A0A087X6V4_POEFO Loading...

T-complex protein 1 subunit epsilon

Component of the chaperonin-containing T-complex (TRiC), a molecular chaperone complex that assists the folding of actin, tubulin and other proteins upon ATP hydrolysis. The TRiC complex mediates the folding of WRAP53/TCAB1, thereby regulating telomere maintenance. As part of the TRiC complex may play a role in the assembly of BBSome, a complex involved in ciliogenesis regulating transports vesicles to the cilia.

AlphaFold DB , UniProt , Accession A0A087X6V4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 541 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	37.4	Very low	61.4	Low	244 Å²	244	109.3 Å²	109.3	100%	1.202	60%	0.597	S	S	*	*				0	130.6	0	-72.3	179.1	-149.9	0	0	107.8	T3	M1-T3 PolarHBondContact O-N 2.68Å
2	S	37.2	Very low	62.7	Low	97 Å²	97	116.3 Å²	116.3	68%	0.678	61%	0.61	S	S	*	*			trans	-60.1	121.7	-178.9	48.4	0	0	0	0	110.8	L4	S2-L4 VanDerWaalsContact C-N 3.33Å; S2-L4 PolarHBondContact O-N 3.31Å
3	T	46.2	Very low	63.8	Low	98 Å²	98	111 Å²	111	60%	0.601	60%	0.602	S	S	*	*			trans	-60	96.5	164.8	27.9	0	0	0	0	108.3	M1 G5	M1-T3 PolarHBondContact O-N 2.68Å; T3-G5 PolarHBondContact O-N 2.88Å
4	L	48	Very low	65	Low	148 Å²	148	115.6 Å²	115.6	78%	0.775	61%	0.606	S	S	*	*			trans	-65	100.5	174.5	-89.9	121.2	0	0	0	108.4	S2	S2-L4 VanDerWaalsContact C-N 3.33Å; S2-L4 PolarHBondContact O-N 3.31Å
5	G	58.5	Low	65.8	Low	30 Å²	30	113.9 Å²	113.9	31%	0.309	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-68.4	132.3	165.1	0	0	0	0	0	109.6	T3 I18	T3-G5 PolarHBondContact O-N 2.88Å; G5-I18 CarbonylContact C-O 3.58Å; G5-I18 VanDerWaalsContact CA-O 3.29Å; G5-I18 WeakPolarHBondContact CA-O 3.33Å
6	T	66.9	Low	66.4	Low	85 Å²	85	113.1 Å²	113.1	52%	0.521	59%	0.594	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.4	124.4	174.7	-43.4	0	0	0	0	108.3	A8 I18	T6-A8 PolarHBondContact O-N 3.17Å; T6-I18 PolarHBondContact N-O 2.9Å; T6-I18 PolarHBondContact O-N 3.49Å
7	L	69.2	Low	67	Low	103 Å²	103	112.9 Å²	112.9	54%	0.539	59%	0.592	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.4	118.2	175.6	-150.1	117.4	0	0	0	108.6	F9 P15 I17	L7-F9 HydrophobicContact CD2-CE1 4.23Å; L7-F9 HydrophobicContact CD2-CE2 3.92Å; L7-F9 HydrophobicContact CD2-CZ 3.55Å; L7-P15 HydrophobicContact CD2-CB 4.19Å; L7-I17 HydrophobicContact CD1-CG1 4.14Å
8	A	74.6	Confident	66.9	Low	24 Å²	24	111.3 Å²	111.3	20%	0.198	58%	0.583	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.2	158.7	178.8	0	0	0	0	0	110.2	T6 P15 F16 I18	T6-A8 PolarHBondContact O-N 3.17Å; A8-P15 WeakPolarHBondContact O-CA 3.32Å; A8-F16 HydrophobicContact CB-CD2 4.46Å; A8-F16 HydrophobicContact CB-CE1 4.33Å; A8-F16 HydrophobicContact CB-CE2 3.99Å; A8-F16 HydrophobicContact CB-CZ 3.91Å; A8-F16 PolarHBondContact N-O 3.45Å; A8-F16 PolarHBondContact O-N 3.3Å; A8-I18 HydrophobicContact CB-CD1 3.68Å; A8-I18 HydrophobicContact CB-CG1 4.11Å
9	F	82.1	Confident	66.9	Low	129 Å²	129	108.9 Å²	108.9	57%	0.566	57%	0.57	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-122.1	139.7	-179.9	-61.5	-90.8	0	0	0	109.5	L7 R14 P15	L7-F9 HydrophobicContact CD2-CE1 4.23Å; L7-F9 HydrophobicContact CD2-CE2 3.92Å; L7-F9 HydrophobicContact CD2-CZ 3.55Å; F9-R14 WeakPolarHBondContact CA-O 3.41Å; F9-P15 HydrophobicContact CD1-CB 4.02Å; F9-P15 HydrophobicContact CE1-CB 3.77Å
10	D	79.2	Confident	66.4	Low	55 Å²	55	111.2 Å²	111.2	29%	0.294	58%	0.576	S	S	.	*			trans	-75.4	173.9	172.4	75.4	0.3	0	0	0	111.5	Y12 G13 R14 F16	D10-Y12 PolarHBondContact O-N 3.4Å; D10-Y12 VanDerWaalsContact OD1-CA 3.24Å; D10-Y12 WeakPolarHBondContact OD1-CA 3.38Å; D10-Y12 WeakPolarHBondContact OD1-CB 3.32Å; D10-Y12 PolarHBondContact OD1-N 3.17Å; D10-G13 PolarHBondContact O-N 3.22Å; D10-G13 PolarHBondContact OD1-N 3.38Å; D10-R14 PolarHBondContact N-O 3.18Å; D10-R14 VanDerWaalsContact N-O 3.12Å; D10-R14 WeakPolarHBondContact OD1-CB 3.26Å; D10-R14 PolarHBondContact OD1-N 3.11Å; D10-F16 HydrophobicContact CB-CE1 4.1Å
11	E	75.7	Confident	65.9	Low	189 Å²	189	110 Å²	110	88%	0.883	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	-13.3	176.9	-64.8	-175.8	163.4	0	0	113.5
12	Y	77.3	Confident	66.7	Low	193 Å²	193	104.4 Å²	104.4	76%	0.757	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	9.9	177.7	-57.8	-81	0	0	0	113	D10 R14	D10-Y12 PolarHBondContact O-N 3.4Å; D10-Y12 VanDerWaalsContact OD1-CA 3.24Å; D10-Y12 WeakPolarHBondContact OD1-CA 3.38Å; D10-Y12 WeakPolarHBondContact OD1-CB 3.32Å; D10-Y12 PolarHBondContact OD1-N 3.17Å; Y12-R14 VanDerWaalsContact C-N 3.34Å; Y12-R14 PolarHBondContact O-N 3.19Å
13	G	77.4	Confident	67.6	Low	48 Å²	48	107.8 Å²	107.8	50%	0.495	55%	0.552	S	S	.	*			trans	74.8	15.1	176.4	0	0	0	0	0	115.2	D10	D10-G13 PolarHBondContact O-N 3.22Å; D10-G13 PolarHBondContact OD1-N 3.38Å
14	R	80.3	Confident	68.2	Low	176 Å²	176	107.2 Å²	107.2	66%	0.664	54%	0.541	S	S	*	.			trans	-81.8	125.8	177.4	-59.9	178.7	177.8	179.9	1.1	110.1	F9 D10 Y12	F9-R14 WeakPolarHBondContact CA-O 3.41Å; D10-R14 PolarHBondContact N-O 3.18Å; D10-R14 VanDerWaalsContact N-O 3.12Å; D10-R14 WeakPolarHBondContact OD1-CB 3.26Å; D10-R14 PolarHBondContact OD1-N 3.11Å; Y12-R14 VanDerWaalsContact C-N 3.34Å; Y12-R14 PolarHBondContact O-N 3.19Å
15	P	76.9	Confident	68.9	Low	90 Å²	90	104.3 Å²	104.3	58%	0.584	52%	0.522	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	132.5	179.3	28.2	-32.1	0	0	0	111.2	L7 A8 F9	L7-P15 HydrophobicContact CD2-CB 4.19Å; A8-P15 WeakPolarHBondContact O-CA 3.32Å; F9-P15 HydrophobicContact CD1-CB 4.02Å; F9-P15 HydrophobicContact CE1-CB 3.77Å
16	F	75.1	Confident	69.4	Low	101 Å²	101	107.1 Å²	107.1	44%	0.443	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	150.5	165.8	64.1	-86.2	0	0	0	110.3	A8 D10 I18	A8-F16 HydrophobicContact CB-CD2 4.46Å; A8-F16 HydrophobicContact CB-CE1 4.33Å; A8-F16 HydrophobicContact CB-CE2 3.99Å; A8-F16 HydrophobicContact CB-CZ 3.91Å; A8-F16 PolarHBondContact N-O 3.45Å; A8-F16 PolarHBondContact O-N 3.3Å; D10-F16 HydrophobicContact CB-CE1 4.1Å; F16-I18 HydrophobicContact CD2-CG1 3.92Å; F16-I18 HydrophobicContact CE2-CD1 3.78Å; F16-I18 HydrophobicContact CE2-CG1 3.6Å; F16-I18 HydrophobicContact CZ-CD1 4.5Å
17	I	76.6	Confident	70	Confident	109 Å²	109	110.2 Å²	110.2	56%	0.559	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.1	117.9	-175	-59.1	174.2	0	0	0	108.3	L7 I19	L7-I17 HydrophobicContact CD1-CG1 4.14Å; I17-I19 HydrophobicContact CG2-CG1 4.09Å
18	I	65.3	Low	70.5	Confident	84 Å²	84	108.9 Å²	108.9	43%	0.431	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	106.4	172.2	-56.3	175.2	0	0	0	107.4	G5 T6 A8 F16 K20	G5-I18 CarbonylContact C-O 3.58Å; G5-I18 VanDerWaalsContact CA-O 3.29Å; G5-I18 WeakPolarHBondContact CA-O 3.33Å; T6-I18 PolarHBondContact N-O 2.9Å; T6-I18 PolarHBondContact O-N 3.49Å; A8-I18 HydrophobicContact CB-CD1 3.68Å; A8-I18 HydrophobicContact CB-CG1 4.11Å; F16-I18 HydrophobicContact CD2-CG1 3.92Å; F16-I18 HydrophobicContact CE2-CD1 3.78Å; F16-I18 HydrophobicContact CE2-CG1 3.6Å; F16-I18 HydrophobicContact CZ-CD1 4.5Å; I18-K20 PolarHBondContact O-N 3.07Å
19	I	66.4	Low	70.9	Confident	66 Å²	66	111.2 Å²	111.2	34%	0.338	54%	0.54	S	S	.	.			trans	-83.8	110.1	173.4	-56.3	176	0	0	0	107.1	I17 D21 Q22	I17-I19 HydrophobicContact CG2-CG1 4.09Å; I19-D21 PolarHBondContact O-N 2.75Å; I19-Q22 PolarHBondContact O-N 3.32Å
20	K	57.8	Low	71	Confident	155 Å²	155	106.5 Å²	106.5	67%	0.674	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	136.8	170.2	-102.6	-178.3	170.9	-175.7	0	109.1	I18	I18-K20 PolarHBondContact O-N 3.07Å
21	D	56.5	Low	71.3	Confident	87 Å²	87	108.3 Å²	108.3	47%	0.465	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	21.8	179.6	-46.3	-44.1	0	0	0	117.4	I19 K25	I19-D21 PolarHBondContact O-N 2.75Å; D21-K25 WeakPolarHBondContact O-CD 3.21Å; D21-K25 WeakPolarHBondContact O-CE 3.29Å; D21-K25 VanDerWaalsContact O-CG 3.31Å; D21-K25 WeakPolarHBondContact O-CG 3.44Å
22	Q	54	Low	71.8	Confident	126 Å²	126	104.6 Å²	104.6	59%	0.589	52%	0.523	S	S	*	.	S	Bend	trans	-69.4	-40.1	170.8	-124.4	179.1	-10	0	0	112.4	I19 K24 K25	I19-Q22 PolarHBondContact O-N 3.32Å; Q22-K24 VanDerWaalsContact C-N 3.3Å; Q22-K24 PolarHBondContact O-N 2.7Å; Q22-K25 PolarHBondContact O-N 3.32Å
23	D	56.5	Low	72.3	Confident	168 Å²	168	95.4 Å²	95.4	90%	0.898	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-26.3	178.9	-70.1	-25.9	0	0	0	113.2	K25	D23-K25 VanDerWaalsContact C-N 3.28Å; D23-K25 PolarHBondContact O-N 2.82Å
24	K	57.6	Low	72.8	Confident	86 Å²	86	93.4 Å²	93.4	37%	0.374	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-5.4	177	-69	-170.7	173.6	-166.9	0	113.2	Q22 G537 E540	Q22-K24 VanDerWaalsContact C-N 3.3Å; Q22-K24 PolarHBondContact O-N 2.7Å; K24-G537 WeakPolarHBondContact O-CA 3.45Å; K24-G537 PolarHBondContact O-N 3.23Å; K24-E540 IonicContact NZ-OE2 3.15Å; K24-E540 PolarHBondContact NZ-OE2 3.27Å
25	K	63.2	Low	73.3	Confident	87 Å²	87	88 Å²	88	38%	0.378	45%	0.446	S	S	.	.			trans	-102	103.1	-178.2	-71.8	172	-168.7	175	0	110.5	D21 Q22 D23 N535	D21-K25 WeakPolarHBondContact O-CD 3.21Å; D21-K25 WeakPolarHBondContact O-CE 3.29Å; D21-K25 VanDerWaalsContact O-CG 3.31Å; D21-K25 WeakPolarHBondContact O-CG 3.44Å; Q22-K25 PolarHBondContact O-N 3.32Å; D23-K25 VanDerWaalsContact C-N 3.28Å; D23-K25 PolarHBondContact O-N 2.82Å; K25-N535 WeakPolarHBondContact CA-O 3.16Å
26	T	69	Low	73.9	Confident	88 Å²	88	85.7 Å²	85.7	54%	0.54	43%	0.432	S	S	.	.			trans	-84.9	131.1	170.6	52.6	0	0	0	0	109.7	N535	T26-N535 PolarHBondContact O-N 3.49Å; T26-N535 VanDerWaalsContact O-N 3.13Å
27	R	78.7	Confident	74.7	Confident	150 Å²	150	81.3 Å²	81.3	57%	0.566	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	124.1	176	-171.4	-175.3	-176.5	-164.4	-3.4	109.4	T29 D532 I533 R534	R27-T29 HydrophobicContact CG-CG2 3.86Å; R27-D532 WeakPolarHBondContact CG-OD1 3.34Å; R27-D532 IonicContact CZ-OD1 3.73Å; R27-D532 IonicContact CZ-OD2 2.76Å; R27-D532 IonicContact NE-OD1 2.75Å; R27-D532 PolarHBondContact NE-OD1 3.07Å; R27-D532 IonicContact NE-OD2 2.78Å; R27-D532 PolarHBondContact NE-OD2 3.41Å; R27-D532 IonicContact NH2-OD1 3.84Å; R27-D532 IonicContact NH2-OD2 2.81Å; R27-D532 PolarHBondContact NH2-OD2 2.97Å; R27-I533 WeakPolarHBondContact CA-O 3.37Å; R27-R534 HydrophobicContact CG-CG 4.31Å
28	L	80.6	Confident	75.5	Confident	76 Å²	76	76.2 Å²	76.2	40%	0.398	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.1	170.2	-69.3	165.4	0	0	0	107.9	A33 I533	L28-A33 HydrophobicContact CB-CB 4.13Å; L28-I533 HydrophobicContact CB-CB 4.32Å; L28-I533 HydrophobicContact CB-CD1 4.22Å; L28-I533 HydrophobicContact CD1-CD1 4.19Å; L28-I533 PolarHBondContact N-O 3.39Å; L28-I533 VanDerWaalsContact N-O 3.14Å; L28-I533 PolarHBondContact O-N 2.71Å
29	T	83	Confident	76.8	Confident	72 Å²	72	79 Å²	79	44%	0.442	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	144.5	-173.8	56.4	0	0	0	0	112.3	R27 D531	R27-T29 HydrophobicContact CG-CG2 3.86Å; T29-D531 CarbonylContact C-O 3.52Å; T29-D531 WeakPolarHBondContact CA-O 3.49Å
30	G	84.9	Confident	78	Confident	30 Å²	30	76.7 Å²	76.7	31%	0.309	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	-131	171.5	0	0	0	0	0	112.7	D32 A33 L34 D531	G30-D32 VanDerWaalsContact C-N 3.34Å; G30-D32 PolarHBondContact O-N 3.43Å; G30-A33 PolarHBondContact O-N 3.43Å; G30-L34 PolarHBondContact O-N 3.41Å; G30-D531 PolarHBondContact N-O 3.25Å
31	I	84.4	Confident	79.7	Confident	94 Å²	94	69.3 Å²	69.3	48%	0.482	36%	0.358	S	S	.	.	H	α-helix	trans	-65.7	-36.8	-172.4	-59.9	173.6	0	0	0	111.5	A33 L34 K35	I31-A33 VanDerWaalsContact C-N 3.32Å; I31-A33 PolarHBondContact O-N 2.85Å; I31-L34 PolarHBondContact O-N 3Å; I31-K35 HydrophobicContact CG2-CD 4.2Å; I31-K35 HydrophobicContact CG2-CG 4.28Å; I31-K35 WeakPolarHBondContact O-CG 3.32Å; I31-K35 PolarHBondContact O-N 3.23Å
32	D	86.4	Confident	81.5	Confident	111 Å²	111	69 Å²	69	59%	0.594	35%	0.353	S	S	*	.	H	α-helix	trans	-66.8	-34.8	-178.5	-64.9	-26	0	0	0	112.2	G30 S36	G30-D32 VanDerWaalsContact C-N 3.34Å; G30-D32 PolarHBondContact O-N 3.43Å; D32-S36 WeakPolarHBondContact O-CB 3.14Å; D32-S36 PolarHBondContact O-N 2.73Å
33	A	87.7	Confident	83.3	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-63.9	-47.1	172.5	0	0	0	0	0	111.1	L28 G30 I31 K35 S36 H37 I533	L28-A33 HydrophobicContact CB-CB 4.13Å; G30-A33 PolarHBondContact O-N 3.43Å; I31-A33 VanDerWaalsContact C-N 3.32Å; I31-A33 PolarHBondContact O-N 2.85Å; A33-K35 PolarHBondContact O-N 2.93Å; A33-S36 WeakPolarHBondContact O-CB 3.35Å; A33-S36 PolarHBondContact O-N 3.36Å; A33-H37 PolarHBondContact O-CD2 3.07Å; A33-H37 PolarHBondContact O-N 3.37Å; A33-I533 HydrophobicContact CB-CD1 3.88Å; A33-I533 HydrophobicContact CB-CG1 4.01Å
34	L	88.4	Confident	85	Confident	5 Å²	5	57.8 Å²	57.8	3%	0.026	30%	0.304	C	S	.	.	H	α-helix	trans	-61.9	-41.3	177.4	-70.9	170.8	0	0	0	112.2	G30 I31 H37 I38 L124 P130 I530	G30-L34 PolarHBondContact O-N 3.41Å; I31-L34 PolarHBondContact O-N 3Å; L34-H37 WeakPolarHBondContact O-CB 3.4Å; L34-H37 PolarHBondContact O-N 3.17Å; L34-I38 VanDerWaalsContact O-CG1 3.24Å; L34-I38 WeakPolarHBondContact O-CG1 3.49Å; L34-I38 PolarHBondContact O-N 2.96Å; L34-L124 HydrophobicContact CB-CD1 4.24Å; L34-L124 HydrophobicContact CD1-CD1 4.25Å; L34-L124 HydrophobicContact CD1-CD2 4.48Å; L34-P130 HydrophobicContact CD1-CB 4.34Å; L34-P130 HydrophobicContact CD1-CG 3.62Å; L34-I530 WeakPolarHBondContact CD2-O 3.26Å
35	K	90	Very high	86.7	Confident	63 Å²	63	54.1 Å²	54.1	27%	0.274	29%	0.29	S	S	.	.	H	α-helix	trans	-63.7	-41.5	175.6	-74.2	-173.9	174.8	-166	0	112.2	I31 A33 H37 I38 M39 D125	I31-K35 HydrophobicContact CG2-CD 4.2Å; I31-K35 HydrophobicContact CG2-CG 4.28Å; I31-K35 WeakPolarHBondContact O-CG 3.32Å; I31-K35 PolarHBondContact O-N 3.23Å; A33-K35 PolarHBondContact O-N 2.93Å; K35-H37 VanDerWaalsContact C-N 3.31Å; K35-H37 PolarHBondContact O-N 3.46Å; K35-I38 PolarHBondContact O-N 3.48Å; K35-M39 WeakPolarHBondContact O-CB 3.37Å; K35-M39 PolarHBondContact O-N 3.2Å; K35-D125 WeakPolarHBondContact CE-OD1 3.26Å; K35-D125 IonicContact NZ-OD1 2.67Å; K35-D125 PolarHBondContact NZ-OD1 3.08Å; K35-D125 IonicContact NZ-OD2 3.84Å
36	S	90.8	Very high	88.1	Confident	42 Å²	42	53.2 Å²	53.2	29%	0.294	29%	0.294	S	S	.	.	H	α-helix	trans	-60.4	-42	174	178.2	0	0	0	0	111.8	D32 A33 M39 A40	D32-S36 WeakPolarHBondContact O-CB 3.14Å; D32-S36 PolarHBondContact O-N 2.73Å; A33-S36 WeakPolarHBondContact O-CB 3.35Å; A33-S36 PolarHBondContact O-N 3.36Å; S36-M39 PolarHBondContact O-N 2.9Å; S36-A40 PolarHBondContact O-N 3.47Å; S36-A40 VanDerWaalsContact O-N 3.13Å
37	H	91.4	Very high	89.1	Confident	9 Å²	9	51.8 Å²	51.8	4%	0.042	29%	0.286	C	S	.	.	H	α-helix	trans	-61.8	-47.7	175.4	-68.5	-18.2	0	0	0	113.2	A33 L34 K35 M39 A40 A41 H85 I87 V527 I530 I533	A33-H37 PolarHBondContact O-CD2 3.07Å; A33-H37 PolarHBondContact O-N 3.37Å; L34-H37 WeakPolarHBondContact O-CB 3.4Å; L34-H37 PolarHBondContact O-N 3.17Å; K35-H37 VanDerWaalsContact C-N 3.31Å; K35-H37 PolarHBondContact O-N 3.46Å; H37-M39 VanDerWaalsContact C-N 3.34Å; H37-M39 PolarHBondContact O-N 2.85Å; H37-A40 PolarHBondContact O-N 3.35Å; H37-A41 PolarHBondContact O-N 3.45Å; H37-A41 VanDerWaalsContact O-N 3.08Å; H37-H85 AromaticContact ND1-CE1 3.36Å; H37-H85 PolarHBondContact ND1-CE1 3.23Å; H37-H85 AromaticContact ND1-NE2 3.69Å; H37-I87 HydrophobicContact CB-CD1 4.39Å; H37-I87 HydrophobicContact CB-CG1 3.75Å; H37-I87 WeakPolarHBondContact ND1-CG1 3.07Å; H37-V527 HydrophobicContact CB-CG1 3.85Å; H37-I530 WeakPolarHBondContact NE2-CG2 3.47Å; H37-I533 WeakPolarHBondContact CE1-CD1 3.14Å; H37-I533 WeakPolarHBondContact CE1-CG1 3.3Å
38	I	92.9	Very high	89.7	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-63.2	-42.2	178.7	-66.9	164	0	0	0	110.3	L34 K35 A40 A41 K42 L117 E121 L124	L34-I38 VanDerWaalsContact O-CG1 3.24Å; L34-I38 WeakPolarHBondContact O-CG1 3.49Å; L34-I38 PolarHBondContact O-N 2.96Å; K35-I38 PolarHBondContact O-N 3.48Å; I38-A40 VanDerWaalsContact C-N 3.34Å; I38-A40 PolarHBondContact O-N 3.32Å; I38-A41 PolarHBondContact O-N 2.91Å; I38-K42 VanDerWaalsContact O-CB 3.26Å; I38-K42 WeakPolarHBondContact O-CB 3.39Å; I38-K42 PolarHBondContact O-N 2.91Å; I38-L117 HydrophobicContact CG1-CB 4.18Å; I38-L117 HydrophobicContact CG1-CD2 4.12Å; I38-L117 HydrophobicContact CG2-CB 4.15Å; I38-L117 WeakPolarHBondContact CG2-O 3.37Å; I38-E121 HydrophobicContact CD1-CB 3.98Å; I38-E121 HydrophobicContact CD1-CG 4.48Å; I38-E121 HydrophobicContact CG2-CB 4.25Å; I38-L124 HydrophobicContact CD1-CD1 3.96Å
39	M	92.9	Very high	90.3	Very high	144 Å²	144	43.7 Å²	43.7	71%	0.709	25%	0.252	S	S	*	.	H	α-helix	trans	-59.2	-44.5	177.5	-172	-177.4	-171.2	0	0	112	K35 S36 H37 K42 A43	K35-M39 WeakPolarHBondContact O-CB 3.37Å; K35-M39 PolarHBondContact O-N 3.2Å; S36-M39 PolarHBondContact O-N 2.9Å; H37-M39 VanDerWaalsContact C-N 3.34Å; H37-M39 PolarHBondContact O-N 2.85Å; M39-K42 PolarHBondContact O-N 3.5Å; M39-A43 PolarHBondContact O-N 3.44Å
40	A	92.3	Very high	90.7	Very high	17 Å²	17	42.8 Å²	42.8	14%	0.14	25%	0.246	C	C	.	.	H	α-helix	trans	-63.4	-46.3	177.3	0	0	0	0	0	111.9	S36 H37 I38 K42 A43 V44 H85	S36-A40 PolarHBondContact O-N 3.47Å; S36-A40 VanDerWaalsContact O-N 3.13Å; H37-A40 PolarHBondContact O-N 3.35Å; I38-A40 VanDerWaalsContact C-N 3.34Å; I38-A40 PolarHBondContact O-N 3.32Å; A40-K42 VanDerWaalsContact C-N 3.35Å; A40-K42 PolarHBondContact O-N 3.25Å; A40-A43 PolarHBondContact O-N 2.94Å; A40-V44 WeakPolarHBondContact O-CG2 3.43Å; A40-V44 PolarHBondContact O-N 3.42Å; A40-H85 HydrophobicContact CB-CB 4.15Å; A40-H85 WeakPolarHBondContact CB-ND1 3.42Å
41	A	93.3	Very high	90.9	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.6	-40.1	177.5	0	0	0	0	0	112.3	H37 I38 V44 A45 I87 M91 L117	H37-A41 PolarHBondContact O-N 3.45Å; H37-A41 VanDerWaalsContact O-N 3.08Å; I38-A41 PolarHBondContact O-N 2.91Å; A41-V44 PolarHBondContact O-N 3.32Å; A41-A45 WeakPolarHBondContact O-CB 3.43Å; A41-A45 PolarHBondContact O-N 3.42Å; A41-I87 HydrophobicContact CB-CG2 4.08Å; A41-M91 HydrophobicContact CB-CG 4.35Å; A41-M91 HydrophobicContact CB-SD 4.29Å; A41-L117 HydrophobicContact CB-CD1 3.39Å
42	K	93.3	Very high	91.2	Very high	80 Å²	80	38 Å²	38	35%	0.348	21%	0.214	S	C	.	.	H	α-helix	trans	-62.6	-41.7	176.9	-173.8	177.8	-172.3	170.8	0	111.8	I38 M39 A40 V44 A45 S46 E118	I38-K42 VanDerWaalsContact O-CB 3.26Å; I38-K42 WeakPolarHBondContact O-CB 3.39Å; I38-K42 PolarHBondContact O-N 2.91Å; M39-K42 PolarHBondContact O-N 3.5Å; A40-K42 VanDerWaalsContact C-N 3.35Å; A40-K42 PolarHBondContact O-N 3.25Å; K42-V44 PolarHBondContact O-N 3.31Å; K42-A45 PolarHBondContact O-N 2.88Å; K42-S46 VanDerWaalsContact O-CB 3.3Å; K42-S46 WeakPolarHBondContact O-CB 3.38Å; K42-S46 PolarHBondContact O-N 3.35Å; K42-S46 PolarHBondContact O-OG 3.29Å; K42-E118 VanDerWaalsContact CE-CD 3.47Å; K42-E118 VanDerWaalsContact CE-OE1 3.24Å; K42-E118 WeakPolarHBondContact CE-OE1 3.49Å; K42-E118 VanDerWaalsContact NZ-CD 3.28Å; K42-E118 IonicContact NZ-OE1 2.65Å; K42-E118 PolarHBondContact NZ-OE1 3.17Å; K42-E118 IonicContact NZ-OE2 3.82Å
43	A	92.1	Very high	91.3	Very high	52 Å²	52	33.5 Å²	33.5	43%	0.43	19%	0.194	S	C	.	.	H	α-helix	trans	-60	-46.2	176.6	0	0	0	0	0	111.5	M39 A40 S46 T47	M39-A43 PolarHBondContact O-N 3.44Å; A40-A43 PolarHBondContact O-N 2.94Å; A43-S46 PolarHBondContact O-N 2.87Å; A43-S46 PolarHBondContact O-OG 3.12Å; A43-T47 PolarHBondContact O-N 3.25Å; A43-T47 PolarHBondContact O-OG1 2.87Å
44	V	92.6	Very high	91.1	Very high	7 Å²	7	35.7 Å²	35.7	4%	0.042	21%	0.208	C	C	.	.	H	α-helix	trans	-61.6	-50.1	176	178.1	0	0	0	0	111.1	A40 A41 K42 S46 T47 L48 L78 A88 M91 V110	A40-V44 WeakPolarHBondContact O-CG2 3.43Å; A40-V44 PolarHBondContact O-N 3.42Å; A41-V44 PolarHBondContact O-N 3.32Å; K42-V44 PolarHBondContact O-N 3.31Å; V44-S46 VanDerWaalsContact C-N 3.33Å; V44-S46 PolarHBondContact O-N 3.4Å; V44-T47 WeakPolarHBondContact O-CB 3.44Å; V44-T47 PolarHBondContact O-N 3.49Å; V44-L48 PolarHBondContact O-N 3.15Å; V44-L78 HydrophobicContact CG1-CD1 4.4Å; V44-L78 HydrophobicContact CG1-CD2 3.39Å; V44-A88 HydrophobicContact CG2-CB 3.56Å; V44-M91 HydrophobicContact CG1-CB 4.2Å; V44-V110 HydrophobicContact CG1-CG1 4.07Å
45	A	93.8	Very high	91.1	Very high	8 Å²	8	38.4 Å²	38.4	7%	0.066	22%	0.223	C	C	.	.	H	α-helix	trans	-60.4	-40.3	179.4	0	0	0	0	0	112.6	A41 K42 T47 L48 K49 V110	A41-A45 WeakPolarHBondContact O-CB 3.43Å; A41-A45 PolarHBondContact O-N 3.42Å; K42-A45 PolarHBondContact O-N 2.88Å; A45-T47 VanDerWaalsContact C-N 3.3Å; A45-T47 PolarHBondContact O-N 3.22Å; A45-L48 PolarHBondContact O-N 3.06Å; A45-K49 WeakPolarHBondContact O-CB 3.47Å; A45-K49 PolarHBondContact O-N 3.25Å; A45-V110 HydrophobicContact CB-CG1 4.49Å
46	S	91.4	Very high	90.8	Very high	68 Å²	68	36 Å²	36	48%	0.476	22%	0.216	S	C	.	.	H	α-helix	trans	-64.5	-33.9	178.1	72.2	0	0	0	0	113	K42 A43 V44	K42-S46 VanDerWaalsContact O-CB 3.3Å; K42-S46 WeakPolarHBondContact O-CB 3.38Å; K42-S46 PolarHBondContact O-N 3.35Å; K42-S46 PolarHBondContact O-OG 3.29Å; A43-S46 PolarHBondContact O-N 2.87Å; A43-S46 PolarHBondContact O-OG 3.12Å; V44-S46 VanDerWaalsContact C-N 3.33Å; V44-S46 PolarHBondContact O-N 3.4Å
47	T	90.7	Very high	90.7	Very high	58 Å²	58	39.5 Å²	39.5	36%	0.356	23%	0.231	S	C	.	.	H	α-helix	trans	-66	-42.7	177.8	-57.8	0	0	0	0	110.6	A43 V44 A45 T50 K59	A43-T47 PolarHBondContact O-N 3.25Å; A43-T47 PolarHBondContact O-OG1 2.87Å; V44-T47 WeakPolarHBondContact O-CB 3.44Å; V44-T47 PolarHBondContact O-N 3.49Å; A45-T47 VanDerWaalsContact C-N 3.3Å; A45-T47 PolarHBondContact O-N 3.22Å; T47-T50 PolarHBondContact O-OG1 2.91Å; T47-K59 WeakPolarHBondContact O-CE 3.5Å
48	L	91.6	Very high	90.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-80.9	-24.1	-179.5	-75.1	-175.5	0	0	0	114.5	V44 A45 T50 S51 I77 L78 T107 V110	V44-L48 PolarHBondContact O-N 3.15Å; A45-L48 PolarHBondContact O-N 3.06Å; L48-T50 PolarHBondContact O-N 3.35Å; L48-T50 VanDerWaalsContact O-N 3.07Å; L48-S51 PolarHBondContact O-N 2.93Å; L48-I77 HydrophobicContact CD2-CB 4.08Å; L48-I77 HydrophobicContact CD2-CD1 3.91Å; L48-I77 HydrophobicContact CD2-CG2 3.87Å; L48-L78 HydrophobicContact CD1-CD1 3.62Å; L48-L78 HydrophobicContact CD1-CD2 3.98Å; L48-L78 HydrophobicContact CD1-CG 3.79Å; L48-L78 HydrophobicContact CG-CD2 4.41Å; L48-T107 HydrophobicContact CB-CG2 4.1Å; L48-T107 WeakPolarHBondContact O-CG2 3.08Å; L48-V110 HydrophobicContact CD1-CB 3.95Å; L48-V110 HydrophobicContact CD1-CG1 3.68Å; L48-V110 HydrophobicContact CD1-CG2 4.26Å
49	K	91.9	Very high	90.3	Very high	57 Å²	57	44.4 Å²	44.4	25%	0.248	26%	0.255	C	S	.	.	H	α-helix	trans	-51.5	-37.4	-178.5	-169.9	-173.6	-178	-157.1	0	112.9	A45 S51 L52 V111 A461 E464 N465	A45-K49 WeakPolarHBondContact O-CB 3.47Å; A45-K49 PolarHBondContact O-N 3.25Å; K49-S51 VanDerWaalsContact C-N 3.26Å; K49-S51 PolarHBondContact O-N 2.85Å; K49-L52 WeakPolarHBondContact O-CB 3.49Å; K49-L52 PolarHBondContact O-N 2.67Å; K49-V111 HydrophobicContact CB-CG2 4.39Å; K49-A461 HydrophobicContact CD-CB 4.24Å; K49-A461 VanDerWaalsContact CE-CB 3.49Å; K49-A461 HydrophobicContact CG-CB 3.67Å; K49-E464 WeakPolarHBondContact CE-OE2 3.2Å; K49-E464 IonicContact NZ-OE2 2.69Å; K49-E464 PolarHBondContact NZ-OE2 3.43Å; K49-N465 PolarHBondContact O-ND2 3.27Å
50	T	91.8	Very high	90.2	Very high	52 Å²	52	43.9 Å²	43.9	32%	0.319	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-8.5	-179.2	52.8	0	0	0	0	114.5	T47 L48 L57 K59	T47-T50 PolarHBondContact O-OG1 2.91Å; L48-T50 PolarHBondContact O-N 3.35Å; L48-T50 VanDerWaalsContact O-N 3.07Å; T50-L57 PolarHBondContact O-N 2.63Å; T50-K59 WeakPolarHBondContact OG1-CE 3.38Å; T50-K59 PolarHBondContact OG1-NZ 3.35Å
51	S	90.2	Very high	90	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.007	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-1.9	174.5	-58.4	0	0	0	0	112.3	L48 K49 L57 K59 N72	L48-S51 PolarHBondContact O-N 2.93Å; K49-S51 VanDerWaalsContact C-N 3.26Å; K49-S51 PolarHBondContact O-N 2.85Å; S51-L57 PolarHBondContact OG-O 3.38Å; S51-K59 VanDerWaalsContact OG-CE 3.31Å; S51-K59 WeakPolarHBondContact OG-CE 3.45Å; S51-N72 PolarHBondContact O-OD1 3.35Å
52	L	90.4	Very high	89.8	Confident	22 Å²	22	49.4 Å²	49.4	12%	0.115	28%	0.282	C	S	.	.			trans	-78.1	129.9	-177.6	-169.7	74.4	0	0	0	112.5	K49 T107 I458 A461 L462 N465	K49-L52 WeakPolarHBondContact O-CB 3.49Å; K49-L52 PolarHBondContact O-N 2.67Å; L52-T107 HydrophobicContact CB-CG2 4.24Å; L52-T107 HydrophobicContact CD1-CG2 4.09Å; L52-I458 HydrophobicContact CD2-CD1 4.15Å; L52-I458 HydrophobicContact CD2-CG2 4.22Å; L52-A461 HydrophobicContact CD2-CB 3.9Å; L52-L462 HydrophobicContact CD2-CD2 4.19Å; L52-L462 HydrophobicContact CD2-CG 4.24Å; L52-L462 HydrophobicContact CG-CD2 3.99Å; L52-N465 PolarHBondContact O-ND2 2.91Å
53	G	87.9	Confident	89.5	Confident	17 Å²	17	50 Å²	50	18%	0.175	29%	0.289	C	S	.	.	S	Bend	trans	95	179.6	171	0	0	0	0	0	114.6	N55 G56 S175 L462	G53-N55 PolarHBondContact O-N 3.22Å; G53-G56 PolarHBondContact O-N 3.15Å; G53-S175 VanDerWaalsContact O-CB 3.31Å; G53-S175 WeakPolarHBondContact O-CB 3.4Å; G53-L462 VanDerWaalsContact CA-CD2 3.41Å
54	P	84.5	Confident	89.2	Confident	46 Å²	46	55.4 Å²	55.4	30%	0.299	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-24.7	-174.7	26.6	-34.7	0	0	0	114	C493 L494	P54-C493 HydrophobicContact CG-CB 3.54Å; P54-L494 HydrophobicContact CB-CD2 4.33Å; P54-L494 HydrophobicContact CG-CD2 4.43Å
55	N	86.6	Confident	89	Confident	63 Å²	63	62.4 Å²	62.4	34%	0.337	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	18.1	174.3	-58.2	-42	0	0	0	112	G53 S466 C493	G53-N55 PolarHBondContact O-N 3.22Å; N55-S466 PolarHBondContact ND2-OG 3.2Å; N55-S466 VanDerWaalsContact ND2-OG 3.13Å; N55-C493 PolarHBondContact ND2-O 3.18Å
56	G	85.5	Confident	88.6	Confident	12 Å²	12	64.2 Å²	64.2	12%	0.124	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-63.5	143.4	174.4	0	0	0	0	0	111.2	G53 N72	G53-G56 PolarHBondContact O-N 3.15Å; G56-N72 PolarHBondContact O-ND2 3.03Å
57	L	86.9	Confident	88.3	Confident	116 Å²	116	65.9 Å²	65.9	61%	0.607	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-92.9	135	179.6	-62.2	173.9	0	0	0	111.1	T50 S51	T50-L57 PolarHBondContact O-N 2.63Å; S51-L57 PolarHBondContact OG-O 3.38Å
58	D	88.1	Confident	88.1	Confident	64 Å²	64	65.9 Å²	65.9	34%	0.342	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-66.5	150.3	174.5	-56.8	-18.2	0	0	0	111.1	V70 N72 V177	D58-V70 HydrophobicContact CB-CG1 3.71Å; D58-N72 WeakPolarHBondContact OD1-CB 3.46Å; D58-N72 PolarHBondContact OD1-ND2 3.16Å; D58-V177 WeakPolarHBondContact OD2-CG2 3.2Å
59	K	89.6	Confident	87.8	Confident	49 Å²	49	67 Å²	67	21%	0.213	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	133.5	174.5	-57.5	-55.3	179.6	-163.8	0	110	T47 T50 S51 M61 V70 T71 I77	T47-K59 WeakPolarHBondContact O-CE 3.5Å; T50-K59 WeakPolarHBondContact OG1-CE 3.38Å; T50-K59 PolarHBondContact OG1-NZ 3.35Å; S51-K59 VanDerWaalsContact OG-CE 3.31Å; S51-K59 WeakPolarHBondContact OG-CE 3.45Å; K59-M61 HydrophobicContact CB-SD 4.48Å; K59-V70 WeakPolarHBondContact O-CA 3.49Å; K59-T71 PolarHBondContact N-O 3.42Å; K59-T71 PolarHBondContact O-N 2.88Å; K59-I77 HydrophobicContact CB-CD1 3.92Å; K59-I77 HydrophobicContact CB-CG1 4.08Å; K59-I77 HydrophobicContact CG-CD1 3.63Å; K59-I77 HydrophobicContact CG-CG1 4.27Å; K59-I77 HydrophobicContact CG-CG2 4.43Å
60	M	89.6	Confident	87.6	Confident	133 Å²	133	66.2 Å²	66.2	66%	0.655	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	113.3	171.6	-176.5	177.8	-69.8	0	0	108.5	V68 V70	M60-V68 HydrophobicContact CG-CG1 3.65Å; M60-V68 HydrophobicContact SD-CG1 4.02Å; M60-V70 HydrophobicContact CB-CG2 4.26Å; M60-V70 HydrophobicContact CE-CG2 3.96Å; M60-V70 HydrophobicContact CG-CG2 4.13Å
61	M	88.3	Confident	87.3	Confident	37 Å²	37	63.8 Å²	63.8	18%	0.182	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	135	176.7	-57.2	-57.8	-72.2	0	0	108.7	K59 V68 T69 I77 M80 M81	K59-M61 HydrophobicContact CB-SD 4.48Å; M61-V68 WeakPolarHBondContact O-CA 2.73Å; M61-T69 PolarHBondContact N-O 3.22Å; M61-T69 PolarHBondContact O-N 3.06Å; M61-I77 HydrophobicContact SD-CG2 4.29Å; M61-M80 HydrophobicContact CB-CB 4.34Å; M61-M80 HydrophobicContact CB-SD 4.01Å; M61-M80 HydrophobicContact CE-CB 4.01Å; M61-M80 HydrophobicContact CG-CB 4.39Å; M61-M80 HydrophobicContact CG-SD 4.37Å; M61-M81 HydrophobicContact CE-CB 4.19Å
62	V	89.4	Confident	87.1	Confident	96 Å²	96	64.1 Å²	64.1	58%	0.582	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	119.6	175.3	-174.5	0	0	0	0	107.2	V68	V62-V68 HydrophobicContact CG2-CG2 4.31Å
63	D	86.1	Confident	86.9	Confident	92 Å²	92	63.5 Å²	63.5	49%	0.492	35%	0.35	S	S	.	.			trans	-73.5	166.9	178.8	-158.8	-1.8	0	0	0	111.4	D65 G66 E67	D63-D65 PolarHBondContact O-N 2.98Å; D63-G66 WeakPolarHBondContact O-CA 3.3Å; D63-G66 PolarHBondContact O-N 2.86Å; D63-E67 PolarHBondContact N-O 3.12Å
64	K	86.3	Confident	86.9	Confident	166 Å²	166	62.7 Å²	62.7	72%	0.722	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-30.1	175.2	-64.4	-179.2	179.9	179.4	0	111.9	G66 D82	K64-G66 VanDerWaalsContact C-N 3.32Å; K64-D82 VanDerWaalsContact CE-OD2 3.29Å; K64-D82 WeakPolarHBondContact CE-OD2 3.36Å; K64-D82 IonicContact NZ-OD2 3.89Å; K64-D82 PolarHBondContact NZ-OD2 3.06Å
65	D	88.1	Confident	87	Confident	153 Å²	153	61 Å²	61	82%	0.818	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-3.7	176.1	-66.2	-30.9	0	0	0	113.7	D63	D63-D65 PolarHBondContact O-N 2.98Å
66	G	85.4	Confident	87.1	Confident	47 Å²	47	58.8 Å²	58.8	49%	0.485	32%	0.32	S	S	.	.			trans	83	7.6	-179.7	0	0	0	0	0	115.1	D63 K64 V68	D63-G66 WeakPolarHBondContact O-CA 3.3Å; D63-G66 PolarHBondContact O-N 2.86Å; K64-G66 VanDerWaalsContact C-N 3.32Å; G66-V68 PolarHBondContact O-N 2.9Å
67	E	85.1	Confident	87.3	Confident	103 Å²	103	58.4 Å²	58.4	48%	0.481	32%	0.315	S	S	.	.			trans	-69	128.1	170.1	-172.2	164.9	-161.9	0	0	109.6	D63 K392	D63-E67 PolarHBondContact N-O 3.12Å; E67-K392 IonicContact OE1-NZ 3.95Å; E67-K392 PolarHBondContact OE1-NZ 2.78Å
68	V	87.3	Confident	87.4	Confident	58 Å²	58	53 Å²	53	35%	0.352	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	121.5	-179.8	-176.7	0	0	0	0	109	M60 M61 V62 G66 V70	M60-V68 HydrophobicContact CG-CG1 3.65Å; M60-V68 HydrophobicContact SD-CG1 4.02Å; M61-V68 WeakPolarHBondContact O-CA 2.73Å; V62-V68 HydrophobicContact CG2-CG2 4.31Å; G66-V68 PolarHBondContact O-N 2.9Å; V68-V70 HydrophobicContact CG1-CG2 4.47Å
69	T	84.9	Confident	87.5	Confident	24 Å²	24	53.9 Å²	53.9	15%	0.147	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	130.5	171.8	-61.1	0	0	0	0	109.2	M61 T71 M80	M61-T69 PolarHBondContact N-O 3.22Å; M61-T69 PolarHBondContact O-N 3.06Å; T69-T71 HydrophobicContact CG2-CG2 4.36Å; T69-M80 HydrophobicContact CG2-CE 3.93Å; T69-M80 HydrophobicContact CG2-SD 4.06Å
70	V	87.9	Confident	87.4	Confident	40 Å²	40	55.2 Å²	55.2	24%	0.242	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	122.3	171.3	-178	0	0	0	0	107.5	D58 K59 M60 V68 M393	D58-V70 HydrophobicContact CB-CG1 3.71Å; K59-V70 WeakPolarHBondContact O-CA 3.49Å; M60-V70 HydrophobicContact CB-CG2 4.26Å; M60-V70 HydrophobicContact CE-CG2 3.96Å; M60-V70 HydrophobicContact CG-CG2 4.13Å; V68-V70 HydrophobicContact CG1-CG2 4.47Å; V70-M393 HydrophobicContact CG2-SD 4.35Å
71	T	86.3	Confident	87.2	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	154.1	-177	-170.1	0	0	0	0	112.1	K59 T69 D73 T76 I77 E397 R400	K59-T71 PolarHBondContact N-O 3.42Å; K59-T71 PolarHBondContact O-N 2.88Å; T69-T71 HydrophobicContact CG2-CG2 4.36Å; T71-D73 PolarHBondContact OG1-N 2.79Å; T71-T76 HydrophobicContact CG2-CG2 3.94Å; T71-I77 HydrophobicContact CG2-CG1 3.77Å; T71-E397 WeakPolarHBondContact CA-OE2 3.38Å; T71-E397 WeakPolarHBondContact CB-OE2 3.48Å; T71-E397 PolarHBondContact OG1-OE2 3.09Å; T71-R400 PolarHBondContact OG1-NH1 3.41Å
72	N	85.6	Confident	87.1	Confident	9 Å²	9	55.8 Å²	55.8	5%	0.048	31%	0.311	C	S	.	.			trans	-97.4	-19.7	173.1	-156.2	-70.2	0	0	0	112.4	S51 G56 D58 G74	S51-N72 PolarHBondContact O-OD1 3.35Å; G56-N72 PolarHBondContact O-ND2 3.03Å; D58-N72 WeakPolarHBondContact OD1-CB 3.46Å; D58-N72 PolarHBondContact OD1-ND2 3.16Å; N72-G74 PolarHBondContact O-N 2.88Å
73	D	86	Confident	86.9	Confident	9 Å²	9	52.1 Å²	52.1	5%	0.048	29%	0.289	C	S	.	.			trans	-69.3	122.8	-172.2	170.1	44.8	0	0	0	112.1	T71 A75 T76 I77 T106	T71-D73 PolarHBondContact OG1-N 2.79Å; D73-A75 VanDerWaalsContact C-N 3.34Å; D73-A75 PolarHBondContact O-N 3.27Å; D73-A75 PolarHBondContact OD1-N 3.32Å; D73-A75 PolarHBondContact OD2-N 2.88Å; D73-T76 PolarHBondContact O-N 2.87Å; D73-T76 VanDerWaalsContact OD2-CB 3.3Å; D73-T76 WeakPolarHBondContact OD2-CB 3.35Å; D73-T76 PolarHBondContact OD2-N 2.98Å; D73-T76 PolarHBondContact OD2-OG1 2.81Å; D73-I77 WeakPolarHBondContact O-CD1 3.32Å; D73-I77 WeakPolarHBondContact O-CG1 3.46Å; D73-I77 PolarHBondContact O-N 3.31Å; D73-T106 PolarHBondContact OD1-OG1 3.25Å
74	G	87.1	Confident	86.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-64.1	-34.4	-177	0	0	0	0	0	113.5	N72 L78 T106 T107	N72-G74 PolarHBondContact O-N 2.88Å; G74-L78 WeakPolarHBondContact O-CB 3.5Å; G74-L78 WeakPolarHBondContact O-CG 3.46Å; G74-L78 PolarHBondContact O-N 2.98Å; G74-L78 VanDerWaalsContact O-N 3.11Å; G74-T106 PolarHBondContact N-OG1 3.4Å; G74-T107 PolarHBondContact N-OG1 2.7Å
75	A	87.6	Confident	87	Confident	9 Å²	9	49.3 Å²	49.3	7%	0.074	28%	0.28	C	S	.	.	H	α-helix	trans	-67.7	-45.8	178.4	0	0	0	0	0	110.8	D73 L78 S79 S95 D99 T106	D73-A75 VanDerWaalsContact C-N 3.34Å; D73-A75 PolarHBondContact O-N 3.27Å; D73-A75 PolarHBondContact OD1-N 3.32Å; D73-A75 PolarHBondContact OD2-N 2.88Å; A75-L78 PolarHBondContact O-N 3.23Å; A75-S79 WeakPolarHBondContact O-CB 3.46Å; A75-S79 PolarHBondContact O-N 3.5Å; A75-S79 PolarHBondContact O-OG 3.34Å; A75-S95 VanDerWaalsContact CA-OG 3.27Å; A75-S95 WeakPolarHBondContact CA-OG 3.48Å; A75-S95 PolarHBondContact N-OG 3.44Å; A75-D99 HydrophobicContact CB-CB 3.92Å; A75-T106 HydrophobicContact CB-CG2 3.84Å
76	T	87.2	Confident	87	Confident	18 Å²	18	48 Å²	48	11%	0.11	27%	0.269	C	S	.	.	H	α-helix	trans	-61.9	-48.8	175.8	-56.7	0	0	0	0	111.7	T71 D73 L78 S79 M80	T71-T76 HydrophobicContact CG2-CG2 3.94Å; D73-T76 PolarHBondContact O-N 2.87Å; D73-T76 VanDerWaalsContact OD2-CB 3.3Å; D73-T76 WeakPolarHBondContact OD2-CB 3.35Å; D73-T76 PolarHBondContact OD2-N 2.98Å; D73-T76 PolarHBondContact OD2-OG1 2.81Å; T76-L78 VanDerWaalsContact C-N 3.29Å; T76-L78 PolarHBondContact O-N 2.87Å; T76-S79 PolarHBondContact O-N 3.04Å; T76-S79 PolarHBondContact O-OG 3.3Å; T76-M80 HydrophobicContact CG2-CE 3.8Å; T76-M80 HydrophobicContact CG2-SD 4.15Å; T76-M80 WeakPolarHBondContact O-CG 3.4Å; T76-M80 PolarHBondContact O-N 2.93Å; T76-M80 VanDerWaalsContact O-N 3.12Å
77	I	90.6	Very high	87.3	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.015	25%	0.246	C	C	.	.	H	α-helix	trans	-55	-47.3	179	-67.8	162.2	0	0	0	110.6	L48 K59 M61 T71 D73 M80 M81	L48-I77 HydrophobicContact CD2-CB 4.08Å; L48-I77 HydrophobicContact CD2-CD1 3.91Å; L48-I77 HydrophobicContact CD2-CG2 3.87Å; K59-I77 HydrophobicContact CB-CD1 3.92Å; K59-I77 HydrophobicContact CB-CG1 4.08Å; K59-I77 HydrophobicContact CG-CD1 3.63Å; K59-I77 HydrophobicContact CG-CG1 4.27Å; K59-I77 HydrophobicContact CG-CG2 4.43Å; M61-I77 HydrophobicContact SD-CG2 4.29Å; T71-I77 HydrophobicContact CG2-CG1 3.77Å; D73-I77 WeakPolarHBondContact O-CD1 3.32Å; D73-I77 WeakPolarHBondContact O-CG1 3.46Å; D73-I77 PolarHBondContact O-N 3.31Å; I77-M80 PolarHBondContact O-N 2.83Å; I77-M81 PolarHBondContact O-N 3.04Å; I77-M81 VanDerWaalsContact O-N 3.13Å
78	L	90	Very high	87.5	Confident	4 Å²	4	41.2 Å²	41.2	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-70.6	-33.4	-178.5	-70.3	179.1	0	0	0	113.3	V44 L48 G74 A75 T76 M80 M81 V92 V110	V44-L78 HydrophobicContact CG1-CD1 4.4Å; V44-L78 HydrophobicContact CG1-CD2 3.39Å; L48-L78 HydrophobicContact CD1-CD1 3.62Å; L48-L78 HydrophobicContact CD1-CD2 3.98Å; L48-L78 HydrophobicContact CD1-CG 3.79Å; L48-L78 HydrophobicContact CG-CD2 4.41Å; G74-L78 WeakPolarHBondContact O-CB 3.5Å; G74-L78 WeakPolarHBondContact O-CG 3.46Å; G74-L78 PolarHBondContact O-N 2.98Å; G74-L78 VanDerWaalsContact O-N 3.11Å; A75-L78 PolarHBondContact O-N 3.23Å; T76-L78 VanDerWaalsContact C-N 3.29Å; T76-L78 PolarHBondContact O-N 2.87Å; L78-M80 VanDerWaalsContact C-N 3.29Å; L78-M80 PolarHBondContact O-N 2.82Å; L78-M81 PolarHBondContact O-N 3.01Å; L78-V92 HydrophobicContact CB-CB 4.25Å; L78-V92 HydrophobicContact CB-CG1 4Å; L78-V92 HydrophobicContact CB-CG2 3.92Å; L78-V110 HydrophobicContact CD1-CG1 4.42Å; L78-V110 HydrophobicContact CD1-CG2 3.81Å
79	S	88.6	Confident	87.7	Confident	81 Å²	81	42.7 Å²	42.7	57%	0.566	23%	0.227	S	C	*	.	H	α-helix	trans	-67.7	-29.7	176.2	73.7	0	0	0	0	113.2	A75 T76	A75-S79 WeakPolarHBondContact O-CB 3.46Å; A75-S79 PolarHBondContact O-N 3.5Å; A75-S79 PolarHBondContact O-OG 3.34Å; T76-S79 PolarHBondContact O-N 3.04Å; T76-S79 PolarHBondContact O-OG 3.3Å
80	M	87.1	Confident	88.1	Confident	78 Å²	78	43.6 Å²	43.6	38%	0.384	23%	0.23	S	C	.	.	H	α-helix	trans	-87.2	-17.1	177.8	-67.6	-176.9	174.8	0	0	112.6	M61 T69 T76 I77 L78 D82	M61-M80 HydrophobicContact CB-CB 4.34Å; M61-M80 HydrophobicContact CB-SD 4.01Å; M61-M80 HydrophobicContact CE-CB 4.01Å; M61-M80 HydrophobicContact CG-CB 4.39Å; M61-M80 HydrophobicContact CG-SD 4.37Å; T69-M80 HydrophobicContact CG2-CE 3.93Å; T69-M80 HydrophobicContact CG2-SD 4.06Å; T76-M80 HydrophobicContact CG2-CE 3.8Å; T76-M80 HydrophobicContact CG2-SD 4.15Å; T76-M80 WeakPolarHBondContact O-CG 3.4Å; T76-M80 PolarHBondContact O-N 2.93Å; T76-M80 VanDerWaalsContact O-N 3.12Å; I77-M80 PolarHBondContact O-N 2.83Å; L78-M80 VanDerWaalsContact C-N 3.29Å; L78-M80 PolarHBondContact O-N 2.82Å; M80-D82 PolarHBondContact O-N 3.42Å
81	M	86.5	Confident	88.3	Confident	72 Å²	72	41.7 Å²	41.7	36%	0.355	22%	0.219	S	C	.	.	S	Bend	trans	-75.6	124.4	178.3	-168.3	174.1	-177.7	0	0	109.6	M61 I77 L78 V83	M61-M81 HydrophobicContact CE-CB 4.19Å; I77-M81 PolarHBondContact O-N 3.04Å; I77-M81 VanDerWaalsContact O-N 3.13Å; L78-M81 PolarHBondContact O-N 3.01Å; M81-V83 HydrophobicContact CB-CG2 4.12Å; M81-V83 HydrophobicContact CG-CG2 3.86Å; M81-V83 PolarHBondContact O-N 2.85Å; M81-V83 HydrophobicContact SD-CG2 4.26Å
82	D	85.6	Confident	88.6	Confident	110 Å²	110	43 Å²	43	59%	0.588	23%	0.227	S	C	*	.			trans	-77.7	112	172.8	-154.4	-4.1	0	0	0	108.9	K64 M80	K64-D82 VanDerWaalsContact CE-OD2 3.29Å; K64-D82 WeakPolarHBondContact CE-OD2 3.36Å; K64-D82 IonicContact NZ-OD2 3.89Å; K64-D82 PolarHBondContact NZ-OD2 3.06Å; M80-D82 PolarHBondContact O-N 3.42Å
83	V	86.3	Confident	88.9	Confident	19 Å²	19	48.2 Å²	48.2	12%	0.115	25%	0.251	C	S	.	.			trans	-120.1	115.9	-171.8	-179	0	0	0	0	110	M81 A88 K89 V92	M81-V83 HydrophobicContact CB-CG2 4.12Å; M81-V83 HydrophobicContact CG-CG2 3.86Å; M81-V83 PolarHBondContact O-N 2.85Å; M81-V83 HydrophobicContact SD-CG2 4.26Å; V83-A88 HydrophobicContact CG1-CB 3.13Å; V83-K89 HydrophobicContact CG1-CG 4.39Å; V83-K89 WeakPolarHBondContact O-CE 3.49Å; V83-V92 HydrophobicContact CG2-CG2 4.42Å
84	D	85.4	Confident	89.3	Confident	141 Å²	141	48 Å²	48	75%	0.754	25%	0.25	S	C	*	.			trans	-78.6	-41.4	178.2	-63.3	-39.6	0	0	0	112.6	Q86	D84-Q86 PolarHBondContact O-N 3.44Å
85	H	87.8	Confident	89.6	Confident	58 Å²	58	48 Å²	48	27%	0.269	25%	0.25	S	C	.	.	S	Bend	trans	-73.9	128.4	-171.1	-167.7	-77.2	0	0	0	112	H37 A40 I87 A88 K89	H37-H85 AromaticContact ND1-CE1 3.36Å; H37-H85 PolarHBondContact ND1-CE1 3.23Å; H37-H85 AromaticContact ND1-NE2 3.69Å; A40-H85 HydrophobicContact CB-CB 4.15Å; A40-H85 WeakPolarHBondContact CB-ND1 3.42Å; H85-I87 VanDerWaalsContact C-N 3.33Å; H85-I87 VanDerWaalsContact CE1-CG1 3.48Å; H85-I87 WeakPolarHBondContact CE1-CG1 3.49Å; H85-I87 PolarHBondContact ND1-N 3.35Å; H85-I87 PolarHBondContact O-N 2.97Å; H85-A88 HydrophobicContact CB-CB 4.39Å; H85-A88 WeakPolarHBondContact O-CB 3.31Å; H85-A88 PolarHBondContact O-N 3.27Å; H85-K89 PolarHBondContact O-N 3.43Å; H85-K89 VanDerWaalsContact O-N 3.11Å
86	Q	88.9	Confident	89.8	Confident	125 Å²	125	53.6 Å²	53.6	58%	0.584	27%	0.272	S	S	*	.	H	α-helix	trans	-59.1	-38.7	-173.3	-61.8	-60.7	-38.1	0	0	113.8	D84 A88 K89 L90	D84-Q86 PolarHBondContact O-N 3.44Å; Q86-A88 VanDerWaalsContact C-N 3.28Å; Q86-A88 PolarHBondContact O-N 3.09Å; Q86-K89 WeakPolarHBondContact O-CB 3.29Å; Q86-K89 PolarHBondContact O-N 3.21Å; Q86-L90 PolarHBondContact O-N 3.37Å
87	I	90.9	Very high	90.1	Very high	3 Å²	3	55.3 Å²	55.3	2%	0.015	29%	0.285	C	S	.	.	H	α-helix	trans	-64.4	-35.7	176.2	-58.6	-58.9	0	0	0	111.8	H37 A41 H85 K89 L90 M91 V527 I530	H37-I87 HydrophobicContact CB-CD1 4.39Å; H37-I87 HydrophobicContact CB-CG1 3.75Å; H37-I87 WeakPolarHBondContact ND1-CG1 3.07Å; A41-I87 HydrophobicContact CB-CG2 4.08Å; H85-I87 VanDerWaalsContact C-N 3.33Å; H85-I87 VanDerWaalsContact CE1-CG1 3.48Å; H85-I87 WeakPolarHBondContact CE1-CG1 3.49Å; H85-I87 PolarHBondContact ND1-N 3.35Å; H85-I87 PolarHBondContact O-N 2.97Å; I87-K89 VanDerWaalsContact C-N 3.33Å; I87-L90 HydrophobicContact CD1-CD1 3.95Å; I87-L90 WeakPolarHBondContact O-CB 3.46Å; I87-L90 PolarHBondContact O-N 3.05Å; I87-M91 WeakPolarHBondContact O-CG 3.37Å; I87-M91 PolarHBondContact O-N 3.46Å; I87-V527 HydrophobicContact CD1-CB 4.47Å; I87-V527 HydrophobicContact CD1-CG1 4.05Å; I87-V527 HydrophobicContact CD1-CG2 4.04Å; I87-V527 HydrophobicContact CG1-CG1 4.48Å; I87-V527 HydrophobicContact CG2-CG1 4.19Å; I87-V527 HydrophobicContact CG2-CG2 3.94Å; I87-I530 HydrophobicContact CD1-CD1 4.05Å
88	A	90.8	Very high	90.2	Very high	4 Å²	4	55.2 Å²	55.2	3%	0.033	29%	0.285	C	S	.	.	H	α-helix	trans	-72.4	-31.6	177.8	0	0	0	0	0	110.7	V44 V83 H85 Q86 M91 V92	V44-A88 HydrophobicContact CG2-CB 3.56Å; V83-A88 HydrophobicContact CG1-CB 3.13Å; H85-A88 HydrophobicContact CB-CB 4.39Å; H85-A88 WeakPolarHBondContact O-CB 3.31Å; H85-A88 PolarHBondContact O-N 3.27Å; Q86-A88 VanDerWaalsContact C-N 3.28Å; Q86-A88 PolarHBondContact O-N 3.09Å; A88-M91 WeakPolarHBondContact O-CB 3.26Å; A88-M91 PolarHBondContact O-N 3.29Å; A88-M91 VanDerWaalsContact O-N 3.13Å; A88-V92 VanDerWaalsContact O-CG2 3.31Å; A88-V92 WeakPolarHBondContact O-CG2 3.46Å; A88-V92 PolarHBondContact O-N 3.13Å
89	K	91.5	Very high	90.3	Very high	90 Å²	90	56.4 Å²	56.4	39%	0.391	29%	0.291	S	S	.	.	H	α-helix	trans	-59.9	-41.8	166	-62.7	-176.4	179.8	-177.8	0	112.4	V83 H85 Q86 I87 M91 V92 E93	V83-K89 HydrophobicContact CG1-CG 4.39Å; V83-K89 WeakPolarHBondContact O-CE 3.49Å; H85-K89 PolarHBondContact O-N 3.43Å; H85-K89 VanDerWaalsContact O-N 3.11Å; Q86-K89 WeakPolarHBondContact O-CB 3.29Å; Q86-K89 PolarHBondContact O-N 3.21Å; I87-K89 VanDerWaalsContact C-N 3.33Å; K89-M91 VanDerWaalsContact C-N 3.28Å; K89-M91 PolarHBondContact O-N 3.17Å; K89-V92 WeakPolarHBondContact O-CB 3.32Å; K89-V92 PolarHBondContact O-N 3.34Å; K89-V92 VanDerWaalsContact O-N 3.08Å; K89-E93 PolarHBondContact O-N 2.78Å
90	L	92.4	Very high	90.3	Very high	42 Å²	42	57.6 Å²	57.6	22%	0.22	29%	0.291	C	S	.	.	H	α-helix	trans	-61	-35.6	172.9	-68.2	174	0	0	0	112.3	Q86 I87 V92 E93 L94	Q86-L90 PolarHBondContact O-N 3.37Å; I87-L90 HydrophobicContact CD1-CD1 3.95Å; I87-L90 WeakPolarHBondContact O-CB 3.46Å; I87-L90 PolarHBondContact O-N 3.05Å; L90-V92 VanDerWaalsContact C-N 3.33Å; L90-E93 PolarHBondContact O-N 2.89Å; L90-L94 WeakPolarHBondContact O-CB 3.4Å; L90-L94 PolarHBondContact O-N 3.27Å
91	M	92.4	Very high	90.3	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-67.5	-33.5	174	-59.3	-64.2	-70.4	0	0	112.1	A41 V44 I87 A88 K89 L94 S95 V110 A113 V523	A41-M91 HydrophobicContact CB-CG 4.35Å; A41-M91 HydrophobicContact CB-SD 4.29Å; V44-M91 HydrophobicContact CG1-CB 4.2Å; I87-M91 WeakPolarHBondContact O-CG 3.37Å; I87-M91 PolarHBondContact O-N 3.46Å; A88-M91 WeakPolarHBondContact O-CB 3.26Å; A88-M91 PolarHBondContact O-N 3.29Å; A88-M91 VanDerWaalsContact O-N 3.13Å; K89-M91 VanDerWaalsContact C-N 3.28Å; K89-M91 PolarHBondContact O-N 3.17Å; M91-L94 HydrophobicContact CE-CD2 4.39Å; M91-L94 WeakPolarHBondContact O-CB 3.37Å; M91-L94 HydrophobicContact SD-CD2 4.34Å; M91-S95 PolarHBondContact O-N 3Å; M91-S95 VanDerWaalsContact O-N 3.12Å; M91-V110 HydrophobicContact CE-CB 4.26Å; M91-V110 HydrophobicContact CE-CG1 3.66Å; M91-V110 WeakPolarHBondContact CE-O 3.25Å; M91-A113 HydrophobicContact CE-CB 3.72Å; M91-A113 HydrophobicContact SD-CB 4.29Å; M91-V523 HydrophobicContact SD-CG1 4.21Å
92	V	92.6	Very high	90.5	Very high	29 Å²	29	56.1 Å²	56.1	18%	0.176	28%	0.283	C	S	.	.	H	α-helix	trans	-64.6	-48	172.3	-176.5	0	0	0	0	110.5	L78 V83 A88 K89 L90 L94 S95 K96	L78-V92 HydrophobicContact CB-CB 4.25Å; L78-V92 HydrophobicContact CB-CG1 4Å; L78-V92 HydrophobicContact CB-CG2 3.92Å; V83-V92 HydrophobicContact CG2-CG2 4.42Å; A88-V92 VanDerWaalsContact O-CG2 3.31Å; A88-V92 WeakPolarHBondContact O-CG2 3.46Å; A88-V92 PolarHBondContact O-N 3.13Å; K89-V92 WeakPolarHBondContact O-CB 3.32Å; K89-V92 PolarHBondContact O-N 3.34Å; K89-V92 VanDerWaalsContact O-N 3.08Å; L90-V92 VanDerWaalsContact C-N 3.33Å; V92-L94 VanDerWaalsContact C-N 3.3Å; V92-L94 PolarHBondContact O-N 3.2Å; V92-S95 PolarHBondContact O-N 3.1Å; V92-K96 PolarHBondContact O-N 2.88Å
93	E	92.4	Very high	90.4	Very high	118 Å²	118	50.9 Å²	50.9	55%	0.551	26%	0.255	S	S	*	.	H	α-helix	trans	-62.5	-36.7	177.4	-70.2	179.1	178.1	0	0	112.5	K89 L90 K96 S97	K89-E93 PolarHBondContact O-N 2.78Å; L90-E93 PolarHBondContact O-N 2.89Å; E93-K96 PolarHBondContact O-N 2.89Å; E93-S97 WeakPolarHBondContact O-CB 3.23Å; E93-S97 PolarHBondContact O-N 3.37Å; E93-S97 PolarHBondContact O-OG 2.82Å
94	L	93.9	Very high	90.4	Very high	5 Å²	5	52 Å²	52	3%	0.026	26%	0.26	C	S	.	.	H	α-helix	trans	-59.3	-49.9	173.6	173.5	58.8	0	0	0	111.7	L90 M91 V92 K96 S97 Q98 V109 A113 L519 V523	L90-L94 WeakPolarHBondContact O-CB 3.4Å; L90-L94 PolarHBondContact O-N 3.27Å; M91-L94 HydrophobicContact CE-CD2 4.39Å; M91-L94 WeakPolarHBondContact O-CB 3.37Å; M91-L94 HydrophobicContact SD-CD2 4.34Å; V92-L94 VanDerWaalsContact C-N 3.3Å; V92-L94 PolarHBondContact O-N 3.2Å; L94-K96 VanDerWaalsContact C-N 3.34Å; L94-S97 PolarHBondContact O-N 2.74Å; L94-Q98 PolarHBondContact O-N 3.35Å; L94-Q98 VanDerWaalsContact O-N 3.13Å; L94-V109 HydrophobicContact CD1-CG2 3.71Å; L94-V109 HydrophobicContact CD2-CG2 4.13Å; L94-V109 HydrophobicContact CG-CG1 4.2Å; L94-V109 HydrophobicContact CG-CG2 3.96Å; L94-A113 HydrophobicContact CD2-CB 3.82Å; L94-L519 HydrophobicContact CD1-CB 3.6Å; L94-L519 HydrophobicContact CD1-CD1 4.47Å; L94-V523 HydrophobicContact CB-CG2 4.1Å; L94-V523 HydrophobicContact CD1-CG2 3.69Å; L94-V523 HydrophobicContact CD2-CB 4.09Å; L94-V523 HydrophobicContact CD2-CG1 4.2Å; L94-V523 HydrophobicContact CD2-CG2 3.98Å; L94-V523 HydrophobicContact CG-CG2 4.12Å
95	S	93.7	Very high	90.5	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.3	-44.1	179.2	-165.5	0	0	0	0	111.2	A75 M91 V92 S97 Q98 D99 T106	A75-S95 VanDerWaalsContact CA-OG 3.27Å; A75-S95 WeakPolarHBondContact CA-OG 3.48Å; A75-S95 PolarHBondContact N-OG 3.44Å; M91-S95 PolarHBondContact O-N 3Å; M91-S95 VanDerWaalsContact O-N 3.12Å; V92-S95 PolarHBondContact O-N 3.1Å; S95-S97 PolarHBondContact O-N 3.5Å; S95-Q98 WeakPolarHBondContact O-CB 3.39Å; S95-Q98 PolarHBondContact O-N 2.8Å; S95-D99 PolarHBondContact O-N 2.87Å; S95-T106 PolarHBondContact OG-O 3.23Å
96	K	92.3	Very high	90.7	Very high	125 Å²	125	43.8 Å²	43.8	54%	0.543	22%	0.223	S	C	.	.	H	α-helix	trans	-63.5	-40.6	177.3	-170.6	175.6	-179	179.1	0	112.8	V92 E93 L94 Q98 D99 D100	V92-K96 PolarHBondContact O-N 2.88Å; E93-K96 PolarHBondContact O-N 2.89Å; L94-K96 VanDerWaalsContact C-N 3.34Å; K96-Q98 VanDerWaalsContact C-N 3.29Å; K96-Q98 PolarHBondContact O-N 2.89Å; K96-D99 WeakPolarHBondContact O-CB 3.39Å; K96-D99 PolarHBondContact O-N 3.35Å; K96-D99 VanDerWaalsContact O-N 3.15Å; K96-D100 PolarHBondContact O-N 2.9Å
97	S	93.4	Very high	90.9	Very high	55 Å²	55	38.4 Å²	38.4	39%	0.385	20%	0.198	S	C	.	.	H	α-helix	trans	-64.5	-35.2	177.4	-57.7	0	0	0	0	112.1	E93 L94 S95 E101	E93-S97 WeakPolarHBondContact O-CB 3.23Å; E93-S97 PolarHBondContact O-N 3.37Å; E93-S97 PolarHBondContact O-OG 2.82Å; L94-S97 PolarHBondContact O-N 2.74Å; S95-S97 PolarHBondContact O-N 3.5Å; S97-E101 WeakPolarHBondContact O-CB 3.36Å; S97-E101 WeakPolarHBondContact O-CG 3.41Å; S97-E101 PolarHBondContact O-N 2.66Å
98	Q	92.8	Very high	90.9	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-68.5	-38.1	173.7	179.4	67.1	27.3	0	0	111.5	L94 S95 K96 I102 G103 D104 V109 L519	L94-Q98 PolarHBondContact O-N 3.35Å; L94-Q98 VanDerWaalsContact O-N 3.13Å; S95-Q98 WeakPolarHBondContact O-CB 3.39Å; S95-Q98 PolarHBondContact O-N 2.8Å; K96-Q98 VanDerWaalsContact C-N 3.29Å; K96-Q98 PolarHBondContact O-N 2.89Å; Q98-I102 WeakPolarHBondContact O-CB 3.43Å; Q98-I102 PolarHBondContact O-N 3.43Å; Q98-G103 PolarHBondContact O-N 2.93Å; Q98-G103 VanDerWaalsContact O-N 3.16Å; Q98-D104 WeakPolarHBondContact CG-O 3.42Å; Q98-D104 PolarHBondContact NE2-O 2.93Å; Q98-V109 HydrophobicContact CB-CG1 3.91Å; Q98-V109 HydrophobicContact CG-CB 4.48Å; Q98-V109 HydrophobicContact CG-CG1 4.07Å; Q98-L519 HydrophobicContact CB-CD1 4.3Å
99	D	91.4	Very high	91.2	Very high	29 Å²	29	38.2 Å²	38.2	16%	0.155	20%	0.197	C	C	.	.	H	α-helix	trans	-64.6	-49.7	176.9	-163.9	40.8	0	0	0	111.9	A75 S95 K96 E101 G103 T106	A75-D99 HydrophobicContact CB-CB 3.92Å; S95-D99 PolarHBondContact O-N 2.87Å; K96-D99 WeakPolarHBondContact O-CB 3.39Å; K96-D99 PolarHBondContact O-N 3.35Å; K96-D99 VanDerWaalsContact O-N 3.15Å; D99-E101 PolarHBondContact O-N 3.17Å; D99-G103 WeakPolarHBondContact O-CA 3.37Å; D99-G103 PolarHBondContact O-N 3.47Å; D99-T106 HydrophobicContact CB-CG2 3.7Å
100	D	89.3	Confident	91.3	Very high	106 Å²	106	33.9 Å²	33.9	57%	0.567	18%	0.179	S	C	*	.	H	α-helix	trans	-62.8	-40.9	-178.7	-69.1	-28.7	0	0	0	112.3	K96	K96-D100 PolarHBondContact O-N 2.9Å
101	E	86.6	Confident	91.5	Very high	114 Å²	114	32.1 Å²	32.1	53%	0.533	17%	0.17	S	C	.	.	H	α-helix	trans	-82.1	-46.7	-176.8	-74.5	-69.7	158.1	0	0	113.5	S97 D99 R410	S97-E101 WeakPolarHBondContact O-CB 3.36Å; S97-E101 WeakPolarHBondContact O-CG 3.41Å; S97-E101 PolarHBondContact O-N 2.66Å; D99-E101 PolarHBondContact O-N 3.17Å; E101-R410 PolarHBondContact O-NH2 3.04Å
102	I	89.9	Confident	91.7	Very high	5 Å²	5	32.3 Å²	32.3	3%	0.026	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-36.1	-171.6	-57.6	-59.8	0	0	0	111.7	Q98 D104 C407 N411 I511 Q515	Q98-I102 WeakPolarHBondContact O-CB 3.43Å; Q98-I102 PolarHBondContact O-N 3.43Å; I102-D104 PolarHBondContact O-N 2.95Å; I102-C407 VanDerWaalsContact O-CB 3.25Å; I102-C407 WeakPolarHBondContact O-CB 3.29Å; I102-N411 WeakPolarHBondContact CG2-ND2 3.46Å; I102-N411 PolarHBondContact O-ND2 2.69Å; I102-I511 HydrophobicContact CD1-CG1 4.1Å; I102-I511 HydrophobicContact CD1-CG2 4.27Å; I102-Q515 HydrophobicContact CD1-CB 4.1Å; I102-Q515 HydrophobicContact CD1-CG 4.34Å; I102-Q515 HydrophobicContact CG1-CB 3.92Å; I102-Q515 HydrophobicContact CG1-CG 3.96Å
103	G	84.6	Confident	91.9	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.162	C	C	.	.	S	Bend	trans	70.4	13.5	-176.3	0	0	0	0	0	115	Q98 D99 D404	Q98-G103 PolarHBondContact O-N 2.93Å; Q98-G103 VanDerWaalsContact O-N 3.16Å; D99-G103 WeakPolarHBondContact O-CA 3.37Å; D99-G103 PolarHBondContact O-N 3.47Å; G103-D404 VanDerWaalsContact O-CA 3.26Å; G103-D404 WeakPolarHBondContact O-CA 3.39Å; G103-D404 WeakPolarHBondContact O-CB 3.36Å; G103-D404 VanDerWaalsContact O-CG 3.27Å
104	D	85.9	Confident	92	Very high	42 Å²	42	25.5 Å²	25.5	23%	0.225	14%	0.138	C	C	.	.	S	Bend	trans	-149.6	159.6	172	-164.6	5.4	0	0	0	109.5	Q98 I102 T172 V408	Q98-D104 WeakPolarHBondContact CG-O 3.42Å; Q98-D104 PolarHBondContact NE2-O 2.93Å; I102-D104 PolarHBondContact O-N 2.95Å; D104-T172 PolarHBondContact OD2-OG1 3.26Å; D104-V408 HydrophobicContact CB-CG2 3.59Å
105	G	87.6	Confident	92.1	Very high	19 Å²	19	25.4 Å²	25.4	20%	0.196	14%	0.138	C	C	.	.			trans	79.1	16.6	180	0	0	0	0	0	114.8	T107 G108 V109 Q516	G105-T107 PolarHBondContact O-N 3.13Å; G105-G108 PolarHBondContact O-N 2.97Å; G105-V109 PolarHBondContact O-N 2.92Å; G105-Q516 PolarHBondContact O-NE2 3.26Å; G105-Q516 VanDerWaalsContact O-NE2 3.1Å
106	T	91.6	Very high	92.3	Very high	7 Å²	7	25.4 Å²	25.4	4%	0.043	14%	0.138	C	C	.	.	H	α-helix	trans	-55	-47.3	177.1	56.7	0	0	0	0	111.7	D73 G74 A75 S95 D99 V109	D73-T106 PolarHBondContact OD1-OG1 3.25Å; G74-T106 PolarHBondContact N-OG1 3.4Å; A75-T106 HydrophobicContact CB-CG2 3.84Å; S95-T106 PolarHBondContact OG-O 3.23Å; D99-T106 HydrophobicContact CB-CG2 3.7Å; T106-V109 VanDerWaalsContact O-CG1 3.26Å; T106-V109 WeakPolarHBondContact O-CG1 3.44Å
107	T	92.3	Very high	92.4	Very high	12 Å²	12	19.5 Å²	19.5	7%	0.074	11%	0.112	C	C	.	.	H	α-helix	trans	-66.5	-44.2	175.7	-53.7	0	0	0	0	111.9	L48 L52 G74 G105 V109 V110 V111	L48-T107 HydrophobicContact CB-CG2 4.1Å; L48-T107 WeakPolarHBondContact O-CG2 3.08Å; L52-T107 HydrophobicContact CB-CG2 4.24Å; L52-T107 HydrophobicContact CD1-CG2 4.09Å; G74-T107 PolarHBondContact N-OG1 2.7Å; G105-T107 PolarHBondContact O-N 3.13Å; T107-V109 PolarHBondContact O-N 2.64Å; T107-V110 PolarHBondContact O-N 3.34Å; T107-V111 HydrophobicContact CG2-CG2 4.48Å; T107-V111 WeakPolarHBondContact O-CG2 3.33Å; T107-V111 PolarHBondContact O-N 3.46Å; T107-V111 VanDerWaalsContact O-N 3.11Å
108	G	92.4	Very high	92.5	Very high	3 Å²	3	20 Å²	20	3%	0.031	11%	0.108	C	C	.	.	H	α-helix	trans	-68.1	-34.6	-174.7	0	0	0	0	0	113.6	G105 V110 V111 L112 Q516	G105-G108 PolarHBondContact O-N 2.97Å; G108-V110 VanDerWaalsContact C-N 3.32Å; G108-V110 PolarHBondContact O-N 2.92Å; G108-V111 PolarHBondContact O-N 2.89Å; G108-L112 WeakPolarHBondContact O-CB 3.42Å; G108-L112 PolarHBondContact O-N 3.22Å; G108-Q516 VanDerWaalsContact CA-NE2 3.27Å
109	V	95.4	Very high	92.6	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-66.2	-37.9	179.1	68.7	0	0	0	0	111.4	L94 Q98 G105 T106 T107 A113 Q516 L519 A520	L94-V109 HydrophobicContact CD1-CG2 3.71Å; L94-V109 HydrophobicContact CD2-CG2 4.13Å; L94-V109 HydrophobicContact CG-CG1 4.2Å; L94-V109 HydrophobicContact CG-CG2 3.96Å; Q98-V109 HydrophobicContact CB-CG1 3.91Å; Q98-V109 HydrophobicContact CG-CB 4.48Å; Q98-V109 HydrophobicContact CG-CG1 4.07Å; G105-V109 PolarHBondContact O-N 2.92Å; T106-V109 VanDerWaalsContact O-CG1 3.26Å; T106-V109 WeakPolarHBondContact O-CG1 3.44Å; T107-V109 PolarHBondContact O-N 2.64Å; V109-A113 WeakPolarHBondContact O-CB 3.31Å; V109-A113 PolarHBondContact O-N 3.49Å; V109-Q516 HydrophobicContact CB-CG 3.95Å; V109-Q516 HydrophobicContact CG2-CG 4.34Å; V109-Q516 VanDerWaalsContact N-NE2 3.13Å; V109-L519 HydrophobicContact CG2-CB 4.14Å; V109-A520 HydrophobicContact CG2-CB 4.1Å
110	V	95.5	Very high	92.7	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-71.2	-42.4	178	172.4	0	0	0	0	111.4	V44 A45 L48 L78 M91 T107 G108 A113 G114	V44-V110 HydrophobicContact CG1-CG1 4.07Å; A45-V110 HydrophobicContact CB-CG1 4.49Å; L48-V110 HydrophobicContact CD1-CB 3.95Å; L48-V110 HydrophobicContact CD1-CG1 3.68Å; L48-V110 HydrophobicContact CD1-CG2 4.26Å; L78-V110 HydrophobicContact CD1-CG1 4.42Å; L78-V110 HydrophobicContact CD1-CG2 3.81Å; M91-V110 HydrophobicContact CE-CB 4.26Å; M91-V110 HydrophobicContact CE-CG1 3.66Å; M91-V110 WeakPolarHBondContact CE-O 3.25Å; T107-V110 PolarHBondContact O-N 3.34Å; G108-V110 VanDerWaalsContact C-N 3.32Å; G108-V110 PolarHBondContact O-N 2.92Å; V110-A113 PolarHBondContact O-N 2.79Å; V110-G114 PolarHBondContact O-N 3.31Å
111	V	95.6	Very high	92.9	Very high	5 Å²	5	17.4 Å²	17.4	3%	0.03	9%	0.092	C	C	.	.	H	α-helix	trans	-63.3	-42.8	176.3	175.4	0	0	0	0	110.9	K49 T107 G108 G114 A115 V457 I458	K49-V111 HydrophobicContact CB-CG2 4.39Å; T107-V111 HydrophobicContact CG2-CG2 4.48Å; T107-V111 WeakPolarHBondContact O-CG2 3.33Å; T107-V111 PolarHBondContact O-N 3.46Å; T107-V111 VanDerWaalsContact O-N 3.11Å; G108-V111 PolarHBondContact O-N 2.89Å; V111-G114 PolarHBondContact O-N 3.39Å; V111-A115 WeakPolarHBondContact O-CB 3.36Å; V111-A115 PolarHBondContact O-N 3.4Å; V111-V457 HydrophobicContact CG1-CG1 4.33Å; V111-I458 HydrophobicContact CB-CD1 3.94Å; V111-I458 HydrophobicContact CG1-CD1 3.73Å
112	L	96.2	Very high	93.2	Very high	4 Å²	4	16 Å²	16	2%	0.021	9%	0.085	C	C	.	.	H	α-helix	trans	-64.6	-45.5	177.4	-179	60.7	0	0	0	111.9	G108 G114 A115 L116 L455 I458 I517 A520	G108-L112 WeakPolarHBondContact O-CB 3.42Å; G108-L112 PolarHBondContact O-N 3.22Å; L112-G114 VanDerWaalsContact C-N 3.34Å; L112-G114 PolarHBondContact O-N 3.23Å; L112-A115 PolarHBondContact O-N 3.14Å; L112-L116 HydrophobicContact CD1-CG 4.45Å; L112-L116 HydrophobicContact CG-CD1 4.25Å; L112-L116 WeakPolarHBondContact O-CG 3.43Å; L112-L116 PolarHBondContact O-N 3.38Å; L112-L455 HydrophobicContact CD1-CD2 3.99Å; L112-L455 HydrophobicContact CD2-CD2 4.49Å; L112-I458 HydrophobicContact CB-CD1 4.45Å; L112-I517 HydrophobicContact CD2-CG1 4.21Å; L112-A520 HydrophobicContact CB-CB 4.22Å; L112-A520 HydrophobicContact CD2-CB 3.89Å; L112-A520 HydrophobicContact CG-CB 3.95Å
113	A	96.3	Very high	93.4	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-62.2	-40.7	176.7	0	0	0	0	0	112.1	M91 L94 V109 V110 L116 L117 A520 V524	M91-A113 HydrophobicContact CE-CB 3.72Å; M91-A113 HydrophobicContact SD-CB 4.29Å; L94-A113 HydrophobicContact CD2-CB 3.82Å; V109-A113 WeakPolarHBondContact O-CB 3.31Å; V109-A113 PolarHBondContact O-N 3.49Å; V110-A113 PolarHBondContact O-N 2.79Å; A113-L116 PolarHBondContact O-N 3.04Å; A113-L117 WeakPolarHBondContact O-CG 3.2Å; A113-L117 PolarHBondContact O-N 3.38Å; A113-L117 VanDerWaalsContact O-N 3.08Å; A113-A520 HydrophobicContact CB-CB 4.03Å; A113-V524 HydrophobicContact CB-CG2 4.34Å
114	G	95.8	Very high	93.8	Very high	3 Å²	3	16.2 Å²	16.2	3%	0.031	9%	0.087	C	C	.	.	H	α-helix	trans	-62.3	-43	173.9	0	0	0	0	0	113	V110 V111 L112 L117 E118	V110-G114 PolarHBondContact O-N 3.31Å; V111-G114 PolarHBondContact O-N 3.39Å; L112-G114 VanDerWaalsContact C-N 3.34Å; L112-G114 PolarHBondContact O-N 3.23Å; G114-L117 PolarHBondContact O-N 3.32Å; G114-E118 PolarHBondContact O-N 3.28Å
115	A	96.1	Very high	94	Very high	4 Å²	4	19 Å²	19	3%	0.033	10%	0.102	C	C	.	.	H	α-helix	trans	-63.7	-42.9	176.4	0	0	0	0	0	112.3	V111 L112 L117 E118 Q119 A454 V457	V111-A115 WeakPolarHBondContact O-CB 3.36Å; V111-A115 PolarHBondContact O-N 3.4Å; L112-A115 PolarHBondContact O-N 3.14Å; A115-L117 VanDerWaalsContact C-N 3.32Å; A115-L117 PolarHBondContact O-N 3.35Å; A115-E118 PolarHBondContact O-N 3.33Å; A115-Q119 WeakPolarHBondContact O-CG 3.28Å; A115-Q119 PolarHBondContact O-N 2.87Å; A115-A454 HydrophobicContact CB-CB 4.04Å; A115-V457 HydrophobicContact CB-CB 3.84Å; A115-V457 HydrophobicContact CB-CG1 4.05Å; A115-V457 HydrophobicContact CB-CG2 3.77Å
116	L	96.5	Very high	94.2	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-62.2	-39	176.7	-75.8	171	0	0	0	112.3	L112 A113 A120 Y137 F451 A454 A520 V524	L112-L116 HydrophobicContact CD1-CG 4.45Å; L112-L116 HydrophobicContact CG-CD1 4.25Å; L112-L116 WeakPolarHBondContact O-CG 3.43Å; L112-L116 PolarHBondContact O-N 3.38Å; A113-L116 PolarHBondContact O-N 3.04Å; L116-A120 WeakPolarHBondContact O-CB 3.29Å; L116-A120 PolarHBondContact O-N 3.47Å; L116-Y137 HydrophobicContact CB-CE2 4.05Å; L116-Y137 HydrophobicContact CD2-CD2 4.19Å; L116-Y137 HydrophobicContact CD2-CE2 3.94Å; L116-Y137 WeakPolarHBondContact O-CE2 3.5Å; L116-Y137 PolarHBondContact O-OH 2.85Å; L116-F451 HydrophobicContact CD1-CD2 4.45Å; L116-F451 HydrophobicContact CD1-CE2 4.08Å; L116-F451 HydrophobicContact CD2-CB 4.34Å; L116-F451 HydrophobicContact CD2-CD2 3.31Å; L116-F451 HydrophobicContact CD2-CE2 3.75Å; L116-F451 HydrophobicContact CD2-CG 3.97Å; L116-A454 HydrophobicContact CD2-CB 3.55Å; L116-A454 HydrophobicContact CG-CB 3.91Å; L116-A520 HydrophobicContact CD1-CB 4.35Å; L116-V524 HydrophobicContact CB-CG1 4.39Å; L116-V524 HydrophobicContact CB-CG2 3.63Å; L116-V524 HydrophobicContact CD1-CG2 4.1Å
117	L	95.6	Very high	94.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-69	-40.3	175.7	-75.3	169.7	0	0	0	112.1	I38 A41 A113 G114 A115 A120 E121 V524 V527	I38-L117 HydrophobicContact CG1-CB 4.18Å; I38-L117 HydrophobicContact CG1-CD2 4.12Å; I38-L117 HydrophobicContact CG2-CB 4.15Å; I38-L117 WeakPolarHBondContact CG2-O 3.37Å; A41-L117 HydrophobicContact CB-CD1 3.39Å; A113-L117 WeakPolarHBondContact O-CG 3.2Å; A113-L117 PolarHBondContact O-N 3.38Å; A113-L117 VanDerWaalsContact O-N 3.08Å; G114-L117 PolarHBondContact O-N 3.32Å; A115-L117 VanDerWaalsContact C-N 3.32Å; A115-L117 PolarHBondContact O-N 3.35Å; L117-A120 WeakPolarHBondContact O-CB 3.49Å; L117-A120 PolarHBondContact O-N 2.98Å; L117-E121 PolarHBondContact O-N 3.49Å; L117-V524 HydrophobicContact CD1-CG2 4.49Å; L117-V524 HydrophobicContact CD2-CB 4.37Å; L117-V524 HydrophobicContact CD2-CG1 3.89Å; L117-V524 HydrophobicContact CD2-CG2 4.27Å; L117-V524 HydrophobicContact CG-CB 4.5Å; L117-V524 HydrophobicContact CG-CG1 4.3Å; L117-V524 HydrophobicContact CG-CG2 3.86Å; L117-V527 HydrophobicContact CD2-CB 4.07Å; L117-V527 HydrophobicContact CD2-CG1 3.91Å
118	E	95.1	Very high	94	Very high	65 Å²	65	29.8 Å²	29.8	30%	0.304	16%	0.157	S	C	.	.	H	α-helix	trans	-62.5	-42.1	174.1	177.5	167.8	-158.3	0	0	111.8	K42 G114 A115 A120 E121	K42-E118 VanDerWaalsContact CE-CD 3.47Å; K42-E118 VanDerWaalsContact CE-OE1 3.24Å; K42-E118 WeakPolarHBondContact CE-OE1 3.49Å; K42-E118 VanDerWaalsContact NZ-CD 3.28Å; K42-E118 IonicContact NZ-OE1 2.65Å; K42-E118 PolarHBondContact NZ-OE1 3.17Å; K42-E118 IonicContact NZ-OE2 3.82Å; G114-E118 PolarHBondContact O-N 3.28Å; A115-E118 PolarHBondContact O-N 3.33Å; E118-A120 VanDerWaalsContact C-N 3.32Å; E118-E121 WeakPolarHBondContact O-CB 3.2Å; E118-E121 PolarHBondContact O-N 3.15Å
119	Q	94.9	Very high	94	Very high	28 Å²	28	34.9 Å²	34.9	13%	0.131	18%	0.18	C	C	.	.	H	α-helix	trans	-68.2	-34.1	174.7	-66.9	-62.8	-19.6	0	0	112	A115 E121 Q122 L123 A454	A115-Q119 WeakPolarHBondContact O-CG 3.28Å; A115-Q119 PolarHBondContact O-N 2.87Å; Q119-E121 VanDerWaalsContact C-N 3.33Å; Q119-E121 PolarHBondContact O-N 3.32Å; Q119-Q122 PolarHBondContact O-N 2.9Å; Q119-L123 PolarHBondContact O-N 3.17Å; Q119-A454 HydrophobicContact CG-CB 4.08Å
120	A	94.1	Very high	93.8	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.7	-37.2	175	0	0	0	0	0	111.7	L116 L117 E118 Q122 L123 L124 I133 Y137 L528	L116-A120 WeakPolarHBondContact O-CB 3.29Å; L116-A120 PolarHBondContact O-N 3.47Å; L117-A120 WeakPolarHBondContact O-CB 3.49Å; L117-A120 PolarHBondContact O-N 2.98Å; E118-A120 VanDerWaalsContact C-N 3.32Å; A120-Q122 VanDerWaalsContact C-N 3.29Å; A120-Q122 PolarHBondContact O-N 2.92Å; A120-L123 WeakPolarHBondContact O-CB 3.35Å; A120-L123 PolarHBondContact O-N 2.82Å; A120-L123 VanDerWaalsContact O-N 3.09Å; A120-L124 VanDerWaalsContact O-CG 3.29Å; A120-L124 WeakPolarHBondContact O-CG 3.05Å; A120-L124 PolarHBondContact O-N 3.1Å; A120-I133 HydrophobicContact CB-CG2 4.14Å; A120-Y137 HydrophobicContact CB-CE2 4.35Å; A120-Y137 PolarHBondContact N-OH 2.82Å; A120-L528 HydrophobicContact CB-CD1 4.27Å; A120-L528 HydrophobicContact CB-CD2 4.11Å
121	E	93.7	Very high	93.6	Very high	54 Å²	54	40.7 Å²	40.7	25%	0.252	21%	0.211	S	C	.	.	H	α-helix	trans	-54.4	-45.6	174.9	-168.5	177.2	-167	0	0	111.9	I38 L117 E118 Q119 L123 L124 D125	I38-E121 HydrophobicContact CD1-CB 3.98Å; I38-E121 HydrophobicContact CD1-CG 4.48Å; I38-E121 HydrophobicContact CG2-CB 4.25Å; L117-E121 PolarHBondContact O-N 3.49Å; E118-E121 WeakPolarHBondContact O-CB 3.2Å; E118-E121 PolarHBondContact O-N 3.15Å; Q119-E121 VanDerWaalsContact C-N 3.33Å; Q119-E121 PolarHBondContact O-N 3.32Å; E121-L123 VanDerWaalsContact C-N 3.28Å; E121-L123 PolarHBondContact O-N 3.43Å; E121-L124 WeakPolarHBondContact O-CB 3.32Å; E121-L124 PolarHBondContact O-N 3.36Å; E121-D125 PolarHBondContact O-N 3.24Å
122	Q	93.3	Very high	93.4	Very high	84 Å²	84	47.1 Å²	47.1	39%	0.393	24%	0.235	S	C	.	.	H	α-helix	trans	-63.7	-34.1	178.9	-58.4	-176.5	20	0	0	112.5	Q119 A120 R126	Q119-Q122 PolarHBondContact O-N 2.9Å; A120-Q122 VanDerWaalsContact C-N 3.29Å; A120-Q122 PolarHBondContact O-N 2.92Å; Q122-R126 WeakPolarHBondContact O-CG 3.38Å; Q122-R126 PolarHBondContact O-N 3.15Å
123	L	92.9	Very high	93.3	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-74.8	-36.2	176.4	-63.4	179.7	0	0	0	111.9	Q119 A120 E121 D125 R126 G127 I128 I133 A447	Q119-L123 PolarHBondContact O-N 3.17Å; A120-L123 WeakPolarHBondContact O-CB 3.35Å; A120-L123 PolarHBondContact O-N 2.82Å; A120-L123 VanDerWaalsContact O-N 3.09Å; E121-L123 VanDerWaalsContact C-N 3.28Å; E121-L123 PolarHBondContact O-N 3.43Å; L123-D125 VanDerWaalsContact C-N 3.34Å; L123-R126 PolarHBondContact O-N 3.33Å; L123-G127 PolarHBondContact O-N 3.09Å; L123-I128 HydrophobicContact CB-CB 4.46Å; L123-I128 HydrophobicContact CB-CD1 4.21Å; L123-I128 HydrophobicContact CD2-CD1 3.93Å; L123-I128 WeakPolarHBondContact O-CB 3.48Å; L123-I128 PolarHBondContact O-N 3.17Å; L123-I128 VanDerWaalsContact O-N 3.09Å; L123-I133 HydrophobicContact CB-CD1 3.6Å; L123-I133 HydrophobicContact CB-CG1 4.13Å; L123-I133 HydrophobicContact CD1-CD1 4.32Å; L123-I133 HydrophobicContact CD1-CG1 4.08Å; L123-I133 HydrophobicContact CD1-CG2 3.99Å; L123-A447 HydrophobicContact CD1-CB 4.33Å
124	L	92.3	Very high	93.1	Very high	9 Å²	9	47.3 Å²	47.3	5%	0.047	24%	0.237	C	C	.	.	H	α-helix	trans	-63.2	-41.3	173.7	-67.7	173.3	0	0	0	111	L34 I38 A120 E121 R126 G127 P130 I133 L528	L34-L124 HydrophobicContact CB-CD1 4.24Å; L34-L124 HydrophobicContact CD1-CD1 4.25Å; L34-L124 HydrophobicContact CD1-CD2 4.48Å; I38-L124 HydrophobicContact CD1-CD1 3.96Å; A120-L124 VanDerWaalsContact O-CG 3.29Å; A120-L124 WeakPolarHBondContact O-CG 3.05Å; A120-L124 PolarHBondContact O-N 3.1Å; E121-L124 WeakPolarHBondContact O-CB 3.32Å; E121-L124 PolarHBondContact O-N 3.36Å; L124-R126 PolarHBondContact O-N 2.95Å; L124-G127 WeakPolarHBondContact O-CA 3.3Å; L124-G127 PolarHBondContact O-N 3.21Å; L124-P130 HydrophobicContact CD2-CB 4.2Å; L124-P130 HydrophobicContact CD2-CG 3.62Å; L124-I133 HydrophobicContact CD2-CD1 3.81Å; L124-I133 HydrophobicContact CG-CD1 4.04Å; L124-L528 HydrophobicContact CD1-CD2 4.41Å
125	D	91.4	Very high	93	Very high	101 Å²	101	49.9 Å²	49.9	54%	0.54	25%	0.25	S	C	.	.	H	α-helix	trans	-63.9	-28	175.5	-78.5	-17.4	0	0	0	113	K35 E121 L123 G127	K35-D125 WeakPolarHBondContact CE-OD1 3.26Å; K35-D125 IonicContact NZ-OD1 2.67Å; K35-D125 PolarHBondContact NZ-OD1 3.08Å; K35-D125 IonicContact NZ-OD2 3.84Å; E121-D125 PolarHBondContact O-N 3.24Å; L123-D125 VanDerWaalsContact C-N 3.34Å; D125-G127 PolarHBondContact O-N 2.69Å
126	R	90.7	Very high	92.8	Very high	170 Å²	170	49.7 Å²	49.7	64%	0.642	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79	-0.4	171.5	-67.6	176.3	-172.9	-171.7	5.8	113.4	Q122 L123 L124	Q122-R126 WeakPolarHBondContact O-CG 3.38Å; Q122-R126 PolarHBondContact O-N 3.15Å; L123-R126 PolarHBondContact O-N 3.33Å; L124-R126 PolarHBondContact O-N 2.95Å
127	G	89.2	Confident	92.8	Very high	68 Å²	68	49.8 Å²	49.8	70%	0.701	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.7	17.1	178.1	0	0	0	0	0	114.7	L123 L124 D125	L123-G127 PolarHBondContact O-N 3.09Å; L124-G127 WeakPolarHBondContact O-CA 3.3Å; L124-G127 PolarHBondContact O-N 3.21Å; D125-G127 PolarHBondContact O-N 2.69Å
128	I	91.6	Very high	92.7	Very high	26 Å²	26	50.9 Å²	50.9	13%	0.133	25%	0.254	C	S	.	.			trans	-78.4	133.1	176.2	-55.7	179.9	0	0	0	109.3	L123 R132 I133 Y446	L123-I128 HydrophobicContact CB-CB 4.46Å; L123-I128 HydrophobicContact CB-CD1 4.21Å; L123-I128 HydrophobicContact CD2-CD1 3.93Å; L123-I128 WeakPolarHBondContact O-CB 3.48Å; L123-I128 PolarHBondContact O-N 3.17Å; L123-I128 VanDerWaalsContact O-N 3.09Å; I128-R132 HydrophobicContact CG2-CB 4.35Å; I128-I133 HydrophobicContact CB-CD1 4.37Å; I128-I133 HydrophobicContact CB-CG1 4.31Å; I128-I133 HydrophobicContact CG2-CD1 4.31Å; I128-I133 HydrophobicContact CG2-CG1 3.74Å; I128-Y446 HydrophobicContact CD1-CG 4.4Å
129	H	91.3	Very high	92.7	Very high	110 Å²	110	51 Å²	51	51%	0.509	26%	0.255	S	S	.	.			trans	-66.7	134.9	-178.2	-166.9	-78.8	0	0	0	112	I131 R132 I133	H129-I131 VanDerWaalsContact C-N 3.3Å; H129-I131 PolarHBondContact ND1-N 3.22Å; H129-I131 PolarHBondContact O-N 3.15Å; H129-I131 VanDerWaalsContact O-N 3.15Å; H129-R132 HydrophobicContact CB-CG 4.34Å; H129-R132 WeakPolarHBondContact O-CB 3.27Å; H129-R132 PolarHBondContact O-N 3.04Å; H129-I133 PolarHBondContact O-N 2.97Å
130	P	92	Very high	92.7	Very high	24 Å²	24	49.7 Å²	49.7	16%	0.156	25%	0.249	C	C	.	.	H	α-helix	trans	-51.5	-42.1	-177.1	-23	24.6	0	0	0	114.6	L34 L124 R132 I133 S134 L528	L34-P130 HydrophobicContact CD1-CB 4.34Å; L34-P130 HydrophobicContact CD1-CG 3.62Å; L124-P130 HydrophobicContact CD2-CB 4.2Å; L124-P130 HydrophobicContact CD2-CG 3.62Å; P130-R132 VanDerWaalsContact C-N 3.32Å; P130-R132 PolarHBondContact O-N 3.28Å; P130-I133 WeakPolarHBondContact O-CB 3.3Å; P130-I133 PolarHBondContact O-N 2.88Å; P130-S134 PolarHBondContact O-N 2.83Å; P130-L528 HydrophobicContact CB-CB 4.28Å; P130-L528 WeakPolarHBondContact CB-O 2.99Å
131	I	91.4	Very high	92.8	Very high	97 Å²	97	49.9 Å²	49.9	50%	0.497	25%	0.251	S	S	.	.	H	α-helix	trans	-60.1	-40	177.9	-60.5	173.9	0	0	0	111.9	H129 I133 S134 D135	H129-I131 VanDerWaalsContact C-N 3.3Å; H129-I131 PolarHBondContact ND1-N 3.22Å; H129-I131 PolarHBondContact O-N 3.15Å; H129-I131 VanDerWaalsContact O-N 3.15Å; I131-I133 VanDerWaalsContact C-N 3.32Å; I131-I133 PolarHBondContact O-N 2.74Å; I131-S134 WeakPolarHBondContact O-CB 3.14Å; I131-S134 PolarHBondContact O-N 3.47Å; I131-D135 PolarHBondContact O-N 2.93Å
132	R	91.4	Very high	92.8	Very high	140 Å²	140	55.4 Å²	55.4	53%	0.528	27%	0.269	S	S	.	.	H	α-helix	trans	-69.2	-33.8	178.7	-67.5	-65.1	-171.4	171	-1.1	111.9	I128 H129 P130 G136	I128-R132 HydrophobicContact CG2-CB 4.35Å; H129-R132 HydrophobicContact CB-CG 4.34Å; H129-R132 WeakPolarHBondContact O-CB 3.27Å; H129-R132 PolarHBondContact O-N 3.04Å; P130-R132 VanDerWaalsContact C-N 3.32Å; P130-R132 PolarHBondContact O-N 3.28Å; R132-G136 PolarHBondContact O-N 2.8Å; R132-G136 VanDerWaalsContact O-N 3.07Å
133	I	93.6	Very high	92.9	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.7	-47.7	172.5	-58.7	169.4	0	0	0	109.3	A120 L123 L124 I128 H129 P130 I131 D135 G136 Y137 L528	A120-I133 HydrophobicContact CB-CG2 4.14Å; L123-I133 HydrophobicContact CB-CD1 3.6Å; L123-I133 HydrophobicContact CB-CG1 4.13Å; L123-I133 HydrophobicContact CD1-CD1 4.32Å; L123-I133 HydrophobicContact CD1-CG1 4.08Å; L123-I133 HydrophobicContact CD1-CG2 3.99Å; L124-I133 HydrophobicContact CD2-CD1 3.81Å; L124-I133 HydrophobicContact CG-CD1 4.04Å; I128-I133 HydrophobicContact CB-CD1 4.37Å; I128-I133 HydrophobicContact CB-CG1 4.31Å; I128-I133 HydrophobicContact CG2-CD1 4.31Å; I128-I133 HydrophobicContact CG2-CG1 3.74Å; H129-I133 PolarHBondContact O-N 2.97Å; P130-I133 WeakPolarHBondContact O-CB 3.3Å; P130-I133 PolarHBondContact O-N 2.88Å; I131-I133 VanDerWaalsContact C-N 3.32Å; I131-I133 PolarHBondContact O-N 2.74Å; I133-D135 PolarHBondContact O-N 3.04Å; I133-G136 PolarHBondContact O-N 3.37Å; I133-Y137 HydrophobicContact CG2-CD1 4.25Å; I133-Y137 HydrophobicContact CG2-CD2 4.27Å; I133-Y137 HydrophobicContact CG2-CE1 3.9Å; I133-Y137 HydrophobicContact CG2-CE2 3.93Å; I133-Y137 HydrophobicContact CG2-CG 4.43Å; I133-Y137 PolarHBondContact O-N 3.17Å; I133-L528 HydrophobicContact CB-CD1 4.39Å; I133-L528 HydrophobicContact CG2-CD1 4.09Å
134	S	93.2	Very high	93	Very high	9 Å²	9	53.6 Å²	53.6	6%	0.063	26%	0.262	C	S	.	.	H	α-helix	trans	-58.2	-45	177	178.1	0	0	0	0	112.7	P130 I131 G136 Y137 D138 K525	P130-S134 PolarHBondContact O-N 2.83Å; I131-S134 WeakPolarHBondContact O-CB 3.14Å; I131-S134 PolarHBondContact O-N 3.47Å; S134-G136 VanDerWaalsContact C-N 3.34Å; S134-Y137 PolarHBondContact O-N 2.97Å; S134-D138 PolarHBondContact O-N 2.73Å; S134-K525 WeakPolarHBondContact OG-CB 2.85Å; S134-K525 WeakPolarHBondContact OG-CD 3.44Å; S134-K525 WeakPolarHBondContact OG-CG 3.4Å
135	D	92.1	Very high	93.2	Very high	57 Å²	57	54.6 Å²	54.6	31%	0.305	27%	0.267	S	S	.	.	H	α-helix	trans	-65	-40.2	179.7	-68.5	-26.4	0	0	0	111.2	I131 I133 D138 Q139	I131-D135 PolarHBondContact O-N 2.93Å; I133-D135 PolarHBondContact O-N 3.04Å; D135-D138 PolarHBondContact O-N 3.02Å; D135-Q139 WeakPolarHBondContact O-CG 3.09Å; D135-Q139 PolarHBondContact O-N 2.88Å; D135-Q139 VanDerWaalsContact O-N 3.14Å
136	G	93.6	Very high	93.4	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-66.2	-38.2	175.1	0	0	0	0	0	113.3	R132 I133 S134 Q139 A140	R132-G136 PolarHBondContact O-N 2.8Å; R132-G136 VanDerWaalsContact O-N 3.07Å; I133-G136 PolarHBondContact O-N 3.37Å; S134-G136 VanDerWaalsContact C-N 3.34Å; G136-Q139 PolarHBondContact O-N 3.05Å; G136-A140 WeakPolarHBondContact O-CB 3.43Å; G136-A140 PolarHBondContact O-N 2.83Å
137	Y	95.5	Very high	93.5	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.008	24%	0.237	C	C	.	.	H	α-helix	trans	-66.1	-40.8	174.2	-75.8	3.9	0	0	0	112	L116 A120 I133 S134 Q139 A140 A141 A447 F451 V524	L116-Y137 HydrophobicContact CB-CE2 4.05Å; L116-Y137 HydrophobicContact CD2-CD2 4.19Å; L116-Y137 HydrophobicContact CD2-CE2 3.94Å; L116-Y137 WeakPolarHBondContact O-CE2 3.5Å; L116-Y137 PolarHBondContact O-OH 2.85Å; A120-Y137 HydrophobicContact CB-CE2 4.35Å; A120-Y137 PolarHBondContact N-OH 2.82Å; I133-Y137 HydrophobicContact CG2-CD1 4.25Å; I133-Y137 HydrophobicContact CG2-CD2 4.27Å; I133-Y137 HydrophobicContact CG2-CE1 3.9Å; I133-Y137 HydrophobicContact CG2-CE2 3.93Å; I133-Y137 HydrophobicContact CG2-CG 4.43Å; I133-Y137 PolarHBondContact O-N 3.17Å; S134-Y137 PolarHBondContact O-N 2.97Å; Y137-Q139 VanDerWaalsContact C-N 3.31Å; Y137-Q139 PolarHBondContact O-N 2.95Å; Y137-A140 PolarHBondContact O-N 3.48Å; Y137-A141 WeakPolarHBondContact O-CB 3.46Å; Y137-A141 PolarHBondContact O-N 3.34Å; Y137-A447 HydrophobicContact CD1-CB 4.07Å; Y137-A447 WeakPolarHBondContact CD1-O 3.36Å; Y137-A447 HydrophobicContact CE1-CB 4.2Å; Y137-A447 WeakPolarHBondContact CE1-O 3.27Å; Y137-F451 HydrophobicContact CD1-CB 3.97Å; Y137-F451 HydrophobicContact CD1-CD2 4.05Å; Y137-F451 HydrophobicContact CE1-CB 4.13Å; Y137-F451 HydrophobicContact CG-CD2 4.01Å; Y137-V524 HydrophobicContact CD2-CG1 3.87Å; Y137-V524 HydrophobicContact CE2-CG1 3.89Å
138	D	94.4	Very high	93.7	Very high	23 Å²	23	43.3 Å²	43.3	12%	0.123	20%	0.204	C	C	.	.	H	α-helix	trans	-61.1	-39.7	175.2	-85.1	-27.1	0	0	0	111.7	S134 D135 R142 Q522 K525	S134-D138 PolarHBondContact O-N 2.73Å; D135-D138 PolarHBondContact O-N 3.02Å; D138-R142 WeakPolarHBondContact O-CG 3.27Å; D138-R142 PolarHBondContact O-N 3.03Å; D138-Q522 PolarHBondContact OD1-NE2 2.87Å; D138-K525 IonicContact OD2-NZ 3.91Å; D138-K525 PolarHBondContact OD2-NZ 2.84Å
139	Q	93.6	Very high	93.7	Very high	67 Å²	67	44.7 Å²	44.7	31%	0.313	21%	0.211	S	C	.	.	H	α-helix	trans	-66.8	-45.5	175.1	-69.1	-179.7	27.5	0	0	111.9	D135 G136 Y137 A141 R142 I143 E444	D135-Q139 WeakPolarHBondContact O-CG 3.09Å; D135-Q139 PolarHBondContact O-N 2.88Å; D135-Q139 VanDerWaalsContact O-N 3.14Å; G136-Q139 PolarHBondContact O-N 3.05Å; Y137-Q139 VanDerWaalsContact C-N 3.31Å; Y137-Q139 PolarHBondContact O-N 2.95Å; Q139-A141 VanDerWaalsContact C-N 3.35Å; Q139-A141 PolarHBondContact O-N 2.89Å; Q139-R142 PolarHBondContact O-N 3.22Å; Q139-I143 WeakPolarHBondContact O-CG1 3.36Å; Q139-I143 PolarHBondContact O-N 2.92Å; Q139-E444 VanDerWaalsContact NE2-CD 3.29Å; Q139-E444 PolarHBondContact NE2-OE2 3.04Å; Q139-E444 PolarHBondContact OE1-OE2 3.18Å
140	A	95.1	Very high	93.7	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61	-42.7	177.5	0	0	0	0	0	112.1	G136 Y137 R142 I143 A144 V433 M448 F451	G136-A140 WeakPolarHBondContact O-CB 3.43Å; G136-A140 PolarHBondContact O-N 2.83Å; Y137-A140 PolarHBondContact O-N 3.48Å; A140-R142 PolarHBondContact O-N 2.92Å; A140-I143 PolarHBondContact O-N 3.42Å; A140-A144 PolarHBondContact O-N 3.1Å; A140-V433 HydrophobicContact CB-CG1 3.84Å; A140-M448 HydrophobicContact CB-CB 4.47Å; A140-M448 HydrophobicContact CB-CG 4.22Å; A140-F451 HydrophobicContact CB-CB 3.75Å; A140-F451 HydrophobicContact CB-CD1 3.6Å; A140-F451 HydrophobicContact CB-CD2 4.03Å; A140-F451 HydrophobicContact CB-CE1 4.16Å; A140-F451 HydrophobicContact CB-CG 3.52Å
141	A	95.6	Very high	93.5	Very high	5 Å²	5	48.9 Å²	48.9	4%	0.041	23%	0.227	C	C	.	.	H	α-helix	trans	-61.2	-41.2	177.6	0	0	0	0	0	112.2	Y137 Q139 A144 I145 F451 I517 T521	Y137-A141 WeakPolarHBondContact O-CB 3.46Å; Y137-A141 PolarHBondContact O-N 3.34Å; Q139-A141 VanDerWaalsContact C-N 3.35Å; Q139-A141 PolarHBondContact O-N 2.89Å; A141-A144 PolarHBondContact O-N 3.17Å; A141-I145 WeakPolarHBondContact O-CB 3.39Å; A141-I145 VanDerWaalsContact O-CG1 3.25Å; A141-I145 WeakPolarHBondContact O-CG1 3.48Å; A141-I145 PolarHBondContact O-N 3.38Å; A141-F451 HydrophobicContact CB-CE2 4.16Å; A141-F451 HydrophobicContact CB-CZ 3.92Å; A141-I517 HydrophobicContact CB-CG2 4.11Å; A141-T521 HydrophobicContact CB-CG2 4Å
142	R	95.6	Very high	93.4	Very high	170 Å²	170	45.3 Å²	45.3	64%	0.642	21%	0.211	S	C	*	.	H	α-helix	trans	-60.9	-45.7	175	-71.4	172.8	-172.1	178.6	3.7	111.8	D138 Q139 A140 A144 I145 D146	D138-R142 WeakPolarHBondContact O-CG 3.27Å; D138-R142 PolarHBondContact O-N 3.03Å; Q139-R142 PolarHBondContact O-N 3.22Å; A140-R142 PolarHBondContact O-N 2.92Å; R142-A144 VanDerWaalsContact C-N 3.33Å; R142-A144 PolarHBondContact O-N 3.08Å; R142-I145 PolarHBondContact O-N 2.7Å; R142-D146 VanDerWaalsContact O-CG 3.31Å; R142-D146 PolarHBondContact O-N 3.15Å
143	I	95.2	Very high	93.2	Very high	48 Å²	48	41 Å²	41	25%	0.246	20%	0.198	C	C	.	.	H	α-helix	trans	-63.7	-40.5	178.7	-65.5	160.9	0	0	0	110.9	Q139 A140 D146 T147 V433 A436 M448	Q139-I143 WeakPolarHBondContact O-CG1 3.36Å; Q139-I143 PolarHBondContact O-N 2.92Å; A140-I143 PolarHBondContact O-N 3.42Å; I143-D146 PolarHBondContact O-N 3.34Å; I143-T147 WeakPolarHBondContact O-CB 3.45Å; I143-T147 PolarHBondContact O-N 2.86Å; I143-T147 PolarHBondContact O-OG1 3.4Å; I143-V433 HydrophobicContact CB-CG2 4.5Å; I143-V433 HydrophobicContact CG2-CG2 4.29Å; I143-A436 HydrophobicContact CD1-CB 3.77Å; I143-A436 HydrophobicContact CG2-CB 4.25Å; I143-M448 HydrophobicContact CD1-CE 3.52Å
144	A	94.9	Very high	92.8	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.5	-46.8	175	0	0	0	0	0	111.5	A140 A141 R142 D146 T147 L148 C429 V433 F451 I517	A140-A144 PolarHBondContact O-N 3.1Å; A141-A144 PolarHBondContact O-N 3.17Å; R142-A144 VanDerWaalsContact C-N 3.33Å; R142-A144 PolarHBondContact O-N 3.08Å; A144-D146 PolarHBondContact O-N 2.93Å; A144-T147 WeakPolarHBondContact O-CB 3.28Å; A144-T147 PolarHBondContact O-N 3.35Å; A144-T147 VanDerWaalsContact O-N 3.12Å; A144-L148 WeakPolarHBondContact O-CG 3.08Å; A144-L148 PolarHBondContact O-N 3.33Å; A144-C429 HydrophobicContact CB-CB 4.03Å; A144-V433 HydrophobicContact CB-CG2 4.22Å; A144-F451 HydrophobicContact CB-CE1 4.34Å; A144-I517 HydrophobicContact CB-CD1 4.22Å
145	I	95.1	Very high	92	Very high	30 Å²	30	46.7 Å²	46.7	15%	0.154	23%	0.228	C	C	.	.	H	α-helix	trans	-60.7	-44.5	177.4	-70.2	165	0	0	0	111.6	A141 R142 T147 L148 D149 K514 F518	A141-I145 WeakPolarHBondContact O-CB 3.39Å; A141-I145 VanDerWaalsContact O-CG1 3.25Å; A141-I145 WeakPolarHBondContact O-CG1 3.48Å; A141-I145 PolarHBondContact O-N 3.38Å; R142-I145 PolarHBondContact O-N 2.7Å; I145-T147 PolarHBondContact O-N 3.41Å; I145-L148 WeakPolarHBondContact O-CB 3.16Å; I145-L148 PolarHBondContact O-N 3.08Å; I145-D149 PolarHBondContact O-N 3.41Å; I145-K514 HydrophobicContact CG2-CD 3.89Å; I145-K514 HydrophobicContact CG2-CG 4.03Å; I145-F518 HydrophobicContact CD1-CB 4.4Å
146	D	95.4	Very high	90.9	Very high	88 Å²	88	47.4 Å²	47.4	47%	0.471	24%	0.236	S	C	.	.	H	α-helix	trans	-64.5	-31.6	176.5	-71.8	-15.1	0	0	0	112	R142 I143 A144 K150	R142-D146 VanDerWaalsContact O-CG 3.31Å; R142-D146 PolarHBondContact O-N 3.15Å; I143-D146 PolarHBondContact O-N 3.34Å; A144-D146 PolarHBondContact O-N 2.93Å; D146-K150 WeakPolarHBondContact O-CG 3.09Å; D146-K150 PolarHBondContact O-N 2.98Å
147	T	93.3	Very high	89.5	Confident	13 Å²	13	48.6 Å²	48.6	8%	0.08	24%	0.244	C	C	.	.	H	α-helix	trans	-70.8	-42.6	176.2	-60.4	0	0	0	0	110.7	I143 A144 I145 D149 K150 M151 A432	I143-T147 WeakPolarHBondContact O-CB 3.45Å; I143-T147 PolarHBondContact O-N 2.86Å; I143-T147 PolarHBondContact O-OG1 3.4Å; A144-T147 WeakPolarHBondContact O-CB 3.28Å; A144-T147 PolarHBondContact O-N 3.35Å; A144-T147 VanDerWaalsContact O-N 3.12Å; I145-T147 PolarHBondContact O-N 3.41Å; T147-D149 VanDerWaalsContact C-N 3.31Å; T147-D149 PolarHBondContact O-N 3.15Å; T147-K150 PolarHBondContact O-N 3.36Å; T147-K150 VanDerWaalsContact O-N 3.16Å; T147-M151 HydrophobicContact CG2-CE 3.22Å; T147-M151 HydrophobicContact CG2-SD 3.89Å; T147-M151 WeakPolarHBondContact O-CG 3.5Å; T147-M151 PolarHBondContact O-N 2.96Å; T147-M151 VanDerWaalsContact O-N 3.11Å; T147-A432 HydrophobicContact CG2-CB 3.8Å; T147-A432 WeakPolarHBondContact OG1-CB 3.25Å
148	L	93.1	Very high	88.2	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-59.8	-41	173.2	-68.3	174.9	0	0	0	111.9	A144 I145 K150 M151 A152 L510 K513 K514 I517	A144-L148 WeakPolarHBondContact O-CG 3.08Å; A144-L148 PolarHBondContact O-N 3.33Å; I145-L148 WeakPolarHBondContact O-CB 3.16Å; I145-L148 PolarHBondContact O-N 3.08Å; L148-K150 VanDerWaalsContact C-N 3.28Å; L148-K150 PolarHBondContact O-N 3.33Å; L148-M151 PolarHBondContact O-N 2.86Å; L148-A152 WeakPolarHBondContact O-CB 3.49Å; L148-A152 PolarHBondContact O-N 3.04Å; L148-L510 HydrophobicContact CB-CD1 3.7Å; L148-K513 HydrophobicContact CD1-CB 4.01Å; L148-K514 HydrophobicContact CD1-CG 4.31Å; L148-I517 HydrophobicContact CD1-CD1 3.77Å
149	D	92.6	Very high	86.7	Confident	55 Å²	55	55.4 Å²	55.4	29%	0.294	29%	0.286	S	S	.	.	H	α-helix	trans	-59	-37.7	175.4	-89.4	-46.4	0	0	0	113	I145 T147 R417 K514	I145-D149 PolarHBondContact O-N 3.41Å; T147-D149 VanDerWaalsContact C-N 3.31Å; T147-D149 PolarHBondContact O-N 3.15Å; D149-R417 IonicContact OD1-CZ 2.89Å; D149-R417 IonicContact OD1-NH1 2.73Å; D149-R417 PolarHBondContact OD1-NH1 3.47Å; D149-K514 VanDerWaalsContact CG-CE 3.49Å; D149-K514 VanDerWaalsContact OD1-CE 3.28Å; D149-K514 WeakPolarHBondContact OD1-CE 3.47Å; D149-K514 IonicContact OD1-NZ 3.73Å; D149-K514 PolarHBondContact OD1-NZ 3.15Å; D149-K514 WeakPolarHBondContact OD2-CE 3.11Å; D149-K514 IonicContact OD2-NZ 3.54Å; D149-K514 PolarHBondContact OD2-NZ 3.24Å
150	K	91.3	Very high	85.4	Confident	176 Å²	176	60 Å²	60	77%	0.765	31%	0.312	S	S	*	.	H	α-helix	trans	-74.6	-29.6	179	-68.4	169.2	-171	170	0	112.9	D146 T147 L148	D146-K150 WeakPolarHBondContact O-CG 3.09Å; D146-K150 PolarHBondContact O-N 2.98Å; T147-K150 PolarHBondContact O-N 3.36Å; T147-K150 VanDerWaalsContact O-N 3.16Å; L148-K150 VanDerWaalsContact C-N 3.28Å; L148-K150 PolarHBondContact O-N 3.33Å
151	M	88.2	Confident	84.4	Confident	45 Å²	45	64 Å²	64	22%	0.222	33%	0.333	C	S	.	.	H	α-helix	trans	-86.7	-16.5	-179	-67.7	173.5	-177	0	0	113.1	T147 L148 A428 P487	T147-M151 HydrophobicContact CG2-CE 3.22Å; T147-M151 HydrophobicContact CG2-SD 3.89Å; T147-M151 WeakPolarHBondContact O-CG 3.5Å; T147-M151 PolarHBondContact O-N 2.96Å; T147-M151 VanDerWaalsContact O-N 3.11Å; L148-M151 PolarHBondContact O-N 2.86Å; M151-A428 HydrophobicContact CE-CB 3.47Å; M151-A428 VanDerWaalsContact CE-CB 3.47Å; M151-A428 HydrophobicContact SD-CB 3.58Å; M151-A428 VanDerWaalsContact SD-CB 3.58Å; M151-P487 HydrophobicContact CE-CB 3.81Å; M151-P487 HydrophobicContact CG-CB 4.03Å; M151-P487 HydrophobicContact CG-CG 4.13Å; M151-P487 HydrophobicContact SD-CB 3.67Å; M151-P487 HydrophobicContact SD-CG 4.42Å
152	A	88.5	Confident	83.8	Confident	22 Å²	22	65.6 Å²	65.6	18%	0.182	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-65.5	134.6	-175.1	0	0	0	0	0	112.2	L148 R417 V418 V419 L510	L148-A152 WeakPolarHBondContact O-CB 3.49Å; L148-A152 PolarHBondContact O-N 3.04Å; A152-R417 HydrophobicContact CB-CB 4.29Å; A152-V418 CarbonylContact C-O 3.47Å; A152-V418 VanDerWaalsContact CA-O 3.25Å; A152-V418 WeakPolarHBondContact CA-O 3.4Å; A152-V419 HydrophobicContact CB-CG1 4.1Å; A152-L510 HydrophobicContact CB-CD1 4.18Å; A152-L510 HydrophobicContact CB-CD2 3.8Å; A152-L510 HydrophobicContact CB-CG 4.42Å
153	E	87.9	Confident	83.3	Confident	51 Å²	51	60.3 Å²	60.3	24%	0.238	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	148.5	168.9	-68.4	-168.4	-170.3	0	0	109.7	F155 R417 V418 Y420 F488 K502	E153-F155 HydrophobicContact CB-CE1 4.43Å; E153-R417 WeakPolarHBondContact O-CA 3.24Å; E153-V418 HydrophobicContact CB-CG2 4.33Å; E153-V418 PolarHBondContact N-O 3.34Å; E153-V418 WeakPolarHBondContact O-CG2 3.48Å; E153-V418 PolarHBondContact O-N 2.87Å; E153-Y420 HydrophobicContact CG-CE2 4.33Å; E153-Y420 PolarHBondContact OE2-OH 2.84Å; E153-F488 WeakPolarHBondContact OE1-CZ 3.47Å; E153-K502 IonicContact OE1-NZ 2.92Å; E153-K502 PolarHBondContact OE1-NZ 3.15Å; E153-K502 IonicContact OE2-NZ 3.01Å; E153-K502 PolarHBondContact OE2-NZ 2.86Å
154	T	84.2	Confident	82.8	Confident	83 Å²	83	59.3 Å²	59.3	51%	0.509	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	120.2	178.6	-54.3	0	0	0	0	109.6	P156 N416	T154-P156 WeakPolarHBondContact O-CD 3.42Å; T154-N416 WeakPolarHBondContact CG2-ND2 3.23Å
155	F	77.4	Confident	82.3	Confident	44 Å²	44	59.6 Å²	59.6	19%	0.193	32%	0.323	C	S	.	.			trans	-105.4	99.3	173.4	-75.5	-3.4	0	0	0	109.4	E153 C157 P164 N416 V418 I507	E153-F155 HydrophobicContact CB-CE1 4.43Å; F155-C157 PolarHBondContact O-N 3.32Å; F155-P164 HydrophobicContact CD2-CB 3.93Å; F155-P164 HydrophobicContact CE2-CB 4.44Å; F155-P164 HydrophobicContact CG-CB 4.36Å; F155-N416 PolarHBondContact N-O 3.04Å; F155-N416 WeakPolarHBondContact O-CB 3.42Å; F155-V418 HydrophobicContact CD1-CG2 4Å; F155-V418 HydrophobicContact CD2-CB 4.3Å; F155-V418 HydrophobicContact CD2-CG1 3.87Å; F155-V418 HydrophobicContact CD2-CG2 3.53Å; F155-V418 HydrophobicContact CE1-CG2 4.03Å; F155-V418 HydrophobicContact CE2-CB 4.49Å; F155-V418 HydrophobicContact CE2-CG1 4.44Å; F155-V418 HydrophobicContact CE2-CG2 3.58Å; F155-V418 HydrophobicContact CG-CG1 4.37Å; F155-V418 HydrophobicContact CG-CG2 3.76Å; F155-V418 HydrophobicContact CZ-CG2 3.82Å; F155-I507 HydrophobicContact CE2-CD1 3.89Å; F155-I507 HydrophobicContact CE2-CG1 4.37Å; F155-I507 HydrophobicContact CE2-CG2 4.18Å
156	P	68.9	Low	82.1	Confident	73 Å²	73	58.6 Å²	58.6	47%	0.474	32%	0.318	S	S	.	.			trans	-59.2	128.3	179.7	24.7	-31.7	0	0	0	110	T154 D158	T154-P156 WeakPolarHBondContact O-CD 3.42Å; P156-D158 PolarHBondContact O-N 2.8Å
157	C	63.2	Low	81.7	Confident	24 Å²	24	56.4 Å²	56.4	16%	0.162	31%	0.305	C	S	.	.			trans	-75.7	76.4	172.7	-67.8	0	0	0	0	108.8	F155 M199 L412	F155-C157 PolarHBondContact O-N 3.32Å; C157-M199 HydrophobicContact CB-CE 4.46Å; C157-M199 WeakPolarHBondContact O-CE 3.5Å; C157-L412 PolarHBondContact SG-O 3.27Å; C157-L412 VanDerWaalsContact SG-O 3.38Å
158	D	67.8	Low	81.4	Confident	81 Å²	81	55.8 Å²	55.8	43%	0.433	30%	0.302	S	S	.	.			trans	-85	127.6	175.3	-74.4	-41.5	0	0	0	110	P156 N160 N161	P156-D158 PolarHBondContact O-N 2.8Å; D158-N160 PolarHBondContact O-N 3.32Å; D158-N161 HydrophobicContact CB-CB 4.36Å; D158-N161 CarbonylContact O-C 3.59Å; D158-N161 PolarHBondContact O-N 3.16Å
159	P	64.7	Low	81.3	Confident	88 Å²	88	55.8 Å²	55.8	57%	0.571	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-22.6	175.8	-24.1	32.9	0	0	0	113.8	M199	P159-M199 HydrophobicContact CG-CE 4.47Å
160	N	65.2	Low	81.1	Confident	162 Å²	162	55.1 Å²	55.1	87%	0.866	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-17.1	-179.3	-63.7	-29.6	0	0	0	113.4	D158	D158-N160 PolarHBondContact O-N 3.32Å
161	N	75.4	Confident	81	Confident	85 Å²	85	48.5 Å²	48.5	46%	0.455	27%	0.272	S	S	.	.			trans	-129.3	83.2	-179.5	-172.6	14.9	0	0	0	110.3	D158 E163 P164	D158-N161 HydrophobicContact CB-CB 4.36Å; D158-N161 CarbonylContact O-C 3.59Å; D158-N161 PolarHBondContact O-N 3.16Å; N161-E163 VanDerWaalsContact C-N 3.35Å; N161-P164 WeakPolarHBondContact O-CD 3.49Å
162	T	81.4	Confident	81	Confident	38 Å²	38	46.7 Å²	46.7	23%	0.233	26%	0.263	C	S	.	.			trans	-84.6	-8.2	-179	54.4	0	0	0	0	113.4	L165 I166 V190 L194	T162-L165 WeakPolarHBondContact O-CB 3.33Å; T162-L165 PolarHBondContact O-N 3.45Å; T162-L165 VanDerWaalsContact O-N 3.11Å; T162-I166 VanDerWaalsContact O-CG1 3.32Å; T162-I166 WeakPolarHBondContact O-CG1 3.44Å; T162-I166 PolarHBondContact O-N 2.8Å; T162-V190 HydrophobicContact CG2-CG1 4.25Å; T162-L194 HydrophobicContact CG2-CD1 3.51Å
163	E	85.8	Confident	80.9	Confident	60 Å²	60	45.6 Å²	45.6	28%	0.28	25%	0.254	S	S	.	.	H	α-helix	trans	-59.1	-41.2	-174.7	-169	69.1	-163.6	0	0	113.3	N161 L165 I166 Q167 R183	N161-E163 VanDerWaalsContact C-N 3.35Å; E163-L165 VanDerWaalsContact C-N 3.32Å; E163-L165 PolarHBondContact O-N 2.94Å; E163-I166 PolarHBondContact O-N 2.91Å; E163-Q167 HydrophobicContact CG-CG 4.45Å; E163-Q167 VanDerWaalsContact O-CG 3.32Å; E163-Q167 WeakPolarHBondContact O-CG 3.41Å; E163-Q167 PolarHBondContact O-N 2.94Å; E163-R183 IonicContact OE1-CZ 2.99Å; E163-R183 IonicContact OE1-NH1 3.14Å; E163-R183 PolarHBondContact OE1-NH1 3.37Å; E163-R183 IonicContact OE1-NH2 2.69Å; E163-R183 IonicContact OE2-NH2 3.7Å; E163-R183 PolarHBondContact OE2-NH2 3.29Å; E163-R183 VanDerWaalsContact OE2-NH2 3.15Å
164	P	83.8	Confident	80.6	Confident	26 Å²	26	43.8 Å²	43.8	17%	0.169	25%	0.249	C	C	.	.	H	α-helix	trans	-63.1	-36.3	175.9	-22.4	34.4	0	0	0	113.4	F155 N161 Q167 T168	F155-P164 HydrophobicContact CD2-CB 3.93Å; F155-P164 HydrophobicContact CE2-CB 4.44Å; F155-P164 HydrophobicContact CG-CB 4.36Å; N161-P164 WeakPolarHBondContact O-CD 3.49Å; P164-Q167 PolarHBondContact O-N 3.07Å; P164-T168 PolarHBondContact O-N 3.01Å; P164-T168 PolarHBondContact O-OG1 2.96Å
165	L	86.1	Confident	80.3	Confident	7 Å²	7	41.3 Å²	41.3	4%	0.037	24%	0.235	C	C	.	.	H	α-helix	trans	-67.6	-42.3	175.8	-60.1	177.4	0	0	0	110.5	T162 E163 T168 A169 V190 L194 L412	T162-L165 WeakPolarHBondContact O-CB 3.33Å; T162-L165 PolarHBondContact O-N 3.45Å; T162-L165 VanDerWaalsContact O-N 3.11Å; E163-L165 VanDerWaalsContact C-N 3.32Å; E163-L165 PolarHBondContact O-N 2.94Å; L165-T168 PolarHBondContact O-N 2.88Å; L165-A169 WeakPolarHBondContact O-CB 3.22Å; L165-A169 PolarHBondContact O-N 2.74Å; L165-V190 HydrophobicContact CB-CG1 3.99Å; L165-V190 HydrophobicContact CB-CG2 3.81Å; L165-V190 HydrophobicContact CD1-CG1 4.05Å; L165-L194 HydrophobicContact CD1-CD1 4.5Å; L165-L194 HydrophobicContact CD1-CD2 4.36Å; L165-L412 HydrophobicContact CD2-CB 3.94Å; L165-L412 HydrophobicContact CD2-CD1 3.53Å; L165-L412 HydrophobicContact CD2-CG 4.36Å
166	I	89.6	Confident	80.5	Confident	9 Å²	9	40 Å²	40	5%	0.046	23%	0.23	C	C	.	.	H	α-helix	trans	-62	-47.3	176.3	-65.4	163.3	0	0	0	109.7	T162 E163 T168 A169 M170 A186 E187 V190	T162-I166 VanDerWaalsContact O-CG1 3.32Å; T162-I166 WeakPolarHBondContact O-CG1 3.44Å; T162-I166 PolarHBondContact O-N 2.8Å; E163-I166 PolarHBondContact O-N 2.91Å; I166-T168 VanDerWaalsContact C-N 3.31Å; I166-T168 PolarHBondContact O-N 3.43Å; I166-A169 PolarHBondContact O-N 2.93Å; I166-M170 HydrophobicContact CG2-CG 4.17Å; I166-M170 HydrophobicContact CG2-SD 3.91Å; I166-M170 WeakPolarHBondContact O-CB 3.44Å; I166-M170 WeakPolarHBondContact O-CG 3.12Å; I166-M170 PolarHBondContact O-N 3.01Å; I166-A186 HydrophobicContact CG2-CB 4.03Å; I166-E187 HydrophobicContact CD1-CG 3.84Å; I166-E187 HydrophobicContact CG1-CG 4.21Å; I166-E187 HydrophobicContact CG2-CG 4.24Å; I166-V190 HydrophobicContact CG1-CB 4.32Å; I166-V190 HydrophobicContact CG1-CG1 4.48Å; I166-V190 HydrophobicContact CG1-CG2 3.98Å
167	Q	87.8	Confident	80.7	Confident	41 Å²	41	39.5 Å²	39.5	19%	0.192	23%	0.225	C	C	.	.	H	α-helix	trans	-60.6	-39.1	178.1	-73	177.5	3	0	0	112.6	E163 P164 M170 T171 H505 I507	E163-Q167 HydrophobicContact CG-CG 4.45Å; E163-Q167 VanDerWaalsContact O-CG 3.32Å; E163-Q167 WeakPolarHBondContact O-CG 3.41Å; E163-Q167 PolarHBondContact O-N 2.94Å; P164-Q167 PolarHBondContact O-N 3.07Å; Q167-M170 PolarHBondContact O-N 3.06Å; Q167-T171 PolarHBondContact O-N 2.89Å; Q167-T171 VanDerWaalsContact O-N 3.11Å; Q167-T171 PolarHBondContact O-OG1 3.44Å; Q167-T171 VanDerWaalsContact O-OG1 3.13Å; Q167-H505 PolarHBondContact OE1-ND1 3.24Å; Q167-I507 HydrophobicContact CB-CD1 4.1Å
168	T	87.8	Confident	81.2	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.006	22%	0.218	C	C	.	.	H	α-helix	trans	-66.8	-46.9	176.5	-48.8	0	0	0	0	110.8	P164 L165 I166 M170 T171 T172 V408 L412 I507	P164-T168 PolarHBondContact O-N 3.01Å; P164-T168 PolarHBondContact O-OG1 2.96Å; L165-T168 PolarHBondContact O-N 2.88Å; I166-T168 VanDerWaalsContact C-N 3.31Å; I166-T168 PolarHBondContact O-N 3.43Å; T168-M170 VanDerWaalsContact C-N 3.29Å; T168-M170 PolarHBondContact O-N 3.02Å; T168-T171 WeakPolarHBondContact O-CB 3.4Å; T168-T171 PolarHBondContact O-N 2.83Å; T168-T171 VanDerWaalsContact O-N 3.08Å; T168-T172 PolarHBondContact O-N 2.84Å; T168-V408 HydrophobicContact CG2-CG1 3.72Å; T168-L412 HydrophobicContact CG2-CD1 3.92Å; T168-I507 HydrophobicContact CG2-CB 4.36Å; T168-I507 HydrophobicContact CG2-CG2 4.04Å
169	A	89.6	Confident	81.3	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.2	-34.5	175.7	0	0	0	0	0	112.8	L165 I166 T171 T172 L173 A186 I409	L165-A169 WeakPolarHBondContact O-CB 3.22Å; L165-A169 PolarHBondContact O-N 2.74Å; I166-A169 PolarHBondContact O-N 2.93Å; A169-T171 VanDerWaalsContact C-N 3.28Å; A169-T171 PolarHBondContact O-N 3.11Å; A169-T172 PolarHBondContact O-N 2.85Å; A169-L173 WeakPolarHBondContact O-CB 3.42Å; A169-L173 VanDerWaalsContact O-CG 3.27Å; A169-L173 WeakPolarHBondContact O-CG 3.5Å; A169-L173 PolarHBondContact O-N 2.64Å; A169-A186 HydrophobicContact CB-CB 3.83Å; A169-I409 HydrophobicContact CB-CD1 3.87Å; A169-I409 HydrophobicContact CB-CG1 4.1Å
170	M	89.8	Confident	81.9	Confident	41 Å²	41	45.8 Å²	45.8	20%	0.202	23%	0.234	C	C	.	.	H	α-helix	trans	-62.6	-35.5	173.7	-75.4	176.8	70.5	0	0	111.8	I166 Q167 T168 G174 H182 R183 A186	I166-M170 HydrophobicContact CG2-CG 4.17Å; I166-M170 HydrophobicContact CG2-SD 3.91Å; I166-M170 WeakPolarHBondContact O-CB 3.44Å; I166-M170 WeakPolarHBondContact O-CG 3.12Å; I166-M170 PolarHBondContact O-N 3.01Å; Q167-M170 PolarHBondContact O-N 3.06Å; T168-M170 VanDerWaalsContact C-N 3.29Å; T168-M170 PolarHBondContact O-N 3.02Å; M170-G174 PolarHBondContact O-N 3.1Å; M170-H182 VanDerWaalsContact CE-CD2 3.46Å; M170-H182 WeakPolarHBondContact CE-CD2 3.41Å; M170-H182 WeakPolarHBondContact CE-NE2 3.41Å; M170-R183 HydrophobicContact CE-CB 4.3Å; M170-R183 HydrophobicContact SD-CB 4.41Å; M170-R183 HydrophobicContact SD-CG 4.28Å; M170-A186 HydrophobicContact CG-CB 3.79Å
171	T	88.5	Confident	82.6	Confident	38 Å²	38	38.9 Å²	38.9	23%	0.233	20%	0.198	C	C	.	.	H	α-helix	trans	-63.9	-49.4	176.1	-59.2	0	0	0	0	110.6	Q167 T168 A169 L173 G174 H505 V506 I507	Q167-T171 PolarHBondContact O-N 2.89Å; Q167-T171 VanDerWaalsContact O-N 3.11Å; Q167-T171 PolarHBondContact O-OG1 3.44Å; Q167-T171 VanDerWaalsContact O-OG1 3.13Å; T168-T171 WeakPolarHBondContact O-CB 3.4Å; T168-T171 PolarHBondContact O-N 2.83Å; T168-T171 VanDerWaalsContact O-N 3.08Å; A169-T171 VanDerWaalsContact C-N 3.28Å; A169-T171 PolarHBondContact O-N 3.11Å; T171-L173 VanDerWaalsContact C-N 3.34Å; T171-L173 PolarHBondContact O-N 2.92Å; T171-G174 PolarHBondContact O-N 2.62Å; T171-H505 PolarHBondContact OG1-O 3.38Å; T171-V506 HydrophobicContact CG2-CG1 4.01Å; T171-I507 PolarHBondContact OG1-N 2.65Å
172	T	87.4	Confident	82.9	Confident	6 Å²	6	37.1 Å²	37.1	4%	0.037	19%	0.187	C	C	.	.	H	α-helix	trans	-64.9	-34.2	178.5	-57.6	0	0	0	0	113.1	D104 T168 A169 S175 D404 V408	D104-T172 PolarHBondContact OD2-OG1 3.26Å; T168-T172 PolarHBondContact O-N 2.84Å; A169-T172 PolarHBondContact O-N 2.85Å; T172-S175 PolarHBondContact O-OG 3.3Å; T172-D404 HydrophobicContact CG2-CB 4.02Å; T172-V408 HydrophobicContact CG2-CG2 4.08Å
173	L	87.1	Confident	83.3	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-79.9	-19	176.9	-69.5	171.2	0	0	0	113.2	A169 T171 S175 K176 I178 H182 M185 A186 A401 A405	A169-L173 WeakPolarHBondContact O-CB 3.42Å; A169-L173 VanDerWaalsContact O-CG 3.27Å; A169-L173 WeakPolarHBondContact O-CG 3.5Å; A169-L173 PolarHBondContact O-N 2.64Å; T171-L173 VanDerWaalsContact C-N 3.34Å; T171-L173 PolarHBondContact O-N 2.92Å; L173-S175 VanDerWaalsContact C-N 3.29Å; L173-S175 PolarHBondContact O-N 3.4Å; L173-K176 PolarHBondContact O-N 3.39Å; L173-I178 HydrophobicContact CD2-CD1 4.29Å; L173-H182 HydrophobicContact CB-CB 3.88Å; L173-M185 HydrophobicContact CD1-CB 3.84Å; L173-A186 HydrophobicContact CD1-CB 4.05Å; L173-A401 HydrophobicContact CD2-CB 4.01Å; L173-A401 VanDerWaalsContact CD2-O 3.24Å; L173-A401 WeakPolarHBondContact CD2-O 3.39Å; L173-A405 HydrophobicContact CD1-CB 4.18Å; L173-A405 HydrophobicContact CD2-CB 3.99Å; L173-A405 HydrophobicContact CG-CB 3.96Å
174	G	81.4	Confident	83.5	Confident	13 Å²	13	40.8 Å²	40.8	13%	0.134	20%	0.197	C	C	.	.	H	α-helix	trans	-67.5	-24.8	-173.7	0	0	0	0	0	114.4	M170 T171 K176 N179	M170-G174 PolarHBondContact O-N 3.1Å; T171-G174 PolarHBondContact O-N 2.62Å; G174-K176 VanDerWaalsContact C-N 3.34Å; G174-N179 PolarHBondContact O-ND2 3.45Å
175	S	78.4	Confident	83.8	Confident	31 Å²	31	39.6 Å²	39.6	22%	0.217	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	4.2	177.3	54.7	0	0	0	0	115.2	G53 T172 L173	G53-S175 VanDerWaalsContact O-CB 3.31Å; G53-S175 WeakPolarHBondContact O-CB 3.4Å; T172-S175 PolarHBondContact O-OG 3.3Å; L173-S175 VanDerWaalsContact C-N 3.29Å; L173-S175 PolarHBondContact O-N 3.4Å
176	K	80.4	Confident	84	Confident	17 Å²	17	39.2 Å²	39.2	7%	0.074	19%	0.187	C	C	.	.	S	Bend	trans	-119.1	170.2	-170.7	-61.8	179.4	-174.7	159	0	112.5	L173 G174 I178 N179 A401 D404	L173-K176 PolarHBondContact O-N 3.39Å; G174-K176 VanDerWaalsContact C-N 3.34Å; K176-I178 PolarHBondContact O-N 3Å; K176-N179 WeakPolarHBondContact O-CB 3.32Å; K176-N179 PolarHBondContact O-N 3.29Å; K176-A401 HydrophobicContact CB-CB 4.18Å; K176-A401 HydrophobicContact CD-CB 3.41Å; K176-A401 VanDerWaalsContact CD-CB 3.41Å; K176-A401 HydrophobicContact CG-CB 4.41Å; K176-D404 WeakPolarHBondContact CE-OD2 3.42Å; K176-D404 IonicContact NZ-OD2 3.26Å; K176-D404 PolarHBondContact NZ-OD2 2.87Å
177	V	73.1	Confident	84.2	Confident	61 Å²	61	42 Å²	42	37%	0.37	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-53.8	-25.4	179.6	-179	0	0	0	0	112.7	D58 N179 E397	D58-V177 WeakPolarHBondContact OD2-CG2 3.2Å; V177-N179 PolarHBondContact O-N 3.3Å; V177-E397 HydrophobicContact CB-CG 4.12Å; V177-E397 HydrophobicContact CG2-CG 3.78Å
178	I	73.6	Confident	84.4	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.021	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-77.9	9.2	178.2	-37.3	176.2	0	0	0	114.1	L173 K176 R180 C181 H182 M185 A398 A401	L173-I178 HydrophobicContact CD2-CD1 4.29Å; K176-I178 PolarHBondContact O-N 3Å; I178-R180 PolarHBondContact O-N 3.05Å; I178-C181 HydrophobicContact CG2-CB 4.2Å; I178-C181 CarbonylContact O-C 3.56Å; I178-C181 PolarHBondContact O-N 2.91Å; I178-H182 PolarHBondContact O-N 3.28Å; I178-M185 HydrophobicContact CD1-CG 4.33Å; I178-M185 HydrophobicContact CG2-CB 4.42Å; I178-M185 HydrophobicContact CG2-CE 4.21Å; I178-M185 HydrophobicContact CG2-CG 3.55Å; I178-A398 HydrophobicContact CD1-CB 3.88Å; I178-A398 HydrophobicContact CG1-CB 4.16Å; I178-A401 HydrophobicContact CD1-CB 3.48Å; I178-A401 VanDerWaalsContact CD1-CB 3.48Å; I178-A401 HydrophobicContact CG1-CB 4.01Å
179	N	71.5	Confident	84.6	Confident	79 Å²	79	40.7 Å²	40.7	42%	0.422	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-53.7	-24	-179.2	-166.9	-2	0	0	0	113.8	G174 K176 V177 H182	G174-N179 PolarHBondContact O-ND2 3.45Å; K176-N179 WeakPolarHBondContact O-CB 3.32Å; K176-N179 PolarHBondContact O-N 3.29Å; V177-N179 PolarHBondContact O-N 3.3Å; N179-H182 PolarHBondContact O-CE1 3.43Å; N179-H182 PolarHBondContact O-ND1 2.88Å
180	R	77.3	Confident	84.7	Confident	243 Å²	243	40.7 Å²	40.7	92%	0.917	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-70.9	-32.5	174.6	-66.8	-174	-177.1	179.8	2	114.6	I178	I178-R180 PolarHBondContact O-N 3.05Å
181	C	79.6	Confident	84.7	Confident	17 Å²	17	42.4 Å²	42.4	12%	0.115	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.1	20.2	-172.5	-56.3	0	0	0	0	112.3	I178 R183 Q184 M185 E220	I178-C181 HydrophobicContact CG2-CB 4.2Å; I178-C181 CarbonylContact O-C 3.56Å; I178-C181 PolarHBondContact O-N 2.91Å; C181-R183 VanDerWaalsContact C-N 3.28Å; C181-R183 PolarHBondContact O-N 3.33Å; C181-Q184 PolarHBondContact O-N 2.99Å; C181-M185 PolarHBondContact O-N 3.49Å; C181-E220 VanDerWaalsContact SG-CG 3.54Å
182	H	82.1	Confident	84.9	Confident	47 Å²	47	40.6 Å²	40.6	22%	0.218	19%	0.193	C	C	.	.	H	α-helix	trans	-61.6	-31.2	-170	64.2	-84.1	0	0	0	113.4	M170 L173 I178 N179 A186	M170-H182 VanDerWaalsContact CE-CD2 3.46Å; M170-H182 WeakPolarHBondContact CE-CD2 3.41Å; M170-H182 WeakPolarHBondContact CE-NE2 3.41Å; L173-H182 HydrophobicContact CB-CB 3.88Å; I178-H182 PolarHBondContact O-N 3.28Å; N179-H182 PolarHBondContact O-CE1 3.43Å; N179-H182 PolarHBondContact O-ND1 2.88Å; H182-A186 WeakPolarHBondContact O-CB 3.42Å; H182-A186 PolarHBondContact O-N 3.46Å
183	R	89.1	Confident	85	Confident	106 Å²	106	40.3 Å²	40.3	40%	0.4	19%	0.191	S	C	.	.	H	α-helix	trans	-64.7	-49	176	-173.1	175.5	179.8	105.6	6.6	112.5	E163 M170 C181 M185 A186 E187	E163-R183 IonicContact OE1-CZ 2.99Å; E163-R183 IonicContact OE1-NH1 3.14Å; E163-R183 PolarHBondContact OE1-NH1 3.37Å; E163-R183 IonicContact OE1-NH2 2.69Å; E163-R183 IonicContact OE2-NH2 3.7Å; E163-R183 PolarHBondContact OE2-NH2 3.29Å; E163-R183 VanDerWaalsContact OE2-NH2 3.15Å; M170-R183 HydrophobicContact CE-CB 4.3Å; M170-R183 HydrophobicContact SD-CB 4.41Å; M170-R183 HydrophobicContact SD-CG 4.28Å; C181-R183 VanDerWaalsContact C-N 3.28Å; C181-R183 PolarHBondContact O-N 3.33Å; R183-M185 VanDerWaalsContact C-N 3.3Å; R183-M185 PolarHBondContact O-N 2.97Å; R183-A186 PolarHBondContact O-N 3.22Å; R183-E187 IonicContact CZ-OE1 3.06Å; R183-E187 IonicContact NE-OE1 2.89Å; R183-E187 PolarHBondContact NE-OE1 3.39Å; R183-E187 IonicContact NH2-OE1 3.83Å; R183-E187 WeakPolarHBondContact O-CG 3.36Å; R183-E187 PolarHBondContact O-N 2.97Å
184	Q	90.1	Very high	85.1	Confident	70 Å²	70	42.5 Å²	42.5	33%	0.327	20%	0.202	S	C	.	.	H	α-helix	trans	-60.9	-42.6	178.1	-178.7	-175.9	1	0	0	110.9	C181 E187 I188 E220 T222	C181-Q184 PolarHBondContact O-N 2.99Å; Q184-E187 PolarHBondContact O-N 2.88Å; Q184-I188 HydrophobicContact CG-CD1 4.07Å; Q184-I188 VanDerWaalsContact O-CG1 3.28Å; Q184-I188 WeakPolarHBondContact O-CG1 3.48Å; Q184-I188 PolarHBondContact O-N 3.44Å; Q184-E220 PolarHBondContact NE2-O 3.4Å; Q184-E220 PolarHBondContact OE1-O 2.96Å; Q184-T222 PolarHBondContact NE2-O 3.12Å
185	M	89.7	Confident	85.3	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-66	-40.1	177.3	-66.4	-61.5	-177	0	0	112.4	L173 I178 C181 R183 I188 A189 L219 T222 L402	L173-M185 HydrophobicContact CD1-CB 3.84Å; I178-M185 HydrophobicContact CD1-CG 4.33Å; I178-M185 HydrophobicContact CG2-CB 4.42Å; I178-M185 HydrophobicContact CG2-CE 4.21Å; I178-M185 HydrophobicContact CG2-CG 3.55Å; C181-M185 PolarHBondContact O-N 3.49Å; R183-M185 VanDerWaalsContact C-N 3.3Å; R183-M185 PolarHBondContact O-N 2.97Å; M185-I188 PolarHBondContact O-N 2.93Å; M185-A189 WeakPolarHBondContact O-CB 3.36Å; M185-A189 PolarHBondContact O-N 2.87Å; M185-L219 HydrophobicContact CE-CD2 4.41Å; M185-L219 WeakPolarHBondContact CE-O 3.47Å; M185-T222 VanDerWaalsContact CE-CB 3.5Å; M185-T222 HydrophobicContact CE-CG2 3.68Å; M185-T222 WeakPolarHBondContact CE-OG1 3.32Å; M185-T222 HydrophobicContact SD-CG2 3.62Å; M185-L402 HydrophobicContact CB-CD2 4.04Å; M185-L402 HydrophobicContact SD-CD1 4.01Å; M185-L402 HydrophobicContact SD-CD2 4.3Å; M185-L402 HydrophobicContact SD-CG 4.44Å
186	A	91.1	Very high	85.7	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.4	-46	174.6	0	0	0	0	0	111.3	I166 A169 M170 L173 H182 R183 I188 A189 V190	I166-A186 HydrophobicContact CG2-CB 4.03Å; A169-A186 HydrophobicContact CB-CB 3.83Å; M170-A186 HydrophobicContact CG-CB 3.79Å; L173-A186 HydrophobicContact CD1-CB 4.05Å; H182-A186 WeakPolarHBondContact O-CB 3.42Å; H182-A186 PolarHBondContact O-N 3.46Å; R183-A186 PolarHBondContact O-N 3.22Å; A186-I188 VanDerWaalsContact C-N 3.32Å; A186-I188 PolarHBondContact O-N 3.24Å; A186-A189 PolarHBondContact O-N 3.46Å; A186-V190 WeakPolarHBondContact O-CB 3.48Å; A186-V190 VanDerWaalsContact O-CG2 3.28Å; A186-V190 WeakPolarHBondContact O-CG2 3.49Å; A186-V190 PolarHBondContact O-N 2.89Å
187	E	92.1	Very high	85.9	Confident	68 Å²	68	42 Å²	42	32%	0.318	20%	0.198	S	C	.	.	H	α-helix	trans	-60.2	-41.7	175.6	-73.9	172.9	-169	0	0	111.5	I166 R183 Q184 N191	I166-E187 HydrophobicContact CD1-CG 3.84Å; I166-E187 HydrophobicContact CG1-CG 4.21Å; I166-E187 HydrophobicContact CG2-CG 4.24Å; R183-E187 IonicContact CZ-OE1 3.06Å; R183-E187 IonicContact NE-OE1 2.89Å; R183-E187 PolarHBondContact NE-OE1 3.39Å; R183-E187 IonicContact NH2-OE1 3.83Å; R183-E187 WeakPolarHBondContact O-CG 3.36Å; R183-E187 PolarHBondContact O-N 2.97Å; Q184-E187 PolarHBondContact O-N 2.88Å; E187-N191 VanDerWaalsContact O-CB 3.26Å; E187-N191 WeakPolarHBondContact O-CB 3.3Å; E187-N191 PolarHBondContact O-N 3.22Å; E187-N191 PolarHBondContact O-ND2 3.07Å
188	I	92.5	Very high	86.3	Confident	14 Å²	14	41.4 Å²	41.4	7%	0.072	19%	0.193	C	C	.	.	H	α-helix	trans	-63.2	-47.4	175.3	-73.1	166.8	0	0	0	111.3	Q184 M185 A186 N191 A192 T222 L224 I385	Q184-I188 HydrophobicContact CG-CD1 4.07Å; Q184-I188 VanDerWaalsContact O-CG1 3.28Å; Q184-I188 WeakPolarHBondContact O-CG1 3.48Å; Q184-I188 PolarHBondContact O-N 3.44Å; M185-I188 PolarHBondContact O-N 2.93Å; A186-I188 VanDerWaalsContact C-N 3.32Å; A186-I188 PolarHBondContact O-N 3.24Å; I188-N191 PolarHBondContact O-N 3.48Å; I188-A192 VanDerWaalsContact O-CB 3.32Å; I188-A192 WeakPolarHBondContact O-CB 3.44Å; I188-A192 PolarHBondContact O-N 3.31Å; I188-T222 HydrophobicContact CD1-CG2 4.16Å; I188-T222 WeakPolarHBondContact CD1-O 3.46Å; I188-L224 HydrophobicContact CG1-CB 4.41Å; I188-L224 HydrophobicContact CG2-CB 4.05Å; I188-L224 HydrophobicContact CG2-CD1 4.48Å; I188-I385 HydrophobicContact CG2-CD1 4.21Å; I188-I385 HydrophobicContact CG2-CG1 4.11Å; I188-I385 HydrophobicContact CG2-CG2 3.82Å
189	A	92.1	Very high	86.5	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62.5	-44.5	-179.9	0	0	0	0	0	111.7	M185 A186 A192 I193 L402 A405 L406 I409	M185-A189 WeakPolarHBondContact O-CB 3.36Å; M185-A189 PolarHBondContact O-N 2.87Å; A186-A189 PolarHBondContact O-N 3.46Å; A189-A192 PolarHBondContact O-N 3.11Å; A189-I193 PolarHBondContact O-N 3.27Å; A189-L402 HydrophobicContact CB-CD2 4.27Å; A189-A405 HydrophobicContact CB-CB 4.3Å; A189-L406 HydrophobicContact CB-CD2 4.01Å; A189-L406 HydrophobicContact CB-CG 4.45Å; A189-I409 HydrophobicContact CB-CD1 3.69Å
190	V	91.7	Very high	86.9	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.4	-46.8	177.3	173.1	0	0	0	0	110.9	T162 L165 I166 A186 A192 I193 L194 I409	T162-V190 HydrophobicContact CG2-CG1 4.25Å; L165-V190 HydrophobicContact CB-CG1 3.99Å; L165-V190 HydrophobicContact CB-CG2 3.81Å; L165-V190 HydrophobicContact CD1-CG1 4.05Å; I166-V190 HydrophobicContact CG1-CB 4.32Å; I166-V190 HydrophobicContact CG1-CG1 4.48Å; I166-V190 HydrophobicContact CG1-CG2 3.98Å; A186-V190 WeakPolarHBondContact O-CB 3.48Å; A186-V190 VanDerWaalsContact O-CG2 3.28Å; A186-V190 WeakPolarHBondContact O-CG2 3.49Å; A186-V190 PolarHBondContact O-N 2.89Å; V190-A192 VanDerWaalsContact C-N 3.31Å; V190-A192 PolarHBondContact O-N 3.38Å; V190-I193 PolarHBondContact O-N 3.3Å; V190-L194 HydrophobicContact CG1-CD1 3.66Å; V190-L194 HydrophobicContact CG1-CG 4.25Å; V190-L194 WeakPolarHBondContact O-CB 3.42Å; V190-L194 VanDerWaalsContact O-CG 3.3Å; V190-L194 WeakPolarHBondContact O-CG 3.43Å; V190-L194 PolarHBondContact O-N 2.95Å; V190-I409 HydrophobicContact CB-CD1 4.3Å; V190-I409 HydrophobicContact CG2-CD1 3.48Å; V190-I409 VanDerWaalsContact CG2-CD1 3.48Å; V190-I409 HydrophobicContact CG2-CG1 4.05Å
191	N	90.8	Very high	87.2	Confident	77 Å²	77	48.2 Å²	48.2	41%	0.412	23%	0.226	S	C	.	.	H	α-helix	trans	-64.1	-36.5	178.1	-73.7	-36.8	0	0	0	112.4	E187 I188 T195 L224	E187-N191 VanDerWaalsContact O-CB 3.26Å; E187-N191 WeakPolarHBondContact O-CB 3.3Å; E187-N191 PolarHBondContact O-N 3.22Å; E187-N191 PolarHBondContact O-ND2 3.07Å; I188-N191 PolarHBondContact O-N 3.48Å; N191-T195 WeakPolarHBondContact O-CB 3.42Å; N191-T195 PolarHBondContact O-N 2.83Å; N191-T195 VanDerWaalsContact O-N 3.17Å; N191-T195 PolarHBondContact O-OG1 2.86Å; N191-L224 HydrophobicContact CB-CD2 3.61Å
192	A	91.4	Very high	87.4	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.8	-52.2	175.5	0	0	0	0	0	110.5	I188 A189 V190 T195 V196 L224 V383 I385 L406	I188-A192 VanDerWaalsContact O-CB 3.32Å; I188-A192 WeakPolarHBondContact O-CB 3.44Å; I188-A192 PolarHBondContact O-N 3.31Å; A189-A192 PolarHBondContact O-N 3.11Å; V190-A192 VanDerWaalsContact C-N 3.31Å; V190-A192 PolarHBondContact O-N 3.38Å; A192-T195 WeakPolarHBondContact O-CB 2.94Å; A192-T195 PolarHBondContact O-N 3.29Å; A192-V196 WeakPolarHBondContact O-CG2 3.21Å; A192-V196 PolarHBondContact O-N 2.87Å; A192-L224 HydrophobicContact CB-CD1 3.84Å; A192-L224 HydrophobicContact CB-CD2 4.48Å; A192-V383 HydrophobicContact CB-CG2 4.1Å; A192-I385 HydrophobicContact CB-CD1 3.98Å; A192-I385 HydrophobicContact CB-CG1 4.27Å; A192-L406 HydrophobicContact CB-CD2 4.26Å
193	I	90.4	Very high	87.6	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-65.1	-45.2	-179.3	-66	-152.5	0	0	0	112.1	A189 V190 T195 V196 A197 V204 F206 I209 L406 I409 R410 V413	A189-I193 PolarHBondContact O-N 3.27Å; V190-I193 PolarHBondContact O-N 3.3Å; I193-T195 PolarHBondContact O-N 3.48Å; I193-T195 VanDerWaalsContact O-N 3.15Å; I193-V196 PolarHBondContact O-N 3.16Å; I193-A197 HydrophobicContact CG2-CB 4.21Å; I193-A197 WeakPolarHBondContact O-CA 3.36Å; I193-A197 WeakPolarHBondContact O-CB 3.49Å; I193-A197 PolarHBondContact O-N 3.03Å; I193-V204 HydrophobicContact CD1-CG1 4.34Å; I193-V204 HydrophobicContact CG1-CG1 4.5Å; I193-V204 HydrophobicContact CG2-CG1 4.05Å; I193-V204 HydrophobicContact CG2-CG2 3.78Å; I193-F206 HydrophobicContact CD1-CE1 4.34Å; I193-I209 HydrophobicContact CG1-CD1 4.09Å; I193-L406 HydrophobicContact CD1-CB 4.05Å; I193-L406 HydrophobicContact CD1-CD2 3.91Å; I193-L406 WeakPolarHBondContact CD1-O 3.26Å; I193-L406 HydrophobicContact CG1-CD2 3.56Å; I193-I409 HydrophobicContact CB-CG2 3.9Å; I193-I409 HydrophobicContact CD1-CB 3.88Å; I193-I409 HydrophobicContact CD1-CG2 3.98Å; I193-I409 HydrophobicContact CG1-CG2 4.27Å; I193-I409 HydrophobicContact CG2-CG2 3.89Å; I193-R410 HydrophobicContact CD1-CB 4.2Å; I193-V413 HydrophobicContact CG2-CG2 4.05Å
194	L	87.9	Confident	87.4	Confident	45 Å²	45	47.7 Å²	47.7	24%	0.236	23%	0.226	C	C	.	.	H	α-helix	trans	-61.7	-26	178.9	-69.7	173.6	0	0	0	113	T162 L165 V190	T162-L194 HydrophobicContact CG2-CD1 3.51Å; L165-L194 HydrophobicContact CD1-CD1 4.5Å; L165-L194 HydrophobicContact CD1-CD2 4.36Å; V190-L194 HydrophobicContact CG1-CD1 3.66Å; V190-L194 HydrophobicContact CG1-CG 4.25Å; V190-L194 WeakPolarHBondContact O-CB 3.42Å; V190-L194 VanDerWaalsContact O-CG 3.3Å; V190-L194 WeakPolarHBondContact O-CG 3.43Å; V190-L194 PolarHBondContact O-N 2.95Å
195	T	87.1	Confident	87.2	Confident	35 Å²	35	48 Å²	48	22%	0.215	23%	0.23	C	C	.	.	H	α-helix	trans	-75.2	-33	176.1	-57.6	0	0	0	0	112.2	N191 A192 I193 T380 V383	N191-T195 WeakPolarHBondContact O-CB 3.42Å; N191-T195 PolarHBondContact O-N 2.83Å; N191-T195 VanDerWaalsContact O-N 3.17Å; N191-T195 PolarHBondContact O-OG1 2.86Å; A192-T195 WeakPolarHBondContact O-CB 2.94Å; A192-T195 PolarHBondContact O-N 3.29Å; I193-T195 PolarHBondContact O-N 3.48Å; I193-T195 VanDerWaalsContact O-N 3.15Å; T195-T380 WeakPolarHBondContact CG2-O 3.32Å; T195-V383 HydrophobicContact CG2-CG1 3.68Å
196	V	86.5	Confident	87	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.018	24%	0.241	C	C	.	.	H	α-helix	trans	-93.3	-34.9	-176.8	-178.5	0	0	0	0	112.3	A192 I193 D198 L208 I209 R381 V383	A192-V196 WeakPolarHBondContact O-CG2 3.21Å; A192-V196 PolarHBondContact O-N 2.87Å; I193-V196 PolarHBondContact O-N 3.16Å; V196-D198 PolarHBondContact O-N 3.02Å; V196-L208 HydrophobicContact CG1-CB 3.68Å; V196-L208 HydrophobicContact CG1-CD1 3.67Å; V196-L208 HydrophobicContact CG1-CG 4.27Å; V196-L208 HydrophobicContact CG2-CB 4.48Å; V196-I209 HydrophobicContact CB-CD1 4.38Å; V196-I209 HydrophobicContact CB-CG1 4.34Å; V196-I209 HydrophobicContact CG1-CG1 4.45Å; V196-I209 HydrophobicContact CG2-CD1 4.08Å; V196-I209 HydrophobicContact CG2-CG1 3.67Å; V196-R381 WeakPolarHBondContact CG2-O 3.4Å; V196-V383 HydrophobicContact CG2-CG1 4.4Å; V196-V383 HydrophobicContact CG2-CG2 3.66Å
197	A	83.4	Confident	86.8	Confident	13 Å²	13	57.8 Å²	57.8	11%	0.107	28%	0.275	C	S	.	.			trans	-56.1	133.3	-170.7	0	0	0	0	0	112	I193 V204 V413	I193-A197 HydrophobicContact CG2-CB 4.21Å; I193-A197 WeakPolarHBondContact O-CA 3.36Å; I193-A197 WeakPolarHBondContact O-CB 3.49Å; I193-A197 PolarHBondContact O-N 3.03Å; A197-V204 HydrophobicContact CB-CG2 3.97Å; A197-V413 HydrophobicContact CB-CG1 4.38Å
198	D	82.4	Confident	86.5	Confident	48 Å²	48	55.7 Å²	55.7	26%	0.257	27%	0.266	S	S	.	.	B	Isolated β-bridge	trans	-91.1	103.1	168.5	-157.2	-53.1	0	0	0	109.1	V196 E200 R201 K202 D203 R381	V196-D198 PolarHBondContact O-N 3.02Å; D198-E200 PolarHBondContact O-N 2.81Å; D198-E200 PolarHBondContact OD1-N 3.5Å; D198-R201 HydrophobicContact CB-CB 4.13Å; D198-R201 PolarHBondContact O-N 2.79Å; D198-R201 PolarHBondContact OD1-N 3.06Å; D198-K202 VanDerWaalsContact O-CA 3.3Å; D198-K202 WeakPolarHBondContact O-CA 3.4Å; D198-K202 PolarHBondContact O-N 3.13Å; D198-D203 PolarHBondContact N-O 2.88Å; D198-D203 PolarHBondContact O-N 3.38Å; D198-R381 VanDerWaalsContact CB-NH2 3.34Å; D198-R381 IonicContact OD2-CZ 3.31Å; D198-R381 IonicContact OD2-NH1 3.84Å; D198-R381 IonicContact OD2-NH2 2.98Å; D198-R381 PolarHBondContact OD2-NH2 3.09Å
199	M	77.4	Confident	86.5	Confident	90 Å²	90	55.7 Å²	55.7	44%	0.443	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-23.5	-176.2	-62.3	-63.9	-88.4	0	0	112.6	C157 P159	C157-M199 HydrophobicContact CB-CE 4.46Å; C157-M199 WeakPolarHBondContact O-CE 3.5Å; P159-M199 HydrophobicContact CG-CE 4.47Å
200	E	80.7	Confident	86.4	Confident	189 Å²	189	57 Å²	57	88%	0.883	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-44.5	176.7	-64	-172.6	169.7	0	0	110.9	D198	D198-E200 PolarHBondContact O-N 2.81Å; D198-E200 PolarHBondContact OD1-N 3.5Å
201	R	83.5	Confident	86.4	Confident	191 Å²	191	58.8 Å²	58.8	72%	0.721	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-15.3	178.5	-166.5	174.1	169.6	176.7	-6.6	113.3	D198 D203	D198-R201 HydrophobicContact CB-CB 4.13Å; D198-R201 PolarHBondContact O-N 2.79Å; D198-R201 PolarHBondContact OD1-N 3.06Å; R201-D203 HydrophobicContact CB-CB 4.38Å; R201-D203 HydrophobicContact CG-CB 4.01Å; R201-D203 IonicContact NE-OD2 2.88Å; R201-D203 PolarHBondContact O-N 3.42Å
202	K	83.8	Confident	86.3	Confident	108 Å²	108	56.9 Å²	56.9	47%	0.47	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	43.4	-170.3	-63.9	-175.4	174.5	-173.1	0	112.2	D198 R414	D198-K202 VanDerWaalsContact O-CA 3.3Å; D198-K202 WeakPolarHBondContact O-CA 3.4Å; D198-K202 PolarHBondContact O-N 3.13Å; K202-R414 VanDerWaalsContact O-CG 3.24Å; K202-R414 WeakPolarHBondContact O-CG 3.41Å
203	D	85.2	Confident	86.2	Confident	45 Å²	45	57.5 Å²	57.5	24%	0.241	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-130.2	148.7	-178.1	-159.4	20.5	0	0	0	110.7	D198 R201 R414	D198-D203 PolarHBondContact N-O 2.88Å; D198-D203 PolarHBondContact O-N 3.38Å; R201-D203 HydrophobicContact CB-CB 4.38Å; R201-D203 HydrophobicContact CG-CB 4.01Å; R201-D203 IonicContact NE-OD2 2.88Å; R201-D203 PolarHBondContact O-N 3.42Å; D203-R414 IonicContact OD1-CZ 3.17Å; D203-R414 IonicContact OD1-NE 2.85Å; D203-R414 PolarHBondContact OD1-NE 3.07Å; D203-R414 IonicContact OD1-NH2 2.73Å; D203-R414 PolarHBondContact OD1-NH2 3.25Å
204	V	85.4	Confident	86.1	Confident	5 Å²	5	59.2 Å²	59.2	3%	0.03	29%	0.285	C	S	.	.			trans	-129.4	118.7	-179.3	-173.3	0	0	0	0	107.3	I193 A197 I209 R410 V413	I193-V204 HydrophobicContact CD1-CG1 4.34Å; I193-V204 HydrophobicContact CG1-CG1 4.5Å; I193-V204 HydrophobicContact CG2-CG1 4.05Å; I193-V204 HydrophobicContact CG2-CG2 3.78Å; A197-V204 HydrophobicContact CB-CG2 3.97Å; V204-I209 HydrophobicContact CG1-CD1 4.44Å; V204-R410 HydrophobicContact CB-CB 4.32Å; V204-R410 HydrophobicContact CB-CG 4Å; V204-R410 HydrophobicContact CG2-CB 4.31Å; V204-R410 HydrophobicContact CG2-CG 4.18Å; V204-V413 HydrophobicContact CG2-CB 4.21Å; V204-V413 HydrophobicContact CG2-CG1 4.11Å; V204-V413 HydrophobicContact CG2-CG2 4.36Å
205	D	85.8	Confident	86.1	Confident	78 Å²	78	60.4 Å²	60.4	42%	0.417	29%	0.294	S	S	.	.			trans	-89.2	117.2	175.8	-169	-13	0	0	0	109.6	E207 L208	D205-E207 VanDerWaalsContact C-N 3.32Å; D205-E207 WeakPolarHBondContact OD1-CB 3.45Å; D205-E207 PolarHBondContact OD1-N 2.69Å; D205-L208 HydrophobicContact CB-CD1 4.09Å; D205-L208 HydrophobicContact CB-CG 4.21Å
206	F	86.3	Confident	86	Confident	49 Å²	49	59.6 Å²	59.6	22%	0.215	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-75.5	-19.7	179.3	-75	-44.6	0	0	0	113.6	I193 L208 I209 L406 C407 R410	I193-F206 HydrophobicContact CD1-CE1 4.34Å; F206-L208 PolarHBondContact O-N 3.43Å; F206-L208 VanDerWaalsContact O-N 3.17Å; F206-I209 HydrophobicContact CD1-CD1 4.35Å; F206-I209 PolarHBondContact O-N 2.98Å; F206-L406 HydrophobicContact CE1-CB 3.96Å; F206-L406 HydrophobicContact CZ-CB 4.46Å; F206-C407 VanDerWaalsContact CE2-SG 3.57Å; F206-C407 HydrophobicContact CZ-CB 4.38Å; F206-C407 VanDerWaalsContact CZ-SG 3.56Å; F206-R410 HydrophobicContact CE1-CB 4.46Å; F206-R410 HydrophobicContact CZ-CB 3.97Å; F206-R410 HydrophobicContact CZ-CG 4.35Å
207	E	85.9	Confident	85.8	Confident	156 Å²	156	61.4 Å²	61.4	73%	0.729	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-62.5	-25.6	176.8	-63.9	-173.3	169.7	0	0	111.4	D205 I209 L332	D205-E207 VanDerWaalsContact C-N 3.32Å; D205-E207 WeakPolarHBondContact OD1-CB 3.45Å; D205-E207 PolarHBondContact OD1-N 2.69Å; E207-I209 VanDerWaalsContact C-N 3.33Å; E207-L332 WeakPolarHBondContact O-CD2 3.41Å
208	L	86.9	Confident	86	Confident	23 Å²	23	67 Å²	67	12%	0.12	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-80.3	-10.7	177.9	-60	-179.7	0	0	0	114.1	V196 D205 F206 I335 R381 A382 V383	V196-L208 HydrophobicContact CG1-CB 3.68Å; V196-L208 HydrophobicContact CG1-CD1 3.67Å; V196-L208 HydrophobicContact CG1-CG 4.27Å; V196-L208 HydrophobicContact CG2-CB 4.48Å; D205-L208 HydrophobicContact CB-CD1 4.09Å; D205-L208 HydrophobicContact CB-CG 4.21Å; F206-L208 PolarHBondContact O-N 3.43Å; F206-L208 VanDerWaalsContact O-N 3.17Å; L208-I335 HydrophobicContact CD2-CD1 4.06Å; L208-I335 HydrophobicContact CD2-CG2 3.76Å; L208-R381 HydrophobicContact CD1-CB 4.46Å; L208-A382 WeakPolarHBondContact O-CA 3.44Å; L208-V383 PolarHBondContact O-N 3.36Å
209	I	90.9	Very high	86.1	Confident	15 Å²	15	66.5 Å²	66.5	8%	0.077	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	103.6	179.9	-55.9	179.9	0	0	0	108.6	I193 V196 V204 F206 E207 V383 I385 L406	I193-I209 HydrophobicContact CG1-CD1 4.09Å; V196-I209 HydrophobicContact CB-CD1 4.38Å; V196-I209 HydrophobicContact CB-CG1 4.34Å; V196-I209 HydrophobicContact CG1-CG1 4.45Å; V196-I209 HydrophobicContact CG2-CD1 4.08Å; V196-I209 HydrophobicContact CG2-CG1 3.67Å; V204-I209 HydrophobicContact CG1-CD1 4.44Å; F206-I209 HydrophobicContact CD1-CD1 4.35Å; F206-I209 PolarHBondContact O-N 2.98Å; E207-I209 VanDerWaalsContact C-N 3.33Å; I209-V383 WeakPolarHBondContact CA-O 3.48Å; I209-V383 HydrophobicContact CB-CG2 4.31Å; I209-V383 HydrophobicContact CG1-CG2 3.84Å; I209-V383 HydrophobicContact CG2-CG2 4.19Å; I209-I385 HydrophobicContact CG2-CD1 4.24Å; I209-L406 HydrophobicContact CD1-CD2 4.39Å; I209-L406 HydrophobicContact CG2-CD1 4.06Å
210	K	90.3	Very high	86.5	Confident	26 Å²	26	67.4 Å²	67.4	11%	0.113	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	131.4	173.7	-171.5	177.8	-179.8	-175	0	110	E212 V229 E329 L332 V383 T384 I385	K210-E212 WeakPolarHBondContact CE-OE2 3.35Å; K210-E212 IonicContact NZ-OE2 2.78Å; K210-V229 PolarHBondContact NZ-O 2.99Å; K210-E329 IonicContact NZ-OE1 3.77Å; K210-E329 PolarHBondContact NZ-OE1 3.27Å; K210-L332 HydrophobicContact CB-CD1 4.12Å; K210-L332 HydrophobicContact CD-CD1 4.16Å; K210-L332 HydrophobicContact CG-CD1 4.44Å; K210-V383 PolarHBondContact N-O 3.47Å; K210-T384 HydrophobicContact CB-CG2 4.06Å; K210-T384 HydrophobicContact CD-CG2 4.4Å; K210-T384 HydrophobicContact CG-CG2 4.25Å; K210-T384 CarbonylContact O-C 3.56Å; K210-T384 WeakPolarHBondContact O-CA 3.42Å; K210-I385 PolarHBondContact O-N 3.33Å
211	V	91.7	Very high	86.8	Confident	39 Å²	39	62.4 Å²	62.4	24%	0.236	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	105.6	171.8	-171.9	0	0	0	0	108.5	I385 I387 K399 L406	V211-I385 HydrophobicContact CG2-CD1 4.48Å; V211-I387 HydrophobicContact CG1-CD1 3.43Å; V211-I387 VanDerWaalsContact CG1-CD1 3.43Å; V211-I387 HydrophobicContact CG1-CG1 4.21Å; V211-K399 HydrophobicContact CG1-CB 4.36Å; V211-K399 HydrophobicContact CG1-CG 3.93Å; V211-L406 HydrophobicContact CG2-CD1 4.26Å
212	E	89.9	Confident	87.1	Confident	37 Å²	37	53.4 Å²	53.4	17%	0.173	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	135.9	-176.4	-169	59.1	-132.4	0	0	109.9	K210 M371 T384 I385 F386 I387	K210-E212 WeakPolarHBondContact CE-OE2 3.35Å; K210-E212 IonicContact NZ-OE2 2.78Å; E212-M371 HydrophobicContact CG-CE 3.83Å; E212-T384 HydrophobicContact CB-CG2 4.09Å; E212-I385 PolarHBondContact N-O 3.46Å; E212-F386 HydrophobicContact CB-CD2 4.45Å; E212-F386 CarbonylContact O-C 3.58Å; E212-F386 WeakPolarHBondContact O-CA 3.36Å; E212-I387 PolarHBondContact O-N 3.2Å
213	G	89.5	Confident	87.4	Confident	13 Å²	13	52 Å²	52	13%	0.134	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	125.4	-175.6	0	0	0	0	0	112.1	I387	G213-I387 WeakPolarHBondContact CA-O 3.43Å
214	K	87.8	Confident	87.7	Confident	35 Å²	35	51.9 Å²	51.9	15%	0.152	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	138.3	177.3	-96.8	-71.6	-170.5	175.7	0	112.3	D231 D369 M371 F386 I387 R388 I395	K214-D231 WeakPolarHBondContact CE-OD1 3.1Å; K214-D231 WeakPolarHBondContact CE-OD2 3.28Å; K214-D231 IonicContact NZ-OD1 2.51Å; K214-D231 PolarHBondContact NZ-OD1 3.02Å; K214-D231 IonicContact NZ-OD2 3.6Å; K214-D231 PolarHBondContact NZ-OD2 3.45Å; K214-D369 IonicContact NZ-OD2 3.6Å; K214-D369 PolarHBondContact NZ-OD2 3.39Å; K214-M371 HydrophobicContact CB-SD 4.36Å; K214-M371 HydrophobicContact CG-CE 3.87Å; K214-M371 HydrophobicContact CG-SD 3.58Å; K214-M371 VanDerWaalsContact CG-SD 3.58Å; K214-F386 HydrophobicContact CB-CE2 3.93Å; K214-F386 HydrophobicContact CB-CZ 4.05Å; K214-F386 HydrophobicContact CG-CE2 4.28Å; K214-I387 PolarHBondContact N-O 3.14Å; K214-R388 PolarHBondContact O-NE 2.94Å; K214-I395 VanDerWaalsContact C-CD1 3.47Å; K214-I395 WeakPolarHBondContact O-CD1 3.37Å
215	V	88.3	Confident	87.9	Confident	71 Å²	71	52.1 Å²	52.1	43%	0.43	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	142.5	176.9	-173.4	0	0	0	0	110.6	K392 I395	V215-K392 HydrophobicContact CG2-CB 4.31Å; V215-I395 HydrophobicContact CB-CD1 4.12Å; V215-I395 HydrophobicContact CG2-CD1 3.66Å
216	G	83.6	Confident	88	Confident	18 Å²	18	54.3 Å²	54.3	19%	0.186	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	107	157.8	-179.6	0	0	0	0	0	112.3	R388 G389	G216-R388 VanDerWaalsContact C-NH2 3.33Å; G216-R388 VanDerWaalsContact O-CZ 3.3Å; G216-R388 PolarHBondContact O-NE 2.81Å; G216-R388 PolarHBondContact O-NH2 2.76Å; G216-R388 VanDerWaalsContact O-NH2 3.13Å; G216-G389 PolarHBondContact N-O 3.37Å
217	G	83.6	Confident	88.1	Confident	41 Å²	41	52 Å²	52	42%	0.423	27%	0.271	S	S	.	.	S	Bend	trans	77.5	-167.1	-173.6	0	0	0	0	0	112.8
218	K	86.4	Confident	88.2	Confident	131 Å²	131	44.7 Å²	44.7	57%	0.57	24%	0.237	S	C	*	.			trans	-105.7	160.5	175.1	-62.2	-179.7	-178	178.8	0	110.3	E220 D221 R388	K218-E220 HydrophobicContact CB-CB 4.41Å; K218-E220 PolarHBondContact O-N 3.13Å; K218-D221 PolarHBondContact N-OD2 3.49Å; K218-D221 WeakPolarHBondContact O-CB 3.4Å; K218-D221 PolarHBondContact O-N 2.86Å; K218-D221 VanDerWaalsContact O-N 3.09Å; K218-R388 VanDerWaalsContact O-CB 3.3Å; K218-R388 WeakPolarHBondContact O-CB 2.87Å
219	L	84.7	Confident	88.4	Confident	37 Å²	37	43.6 Å²	43.6	19%	0.194	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-58.5	-31.8	171.3	-83.1	164.8	0	0	0	112.8	M185 D221 T222 R388 I394 A398	M185-L219 HydrophobicContact CE-CD2 4.41Å; M185-L219 WeakPolarHBondContact CE-O 3.47Å; L219-D221 PolarHBondContact O-N 3.41Å; L219-T222 VanDerWaalsContact O-CB 3.26Å; L219-T222 WeakPolarHBondContact O-CB 3.47Å; L219-T222 PolarHBondContact O-N 3.26Å; L219-T222 PolarHBondContact O-OG1 3.25Å; L219-R388 WeakPolarHBondContact CA-O 3.29Å; L219-R388 VanDerWaalsContact CD2-O 3.3Å; L219-R388 WeakPolarHBondContact CD2-O 3.4Å; L219-I394 HydrophobicContact CD1-CG2 3.6Å; L219-I394 HydrophobicContact CD2-CG2 3.96Å; L219-I394 HydrophobicContact CG-CG2 3.97Å; L219-A398 HydrophobicContact CD2-CB 4.02Å
220	E	86.3	Confident	88.4	Confident	108 Å²	108	43 Å²	43	51%	0.505	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-62.6	-22.6	176.6	-65	166.8	-174.7	0	0	113.1	C181 Q184 K218 T222	C181-E220 VanDerWaalsContact SG-CG 3.54Å; Q184-E220 PolarHBondContact NE2-O 3.4Å; Q184-E220 PolarHBondContact OE1-O 2.96Å; K218-E220 HydrophobicContact CB-CB 4.41Å; K218-E220 PolarHBondContact O-N 3.13Å; E220-T222 PolarHBondContact O-N 3.36Å
221	D	87.5	Confident	88.2	Confident	84 Å²	84	44.4 Å²	44.4	45%	0.449	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-79.4	5.7	179.1	-55.8	-35.7	0	0	0	112.5	K218 L219 R388	K218-D221 PolarHBondContact N-OD2 3.49Å; K218-D221 WeakPolarHBondContact O-CB 3.4Å; K218-D221 PolarHBondContact O-N 2.86Å; K218-D221 VanDerWaalsContact O-N 3.09Å; L219-D221 PolarHBondContact O-N 3.41Å; D221-R388 HydrophobicContact CB-CB 4.16Å; D221-R388 HydrophobicContact CB-CG 4.19Å
222	T	89.2	Confident	88.1	Confident	3 Å²	3	46.3 Å²	46.3	2%	0.018	24%	0.242	C	C	.	.			trans	-69.9	132.5	178.2	-61.7	0	0	0	0	110.4	Q184 M185 I188 L219 E220 I385 F386 I387 R388	Q184-T222 PolarHBondContact NE2-O 3.12Å; M185-T222 VanDerWaalsContact CE-CB 3.5Å; M185-T222 HydrophobicContact CE-CG2 3.68Å; M185-T222 WeakPolarHBondContact CE-OG1 3.32Å; M185-T222 HydrophobicContact SD-CG2 3.62Å; I188-T222 HydrophobicContact CD1-CG2 4.16Å; I188-T222 WeakPolarHBondContact CD1-O 3.46Å; L219-T222 VanDerWaalsContact O-CB 3.26Å; L219-T222 WeakPolarHBondContact O-CB 3.47Å; L219-T222 PolarHBondContact O-N 3.26Å; L219-T222 PolarHBondContact O-OG1 3.25Å; E220-T222 PolarHBondContact O-N 3.36Å; T222-I385 HydrophobicContact CG2-CG2 4.4Å; T222-F386 WeakPolarHBondContact CA-O 3.39Å; T222-F386 WeakPolarHBondContact CG2-O 3.48Å; T222-I387 HydrophobicContact CG2-CB 4.4Å; T222-I387 HydrophobicContact CG2-CG1 4.08Å; T222-R388 PolarHBondContact OG1-N 3.15Å
223	Q	90.3	Very high	87.9	Confident	77 Å²	77	49.8 Å²	49.8	36%	0.36	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	146.5	-172.2	56.2	178.6	0.9	0	0	112.3	I225 F386	Q223-I225 HydrophobicContact CG-CD1 4.29Å; Q223-I225 HydrophobicContact CG-CG1 4.21Å; Q223-F386 HydrophobicContact CG-CB 4.25Å; Q223-F386 HydrophobicContact CG-CD1 4.13Å; Q223-F386 PolarHBondContact N-O 2.88Å; Q223-F386 VanDerWaalsContact N-O 3.07Å; Q223-F386 PolarHBondContact O-N 3.48Å
224	L	91.9	Very high	87.9	Confident	43 Å²	43	49.5 Å²	49.5	23%	0.225	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	118.8	169.5	-178.3	61.2	0	0	0	109.5	I188 N191 A192 V383 I385	I188-L224 HydrophobicContact CG1-CB 4.41Å; I188-L224 HydrophobicContact CG2-CB 4.05Å; I188-L224 HydrophobicContact CG2-CD1 4.48Å; N191-L224 HydrophobicContact CB-CD2 3.61Å; A192-L224 HydrophobicContact CB-CD1 3.84Å; A192-L224 HydrophobicContact CB-CD2 4.48Å; L224-V383 HydrophobicContact CD1-CB 4.19Å; L224-I385 HydrophobicContact CD1-CG1 3.92Å
225	I	89.7	Confident	87.8	Confident	11 Å²	11	48.4 Å²	48.4	6%	0.056	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	118.4	176.4	-65.2	167.5	0	0	0	108.1	Q223 G227 V229 V373 T375 T384 F386	Q223-I225 HydrophobicContact CG-CD1 4.29Å; Q223-I225 HydrophobicContact CG-CG1 4.21Å; I225-G227 VanDerWaalsContact C-N 3.27Å; I225-G227 PolarHBondContact O-N 3.44Å; I225-V229 HydrophobicContact CB-CG2 4.32Å; I225-V229 HydrophobicContact CD1-CG2 3.36Å; I225-V229 HydrophobicContact CG1-CG2 4.43Å; I225-V229 HydrophobicContact CG2-CG2 4.23Å; I225-V373 HydrophobicContact CD1-CG1 4.17Å; I225-V373 HydrophobicContact CG2-CG1 3.73Å; I225-T375 HydrophobicContact CG2-CG2 3.82Å; I225-T384 PolarHBondContact N-O 3.03Å; I225-T384 PolarHBondContact O-N 2.99Å; I225-F386 HydrophobicContact CD1-CB 3.82Å; I225-F386 HydrophobicContact CD1-CG 4.39Å
226	K	87.6	Confident	87.8	Confident	124 Å²	124	47.1 Å²	47.1	54%	0.539	24%	0.239	S	C	.	.	S	Bend	trans	-77.6	80.2	172.7	-66.7	-176.3	178.9	-177.8	0	109.8
227	G	87.4	Confident	87.8	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	154.5	-152.8	-177.2	0	0	0	0	0	111.1	I225 I374 A382 V383 T384	I225-G227 VanDerWaalsContact C-N 3.27Å; I225-G227 PolarHBondContact O-N 3.44Å; G227-I374 WeakPolarHBondContact CA-O 3.42Å; G227-A382 PolarHBondContact N-O 3.3Å; G227-V383 CarbonylContact O-C 3.47Å; G227-T384 WeakPolarHBondContact O-CB 3.31Å; G227-T384 PolarHBondContact O-N 3.49Å; G227-T384 VanDerWaalsContact O-N 3.17Å; G227-T384 PolarHBondContact O-OG1 2.76Å
228	V	89.4	Confident	87.9	Confident	2 Å²	2	57 Å²	57	1%	0.012	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.9	-173.7	-172.8	0	0	0	0	110.8	V230 L332 I333 A336 I374 T384	V228-V230 HydrophobicContact CG1-CG2 4.12Å; V228-L332 HydrophobicContact CG2-CB 4.24Å; V228-I333 HydrophobicContact CB-CG1 4.12Å; V228-I333 HydrophobicContact CG1-CG1 3.87Å; V228-I333 HydrophobicContact CG2-CG1 4.32Å; V228-A336 HydrophobicContact CG2-CB 3.76Å; V228-I374 PolarHBondContact N-O 3.12Å; V228-I374 VanDerWaalsContact N-O 3.15Å; V228-I374 PolarHBondContact O-N 3.39Å; V228-T384 WeakPolarHBondContact CA-OG1 3.43Å
229	V	90.5	Very high	87.9	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	134	167.5	-175	0	0	0	0	109.5	K210 I225 M371 V373 T384	K210-V229 PolarHBondContact NZ-O 2.99Å; I225-V229 HydrophobicContact CB-CG2 4.32Å; I225-V229 HydrophobicContact CD1-CG2 3.36Å; I225-V229 HydrophobicContact CG1-CG2 4.43Å; I225-V229 HydrophobicContact CG2-CG2 4.23Å; V229-M371 HydrophobicContact CG1-CB 4.24Å; V229-M371 HydrophobicContact CG1-CE 3.79Å; V229-M371 HydrophobicContact CG1-SD 4.03Å; V229-V373 HydrophobicContact CG1-CG2 4.33Å; V229-V373 HydrophobicContact CG2-CG1 4.44Å; V229-V373 HydrophobicContact CG2-CG2 4.2Å; V229-T384 HydrophobicContact CB-CG2 3.85Å; V229-T384 HydrophobicContact CG2-CG2 3.76Å; V229-T384 PolarHBondContact N-OG1 3.36Å
230	V	89.8	Confident	87.9	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	130.3	178.2	-175.5	0	0	0	0	108.5	V228 K232 I325 I333 L372	V228-V230 HydrophobicContact CG1-CG2 4.12Å; V230-K232 HydrophobicContact CG1-CB 3.9Å; V230-K232 HydrophobicContact CG1-CG 3.65Å; V230-K232 PolarHBondContact O-N 2.77Å; V230-I325 HydrophobicContact CG1-CG1 4.32Å; V230-I333 HydrophobicContact CG2-CD1 3.85Å; V230-L372 PolarHBondContact N-O 2.79Å; V230-L372 PolarHBondContact O-N 3.33Å
231	D	87.6	Confident	87.9	Confident	57 Å²	57	52.2 Å²	52.2	31%	0.305	26%	0.262	S	S	.	.	S	Bend	trans	-78.7	59	174.9	-166.3	23.3	0	0	0	111.1	K214 M371	K214-D231 WeakPolarHBondContact CE-OD1 3.1Å; K214-D231 WeakPolarHBondContact CE-OD2 3.28Å; K214-D231 IonicContact NZ-OD1 2.51Å; K214-D231 PolarHBondContact NZ-OD1 3.02Å; K214-D231 IonicContact NZ-OD2 3.6Å; K214-D231 PolarHBondContact NZ-OD2 3.45Å; D231-M371 HydrophobicContact CB-CE 3.57Å
232	K	88.6	Confident	87.9	Confident	79 Å²	79	50.7 Å²	50.7	34%	0.343	26%	0.262	S	S	.	.			trans	-141.6	147.4	177.1	-59.6	-64.6	159.6	-161.4	0	110.1	V230 V322 W324 L372	V230-K232 HydrophobicContact CG1-CB 3.9Å; V230-K232 HydrophobicContact CG1-CG 3.65Å; V230-K232 PolarHBondContact O-N 2.77Å; K232-V322 HydrophobicContact CB-CG1 3.76Å; K232-V322 HydrophobicContact CG-CG1 4.4Å; K232-W324 VanDerWaalsContact CE-O 3.25Å; K232-W324 WeakPolarHBondContact CE-O 3.32Å; K232-L372 WeakPolarHBondContact O-CB 3.39Å; K232-L372 PolarHBondContact O-N 2.96Å
233	E	87.1	Confident	87.8	Confident	110 Å²	110	51.8 Å²	51.8	51%	0.514	27%	0.267	S	S	.	.			trans	-92.6	167	170.3	57.5	-177	-174.6	0	0	111.1	E361 H370	E233-E361 WeakPolarHBondContact CB-OE1 3.46Å; E233-H370 HydrophobicContact CB-CB 4.05Å; E233-H370 IonicContact OE2-CD2 3.53Å
234	F	88.2	Confident	87.7	Confident	6 Å²	6	53.8 Å²	53.8	3%	0.026	28%	0.28	C	S	.	.			trans	-61.8	145.3	165.8	-76	-73.3	0	0	0	110.1	H236 M239 P240 L243 L299 P320 V322 V359 E361 L372	F234-H236 PolarHBondContact O-N 2.9Å; F234-H236 VanDerWaalsContact O-N 3.15Å; F234-M239 HydrophobicContact CB-CB 4.15Å; F234-M239 HydrophobicContact CB-SD 4.31Å; F234-M239 HydrophobicContact CG-CB 4.48Å; F234-P240 WeakPolarHBondContact CE2-O 3.38Å; F234-L243 HydrophobicContact CE1-CD1 4.28Å; F234-L243 HydrophobicContact CZ-CD1 4.27Å; F234-L299 HydrophobicContact CE1-CD1 3.75Å; F234-P320 HydrophobicContact CD1-CB 3.99Å; F234-P320 HydrophobicContact CE1-CB 3.82Å; F234-V322 HydrophobicContact CD1-CG2 4.35Å; F234-V359 HydrophobicContact CZ-CG1 4.22Å; F234-E361 HydrophobicContact CD2-CB 3.84Å; F234-E361 HydrophobicContact CD2-CG 4.47Å; F234-E361 HydrophobicContact CE2-CB 3.75Å; F234-E361 PolarHBondContact N-OE1 3.37Å; F234-L372 HydrophobicContact CD1-CD1 4.23Å; F234-L372 HydrophobicContact CD2-CD1 4.37Å; F234-L372 HydrophobicContact CE1-CD1 3.75Å; F234-L372 HydrophobicContact CE2-CD1 3.9Å; F234-L372 HydrophobicContact CZ-CD1 3.56Å
235	S	86.9	Confident	87.4	Confident	12 Å²	12	58 Å²	58	8%	0.084	30%	0.304	C	S	.	.	S	Bend	trans	-65.8	-24.6	-169.7	66.5	0	0	0	0	115	M239 F306 N311 A321	S235-M239 WeakPolarHBondContact OG-CE 3.28Å; S235-M239 PolarHBondContact OG-SD 3.41Å; S235-F306 VanDerWaalsContact CB-CE2 3.43Å; S235-F306 VanDerWaalsContact CB-CZ 3.5Å; S235-N311 WeakPolarHBondContact CB-OD1 3.47Å; S235-N311 PolarHBondContact OG-OD1 3.4Å; S235-A321 WeakPolarHBondContact CB-O 3.42Å; S235-A321 PolarHBondContact N-O 3.2Å; S235-A321 PolarHBondContact OG-O 3.45Å
236	H	86.7	Confident	87.3	Confident	44 Å²	44	57.6 Å²	57.6	20%	0.204	30%	0.301	C	S	.	.	S	Bend	trans	-127.8	133.2	176	-167.3	-80.5	0	0	0	111.2	F234 Q238 M239	F234-H236 PolarHBondContact O-N 2.9Å; F234-H236 VanDerWaalsContact O-N 3.15Å; H236-Q238 WeakPolarHBondContact ND1-CB 3.47Å; H236-Q238 PolarHBondContact ND1-N 2.75Å; H236-Q238 PolarHBondContact O-N 2.98Å; H236-Q238 VanDerWaalsContact O-N 3.09Å; H236-M239 HydrophobicContact CB-CE 3.98Å; H236-M239 HydrophobicContact CB-CG 4Å; H236-M239 HydrophobicContact CB-SD 4.05Å; H236-M239 VanDerWaalsContact O-CB 3.28Å; H236-M239 WeakPolarHBondContact O-CB 3.35Å; H236-M239 PolarHBondContact O-N 3.49Å
237	P	84.5	Confident	87.4	Confident	117 Å²	117	56.7 Å²	56.7	76%	0.76	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-23.7	-175.1	-25.8	34.1	0	0	0	115.9	M239	P237-M239 VanDerWaalsContact C-N 3.32Å
238	Q	86.2	Confident	87.6	Confident	149 Å²	149	56.6 Å²	56.6	70%	0.696	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-5	177	-64.5	179.2	-18.4	0	0	113.6	H236 L315	H236-Q238 WeakPolarHBondContact ND1-CB 3.47Å; H236-Q238 PolarHBondContact ND1-N 2.75Å; H236-Q238 PolarHBondContact O-N 2.98Å; H236-Q238 VanDerWaalsContact O-N 3.09Å; Q238-L315 HydrophobicContact CB-CD1 4.21Å; Q238-L315 HydrophobicContact CB-CD2 4.07Å
239	M	85.9	Confident	87.8	Confident	8 Å²	8	56.5 Å²	56.5	4%	0.039	30%	0.296	C	S	.	.	S	Bend	trans	-65.6	151.4	175.2	-75.1	175.8	174.5	0	0	111	F234 S235 H236 P237 K241 L314 L315 P320	F234-M239 HydrophobicContact CB-CB 4.15Å; F234-M239 HydrophobicContact CB-SD 4.31Å; F234-M239 HydrophobicContact CG-CB 4.48Å; S235-M239 WeakPolarHBondContact OG-CE 3.28Å; S235-M239 PolarHBondContact OG-SD 3.41Å; H236-M239 HydrophobicContact CB-CE 3.98Å; H236-M239 HydrophobicContact CB-CG 4Å; H236-M239 HydrophobicContact CB-SD 4.05Å; H236-M239 VanDerWaalsContact O-CB 3.28Å; H236-M239 WeakPolarHBondContact O-CB 3.35Å; H236-M239 PolarHBondContact O-N 3.49Å; P237-M239 VanDerWaalsContact C-N 3.32Å; M239-K241 PolarHBondContact O-N 3.28Å; M239-L314 HydrophobicContact CE-CB 4.19Å; M239-L315 HydrophobicContact CE-CB 4.41Å; M239-L315 HydrophobicContact CG-CD1 3.78Å; M239-P320 HydrophobicContact SD-CB 4.37Å
240	P	85.4	Confident	87.9	Confident	61 Å²	61	56.6 Å²	56.6	40%	0.396	30%	0.296	S	S	.	.			trans	-60.6	128.4	175	26.1	-35.5	0	0	0	110.6	F234 A242 L243 P320	F234-P240 WeakPolarHBondContact CE2-O 3.38Å; P240-A242 VanDerWaalsContact C-N 3.28Å; P240-A242 PolarHBondContact O-N 3.21Å; P240-L243 HydrophobicContact CB-CD2 4.39Å; P240-L243 HydrophobicContact CG-CD2 3.91Å; P240-P320 HydrophobicContact CG-CG 3.56Å
241	K	85.9	Confident	88	Confident	107 Å²	107	56.5 Å²	56.5	47%	0.465	30%	0.296	S	S	.	.	S	Bend	trans	-78.5	-11.5	-178.3	-60.3	-164.8	171.2	-162.4	0	114.2	M239 K360 E361	M239-K241 PolarHBondContact O-N 3.28Å; K241-K360 WeakPolarHBondContact O-CA 3.3Å; K241-E361 HydrophobicContact CB-CB 4.33Å; K241-E361 WeakPolarHBondContact CD-OE2 3.35Å; K241-E361 WeakPolarHBondContact CE-OE2 3.26Å; K241-E361 WeakPolarHBondContact CG-OE2 3.23Å; K241-E361 IonicContact NZ-OE2 3.9Å; K241-E361 PolarHBondContact O-N 3.13Å
242	A	87.2	Confident	88.2	Confident	53 Å²	53	55.5 Å²	55.5	44%	0.438	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	134.8	177.7	0	0	0	0	0	109.5	P240 V359 K360	P240-A242 VanDerWaalsContact C-N 3.28Å; P240-A242 PolarHBondContact O-N 3.21Å; A242-V359 CarbonylContact C-O 3.53Å; A242-V359 WeakPolarHBondContact CA-O 3.15Å; A242-K360 HydrophobicContact CB-CG 4.34Å
243	L	87.4	Confident	88.1	Confident	25 Å²	25	52.5 Å²	52.5	13%	0.131	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	124.3	177.5	-65.8	165.1	0	0	0	108.3	F234 P240 L299 P320 L358 V359	F234-L243 HydrophobicContact CE1-CD1 4.28Å; F234-L243 HydrophobicContact CZ-CD1 4.27Å; P240-L243 HydrophobicContact CB-CD2 4.39Å; P240-L243 HydrophobicContact CG-CD2 3.91Å; L243-L299 HydrophobicContact CD1-CB 4.35Å; L243-L299 HydrophobicContact CD1-CD1 4.12Å; L243-P320 HydrophobicContact CD1-CB 3.87Å; L243-P320 HydrophobicContact CD1-CG 3.78Å; L243-P320 HydrophobicContact CD2-CG 4.11Å; L243-P320 HydrophobicContact CG-CG 4.45Å; L243-L358 WeakPolarHBondContact O-CA 3.26Å; L243-V359 HydrophobicContact CB-CB 4.4Å; L243-V359 PolarHBondContact N-O 3.06Å; L243-V359 PolarHBondContact O-N 2.99Å
244	N	87.1	Confident	88.1	Confident	119 Å²	119	49.4 Å²	49.4	64%	0.636	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.4	147.7	172.8	-58.8	-23.9	0	0	0	109.2	A246 G357 L358	N244-A246 PolarHBondContact O-N 3.29Å; N244-G357 CarbonylContact C-O 3.29Å; N244-G357 WeakPolarHBondContact CA-O 3.48Å; N244-L358 WeakPolarHBondContact OD1-CD1 3.43Å
245	D	86.8	Confident	87.9	Confident	133 Å²	133	49.1 Å²	49.1	71%	0.711	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	51	55.6	-178	-66	-50.3	0	0	0	112.5	K247 N298 A356 G357	D245-K247 PolarHBondContact O-N 2.82Å; D245-N298 PolarHBondContact O-ND2 2.78Å; D245-A356 CarbonylContact C-O 3.59Å; D245-G357 PolarHBondContact N-O 2.77Å
246	A	86.1	Confident	87.8	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.008	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	118	-178.9	0	0	0	0	0	112.7	N244 I248 N298 T355 A356 V359	N244-A246 PolarHBondContact O-N 3.29Å; A246-I248 HydrophobicContact CB-CD1 4.27Å; A246-I248 HydrophobicContact CB-CG1 3.98Å; A246-N298 WeakPolarHBondContact CA-ND2 3.39Å; A246-N298 VanDerWaalsContact CA-OD1 3.25Å; A246-N298 WeakPolarHBondContact CA-OD1 3.23Å; A246-T355 WeakPolarHBondContact O-CA 3.32Å; A246-A356 WeakPolarHBondContact CA-O 3.39Å; A246-A356 HydrophobicContact CB-CB 4.33Å; A246-A356 PolarHBondContact N-O 3.15Å; A246-A356 PolarHBondContact O-N 3.27Å; A246-V359 HydrophobicContact CB-CB 4.42Å; A246-V359 HydrophobicContact CB-CG2 3.53Å
247	K	91.3	Very high	87.5	Confident	105 Å²	105	50 Å²	50	46%	0.457	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	103.9	162.8	-69.9	-177.9	-178.9	179	0	109.2	D245 G296 A297 N298 L299 L353 G354	D245-K247 PolarHBondContact O-N 2.82Å; K247-G296 VanDerWaalsContact CD-O 3.29Å; K247-G296 WeakPolarHBondContact CD-O 3.29Å; K247-A297 CarbonylContact O-C 3.51Å; K247-A297 WeakPolarHBondContact O-CA 3.41Å; K247-N298 VanDerWaalsContact N-CG 3.27Å; K247-N298 PolarHBondContact N-ND2 2.98Å; K247-N298 PolarHBondContact N-OD1 3.28Å; K247-N298 PolarHBondContact O-N 3.24Å; K247-N298 PolarHBondContact O-OD1 3.23Å; K247-L299 PolarHBondContact O-N 3Å; K247-L353 HydrophobicContact CB-CD1 4.4Å; K247-G354 CarbonylContact C-O 3.51Å; K247-G354 WeakPolarHBondContact CA-O 3.3Å
248	I	91.6	Very high	87.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	121.3	-166.4	-54.4	178.1	0	0	0	109.5	A246 I250 L299 I301 T337 G354 A356 V359 I374	A246-I248 HydrophobicContact CB-CD1 4.27Å; A246-I248 HydrophobicContact CB-CG1 3.98Å; I248-I250 HydrophobicContact CG2-CG1 4.07Å; I248-L299 WeakPolarHBondContact CA-O 3.4Å; I248-L299 HydrophobicContact CD1-CD2 4.19Å; I248-L299 HydrophobicContact CG1-CB 4.31Å; I248-L299 HydrophobicContact CG1-CD2 4.04Å; I248-L299 HydrophobicContact CG2-CD2 4.33Å; I248-I301 HydrophobicContact CG2-CB 4.28Å; I248-I301 HydrophobicContact CG2-CD1 3.6Å; I248-I301 HydrophobicContact CG2-CG1 4.04Å; I248-T337 HydrophobicContact CD1-CG2 3.8Å; I248-G354 PolarHBondContact N-O 2.83Å; I248-G354 PolarHBondContact O-N 3.35Å; I248-A356 HydrophobicContact CD1-CB 3.9Å; I248-V359 HydrophobicContact CD1-CG2 4.1Å; I248-I374 HydrophobicContact CD1-CD1 4.38Å; I248-I374 HydrophobicContact CD1-CG2 4.11Å
249	A	93	Very high	87	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	116.4	167.9	0	0	0	0	0	109.1	L251 V292 A297 L299 I301 L348 L353	A249-L251 HydrophobicContact CB-CG 4.35Å; A249-V292 HydrophobicContact CB-CG1 4.18Å; A249-A297 HydrophobicContact CB-CB 3.93Å; A249-L299 PolarHBondContact N-O 3.47Å; A249-I301 PolarHBondContact O-N 3.11Å; A249-L348 HydrophobicContact CB-CD1 4.32Å; A249-L348 HydrophobicContact CB-CD2 4.47Å; A249-L353 HydrophobicContact CB-CD2 3.87Å
250	I	93.5	Very high	86.9	Confident	1 Å²	1	51 Å²	51	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	108.8	-179.6	-55.4	177.2	0	0	0	108.3	I248 I330 I333 A334 I341 V342	I248-I250 HydrophobicContact CG2-CG1 4.07Å; I250-I330 HydrophobicContact CG2-CD1 3.76Å; I250-I330 HydrophobicContact CG2-CG1 3.41Å; I250-I330 VanDerWaalsContact CG2-CG1 3.41Å; I250-I333 HydrophobicContact CD1-CG2 4.01Å; I250-I333 HydrophobicContact CG1-CG2 4.41Å; I250-A334 VanDerWaalsContact CD1-CA 3.46Å; I250-A334 HydrophobicContact CD1-CB 3.84Å; I250-I341 HydrophobicContact CG2-CB 4.48Å; I250-I341 HydrophobicContact CG2-CG1 4.04Å; I250-V342 PolarHBondContact O-N 3.48Å
251	L	92	Very high	86.7	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	132.3	-167.8	-56.6	174.4	0	0	0	111.3	A249 F255 V292 I301 C302 Q303 V342 F345 L348	A249-L251 HydrophobicContact CB-CG 4.35Å; L251-F255 HydrophobicContact CD1-CE2 3.9Å; L251-F255 HydrophobicContact CD1-CZ 3.98Å; L251-V292 HydrophobicContact CD1-CG2 4.47Å; L251-I301 PolarHBondContact N-O 3.28Å; L251-C302 WeakPolarHBondContact O-CA 3.46Å; L251-Q303 PolarHBondContact O-N 3.44Å; L251-V342 WeakPolarHBondContact CA-O 3.37Å; L251-V342 HydrophobicContact CD2-CB 4.19Å; L251-F345 HydrophobicContact CD1-CD1 4.34Å; L251-F345 HydrophobicContact CD1-CE1 3.75Å; L251-L348 HydrophobicContact CD2-CD1 4.12Å
252	T	91.2	Very high	86.8	Confident	35 Å²	35	58.7 Å²	58.7	22%	0.215	32%	0.316	C	S	.	.	S	Bend	trans	-100.6	1.8	168.2	62.9	0	0	0	0	112.5	W304 I330 I341 V342 P343	T252-W304 PolarHBondContact O-NE1 2.89Å; T252-I330 HydrophobicContact CG2-CD1 4.34Å; T252-I341 HydrophobicContact CG2-CG2 3.25Å; T252-V342 PolarHBondContact N-O 3.39Å; T252-P343 VanDerWaalsContact OG1-CA 3.3Å; T252-P343 WeakPolarHBondContact OG1-CA 3.45Å
253	C	86.5	Confident	86.5	Confident	16 Å²	16	65.8 Å²	65.8	11%	0.108	34%	0.337	C	S	.	.	S	Bend	trans	-92.1	139.3	171.1	50.5	0	0	0	0	110.7	P343 F345	C253-P343 WeakPolarHBondContact CB-O 3.36Å; C253-F345 HydrophobicContact CB-CE2 4.03Å; C253-F345 HydrophobicContact CB-CZ 4.4Å; C253-F345 WeakPolarHBondContact SG-CE2 3.28Å; C253-F345 WeakPolarHBondContact SG-CZ 3.36Å
254	P	86.3	Confident	86.2	Confident	45 Å²	45	70 Å²	70	29%	0.292	36%	0.355	S	S	.	.			trans	-70	151	170	29.5	-33.2	0	0	0	110.7	E256 W304 G305	P254-E256 VanDerWaalsContact C-N 3.29Å; P254-E256 HydrophobicContact CB-CB 4.39Å; P254-E256 HydrophobicContact CB-CG 4.17Å; P254-E256 HydrophobicContact CG-CB 4.47Å; P254-E256 PolarHBondContact O-N 3.44Å; P254-E256 VanDerWaalsContact O-N 3.12Å; P254-W304 HydrophobicContact CB-CB 3.84Å; P254-G305 WeakPolarHBondContact CB-O 3.25Å
255	F	84.9	Confident	85.9	Confident	1 Å²	1	72 Å²	72	0%	0.004	36%	0.358	C	S	.	.	S	Bend	trans	-79.6	86.8	160.4	-72.9	-92.6	0	0	0	107.8	L251 F285 M288 I289 V292 A300 C302 F306 A310 L314 F345	L251-F255 HydrophobicContact CD1-CE2 3.9Å; L251-F255 HydrophobicContact CD1-CZ 3.98Å; F255-F285 HydrophobicContact CB-CE1 4.45Å; F255-F285 WeakPolarHBondContact O-CE1 3.34Å; F255-M288 HydrophobicContact CD1-CB 4.43Å; F255-I289 HydrophobicContact CE1-CG1 4.37Å; F255-V292 HydrophobicContact CE1-CG2 4.29Å; F255-V292 HydrophobicContact CZ-CG2 4.1Å; F255-A300 HydrophobicContact CE2-CB 4.13Å; F255-A300 HydrophobicContact CZ-CB 4.22Å; F255-C302 VanDerWaalsContact CD2-SG 3.53Å; F255-C302 WeakPolarHBondContact CE2-SG 3.4Å; F255-F306 HydrophobicContact CB-CB 3.65Å; F255-F306 HydrophobicContact CB-CD1 4.39Å; F255-F306 HydrophobicContact CB-CG 4.28Å; F255-F306 AromaticContact CD2-CD1 3.88Å; F255-F306 HydrophobicContact CD2-CD1 3.88Å; F255-F306 HydrophobicContact CD2-CE1 4.44Å; F255-F306 WeakPolarHBondContact O-CB 3.36Å; F255-A310 HydrophobicContact CB-CB 4.33Å; F255-L314 HydrophobicContact CE1-CD2 4.17Å; F255-L314 HydrophobicContact CZ-CD2 4.17Å; F255-F345 AromaticContact CD1-CE1 3.98Å; F255-F345 HydrophobicContact CD1-CE1 3.98Å; F255-F345 AromaticContact CD1-CZ 3.85Å; F255-F345 HydrophobicContact CD1-CZ 3.85Å; F255-F345 HydrophobicContact CD2-CZ 4.36Å; F255-F345 AromaticContact CE1-CE1 3.6Å; F255-F345 HydrophobicContact CE1-CE1 3.6Å; F255-F345 AromaticContact CE1-CZ 3.97Å; F255-F345 HydrophobicContact CE1-CZ 3.97Å; F255-F345 HydrophobicContact CE2-CE1 4.23Å; F255-F345 HydrophobicContact CE2-CZ 4.48Å; F255-F345 HydrophobicContact CG-CE1 4.45Å; F255-F345 HydrophobicContact CG-CZ 4.05Å; F255-F345 AromaticContact CZ-CE1 3.75Å; F255-F345 HydrophobicContact CZ-CE1 3.75Å; F255-F345 HydrophobicContact CZ-CZ 4.3Å
256	E	83.8	Confident	85.7	Confident	58 Å²	58	70.6 Å²	70.6	27%	0.271	35%	0.35	S	S	.	.	S	Bend	trans	-143.5	156.1	174.5	-76.6	-174.6	-145.4	0	0	109.8	P254 K259 M288	P254-E256 VanDerWaalsContact C-N 3.29Å; P254-E256 HydrophobicContact CB-CB 4.39Å; P254-E256 HydrophobicContact CB-CG 4.17Å; P254-E256 HydrophobicContact CG-CB 4.47Å; P254-E256 PolarHBondContact O-N 3.44Å; P254-E256 VanDerWaalsContact O-N 3.12Å; E256-K259 IonicContact OE2-NZ 2.68Å; E256-K259 PolarHBondContact OE2-NZ 3.12Å; E256-M288 WeakPolarHBondContact O-CE 3.15Å
257	P	81.9	Confident	85.6	Confident	16 Å²	16	77.1 Å²	77.1	10%	0.104	39%	0.385	C	S	.	.			trans	-59.3	141.5	172.1	-18	33.4	0	0	0	109.3	K259 E281 F285	P257-K259 PolarHBondContact O-N 2.87Å; P257-E281 HydrophobicContact CB-CG 4.25Å; P257-E281 HydrophobicContact CG-CB 4.27Å; P257-E281 HydrophobicContact CG-CG 3.89Å; P257-F285 VanDerWaalsContact CD-CZ 3.42Å; P257-F285 HydrophobicContact CG-CD2 4.48Å; P257-F285 HydrophobicContact CG-CE2 3.65Å; P257-F285 HydrophobicContact CG-CZ 3.87Å
258	P	78.9	Confident	85.4	Confident	91 Å²	91	75.1 Å²	75.1	59%	0.591	38%	0.381	S	S	*	.			trans	-63.4	105.8	-173.6	24.5	-33.6	0	0	0	110.7
259	K	80.9	Confident	85.2	Confident	135 Å²	135	81.3 Å²	81.3	59%	0.587	42%	0.42	S	S	*	.			trans	-93.7	132.7	174	-67.7	165.5	-167	158	0	109.3	E256 P257	E256-K259 IonicContact OE2-NZ 2.68Å; E256-K259 PolarHBondContact OE2-NZ 3.12Å; P257-K259 PolarHBondContact O-N 2.87Å
260	P	82.8	Confident	85.2	Confident	70 Å²	70	83.7 Å²	83.7	46%	0.455	44%	0.436	S	S	.	.			trans	-61.7	139.8	171	26.9	-33.7	0	0	0	109.7	T262 H264	P260-T262 PolarHBondContact O-N 2.9Å; P260-H264 HydrophobicContact CG-CB 3.49Å; P260-H264 VanDerWaalsContact CG-CB 3.49Å
261	K	82.4	Confident	85.1	Confident	223 Å²	223	88.8 Å²	88.8	97%	0.97	47%	0.467	S	S	*	.	S	Bend	trans	-66.1	-18.9	178.7	-69.4	-172.5	175.9	-174.6	0	113.2
262	T	87.1	Confident	85	Confident	105 Å²	105	96 Å²	96	64%	0.644	50%	0.501	S	S	*	.	S	Bend	trans	-80.9	149.3	174.1	50.5	0	0	0	0	110.8	P260 H264	P260-T262 PolarHBondContact O-N 2.9Å; T262-H264 PolarHBondContact O-N 3.47Å
263	K	80.9	Confident	84.8	Confident	203 Å²	203	97.7 Å²	97.7	88%	0.883	51%	0.509	S	S	*	.			trans	-55.5	106.3	174.4	-168.7	174.8	-173.1	173	0	109.9
264	H	81.6	Confident	84.8	Confident	113 Å²	113	104.1 Å²	104.1	52%	0.523	53%	0.532	S	S	.	.			trans	-113.1	131.3	179.9	-179.5	-84.8	0	0	0	109.2	P260 T262	P260-H264 HydrophobicContact CG-CB 3.49Å; P260-H264 VanDerWaalsContact CG-CB 3.49Å; T262-H264 PolarHBondContact O-N 3.47Å
265	K	81.1	Confident	85	Confident	160 Å²	160	108.2 Å²	108.2	70%	0.696	55%	0.545	S	S	*	.			trans	-106	123.6	169.4	-69.7	-174.6	177.2	-175.2	0	107.2
266	L	81.4	Confident	85.1	Confident	104 Å²	104	110.9 Å²	110.9	55%	0.545	57%	0.567	S	S	.	*			trans	-101.3	100.3	177.4	-150.2	153.4	0	0	0	106.6	V268 L277	L266-V268 HydrophobicContact CD2-CG2 3.79Å; L266-L277 HydrophobicContact CD1-CD2 4.35Å; L266-L277 HydrophobicContact CD2-CD1 3.55Å; L266-L277 HydrophobicContact CD2-CD2 4.16Å
267	D	84.4	Confident	85.3	Confident	138 Å²	138	110.6 Å²	110.6	74%	0.738	57%	0.567	S	S	*	*			trans	-85.9	114.1	179.8	-68.3	-33.6	0	0	0	108.8
268	V	87.3	Confident	85.5	Confident	63 Å²	63	113.8 Å²	113.8	38%	0.382	58%	0.581	S	S	.	*			trans	-98.3	111	-179.5	-174.1	0	0	0	0	108.8	L266 S270 D273 Y274 L277	L266-V268 HydrophobicContact CD2-CG2 3.79Å; V268-S270 WeakPolarHBondContact CG1-O 3.29Å; V268-D273 HydrophobicContact CG1-CB 4Å; V268-Y274 HydrophobicContact CG1-CD2 4.39Å; V268-L277 HydrophobicContact CG1-CD1 4.48Å; V268-L277 HydrophobicContact CG2-CD1 3.61Å
269	T	88.4	Confident	85.9	Confident	131 Å²	131	116.2 Å²	116.2	80%	0.804	58%	0.582	S	S	*	*			trans	-89.2	-32.3	-174.8	38.6	0	0	0	0	114.3	D273	T269-D273 PolarHBondContact OG1-OD2 2.85Å
270	S	91.8	Very high	86.2	Confident	50 Å²	50	114.8 Å²	114.8	35%	0.35	57%	0.574	S	S	.	*	S	Bend	trans	-121.8	154.1	-177.5	-178.6	0	0	0	0	112.4	V268 E272 D273 Y274	V268-S270 WeakPolarHBondContact CG1-O 3.29Å; S270-E272 PolarHBondContact O-N 2.8Å; S270-E272 PolarHBondContact OG-N 2.94Å; S270-D273 WeakPolarHBondContact CB-OD2 3.33Å; S270-D273 PolarHBondContact N-OD2 3.24Å; S270-D273 PolarHBondContact O-N 2.95Å; S270-Y274 PolarHBondContact O-N 3.39Å
271	V	90.6	Very high	86.3	Confident	108 Å²	108	115.1 Å²	115.1	66%	0.655	57%	0.569	S	S	*	*	H	α-helix	trans	-63.9	-28.9	170.7	-178.5	0	0	0	0	111.1	K275	V271-K275 PolarHBondContact O-N 3.16Å
272	E	90	Very high	86.4	Confident	152 Å²	152	109.1 Å²	109.1	71%	0.71	54%	0.543	S	S	*	.	H	α-helix	trans	-69.5	-41.5	176.3	-65.9	-176.6	168.4	0	0	111.6	S270 Y274 K275 A276	S270-E272 PolarHBondContact O-N 2.8Å; S270-E272 PolarHBondContact OG-N 2.94Å; E272-Y274 VanDerWaalsContact C-N 3.28Å; E272-Y274 PolarHBondContact O-N 2.9Å; E272-K275 PolarHBondContact O-N 2.99Å; E272-K275 VanDerWaalsContact O-N 3.17Å; E272-A276 PolarHBondContact O-N 3.16Å
273	D	87.8	Confident	86.4	Confident	70 Å²	70	109.4 Å²	109.4	37%	0.374	54%	0.537	S	S	.	.	H	α-helix	trans	-61.2	-39.9	175.8	-57.9	-27.6	0	0	0	110.8	V268 T269 S270 K275 A276 L277	V268-D273 HydrophobicContact CG1-CB 4Å; T269-D273 PolarHBondContact OG1-OD2 2.85Å; S270-D273 WeakPolarHBondContact CB-OD2 3.33Å; S270-D273 PolarHBondContact N-OD2 3.24Å; S270-D273 PolarHBondContact O-N 2.95Å; D273-K275 PolarHBondContact O-N 3.15Å; D273-A276 PolarHBondContact O-N 3.33Å; D273-L277 WeakPolarHBondContact O-CG 3.47Å; D273-L277 PolarHBondContact O-N 3.35Å
274	Y	87.1	Confident	86.7	Confident	150 Å²	150	102.3 Å²	102.3	59%	0.588	51%	0.506	S	S	*	.	H	α-helix	trans	-61.6	-43.6	175.5	-169.8	-98.3	0	0	0	112.2	V268 S270 E272 A276 L277 Q278	V268-Y274 HydrophobicContact CG1-CD2 4.39Å; S270-Y274 PolarHBondContact O-N 3.39Å; E272-Y274 VanDerWaalsContact C-N 3.28Å; E272-Y274 PolarHBondContact O-N 2.9Å; Y274-A276 VanDerWaalsContact C-N 3.34Å; Y274-L277 PolarHBondContact O-N 3.43Å; Y274-Q278 PolarHBondContact O-N 3.11Å
275	K	89.6	Confident	87	Confident	131 Å²	131	97.1 Å²	97.1	57%	0.57	48%	0.482	S	S	*	.	H	α-helix	trans	-66.9	-35.8	175.8	-72.6	179.1	-179.1	175.5	0	112.2	V271 E272 D273 K279	V271-K275 PolarHBondContact O-N 3.16Å; E272-K275 PolarHBondContact O-N 2.99Å; E272-K275 VanDerWaalsContact O-N 3.17Å; D273-K275 PolarHBondContact O-N 3.15Å; K275-K279 PolarHBondContact O-N 3.01Å; K275-K279 VanDerWaalsContact O-N 3.12Å
276	A	88.1	Confident	87.2	Confident	58 Å²	58	94.4 Å²	94.4	48%	0.479	47%	0.472	S	S	.	.	H	α-helix	trans	-66.5	-42	175.7	0	0	0	0	0	111.4	E272 D273 Y274 K279 Y280	E272-A276 PolarHBondContact O-N 3.16Å; D273-A276 PolarHBondContact O-N 3.33Å; Y274-A276 VanDerWaalsContact C-N 3.34Å; A276-K279 PolarHBondContact O-N 3.31Å; A276-Y280 WeakPolarHBondContact O-CB 3.25Å; A276-Y280 PolarHBondContact O-N 3.23Å
277	L	86.8	Confident	87.6	Confident	51 Å²	51	93.3 Å²	93.3	27%	0.267	46%	0.464	S	S	.	.	H	α-helix	trans	-60.4	-46	174.1	-76.9	166	0	0	0	111.9	L266 V268 D273 Y274 K279 Y280 E281	L266-L277 HydrophobicContact CD1-CD2 4.35Å; L266-L277 HydrophobicContact CD2-CD1 3.55Å; L266-L277 HydrophobicContact CD2-CD2 4.16Å; V268-L277 HydrophobicContact CG1-CD1 4.48Å; V268-L277 HydrophobicContact CG2-CD1 3.61Å; D273-L277 WeakPolarHBondContact O-CG 3.47Å; D273-L277 PolarHBondContact O-N 3.35Å; Y274-L277 PolarHBondContact O-N 3.43Å; L277-K279 VanDerWaalsContact C-N 3.29Å; L277-K279 PolarHBondContact O-N 3.04Å; L277-Y280 WeakPolarHBondContact O-CB 3.45Å; L277-Y280 PolarHBondContact O-N 2.89Å; L277-Y280 VanDerWaalsContact O-N 3.15Å; L277-E281 WeakPolarHBondContact O-CG 3.41Å; L277-E281 PolarHBondContact O-N 2.89Å
278	Q	85.6	Confident	87.7	Confident	83 Å²	83	87.7 Å²	87.7	39%	0.388	43%	0.434	S	S	.	.	H	α-helix	trans	-61.8	-37.8	177.8	-170.3	177.7	28.2	0	0	112.4	Y274 K282	Y274-Q278 PolarHBondContact O-N 3.11Å; Q278-K282 WeakPolarHBondContact O-CG 3.36Å; Q278-K282 PolarHBondContact O-N 3.34Å
279	K	88.1	Confident	87.8	Confident	143 Å²	143	84.8 Å²	84.8	62%	0.622	42%	0.416	S	S	*	.	H	α-helix	trans	-66.5	-44.9	173.2	-78.4	-177.5	175	-173.9	0	111.6	K275 A276 L277 E281 K282 E283	K275-K279 PolarHBondContact O-N 3.01Å; K275-K279 VanDerWaalsContact O-N 3.12Å; A276-K279 PolarHBondContact O-N 3.31Å; L277-K279 VanDerWaalsContact C-N 3.29Å; L277-K279 PolarHBondContact O-N 3.04Å; K279-E281 VanDerWaalsContact C-N 3.34Å; K279-E281 PolarHBondContact O-N 2.81Å; K279-K282 PolarHBondContact O-N 3.04Å; K279-E283 WeakPolarHBondContact O-CG 3.26Å; K279-E283 PolarHBondContact O-N 2.78Å
280	Y	87.8	Confident	87.8	Confident	104 Å²	104	85.2 Å²	85.2	41%	0.408	41%	0.409	S	S	.	.	H	α-helix	trans	-59.2	-43.3	178.2	172	-98.3	0	0	0	112.1	A276 L277 K282 E283 K284	A276-Y280 WeakPolarHBondContact O-CB 3.25Å; A276-Y280 PolarHBondContact O-N 3.23Å; L277-Y280 WeakPolarHBondContact O-CB 3.45Å; L277-Y280 PolarHBondContact O-N 2.89Å; L277-Y280 VanDerWaalsContact O-N 3.15Å; Y280-K282 PolarHBondContact O-N 3.37Å; Y280-E283 PolarHBondContact O-N 3.26Å; Y280-K284 HydrophobicContact CD1-CG 4.38Å; Y280-K284 HydrophobicContact CD2-CG 4.16Å; Y280-K284 HydrophobicContact CE1-CG 3.92Å; Y280-K284 HydrophobicContact CE2-CD 4.14Å; Y280-K284 VanDerWaalsContact CE2-CE 3.46Å; Y280-K284 HydrophobicContact CE2-CG 3.7Å; Y280-K284 HydrophobicContact CG-CG 4.49Å; Y280-K284 WeakPolarHBondContact O-CB 3.39Å; Y280-K284 WeakPolarHBondContact O-CG 3.35Å; Y280-K284 PolarHBondContact O-N 3.42Å
281	E	84.4	Confident	87.6	Confident	78 Å²	78	85.8 Å²	85.8	36%	0.364	41%	0.406	S	S	.	.	H	α-helix	trans	-59.1	-48.6	176.1	-73.5	177.5	157.6	0	0	111	P257 L277 K279 K284 F285	P257-E281 HydrophobicContact CB-CG 4.25Å; P257-E281 HydrophobicContact CG-CB 4.27Å; P257-E281 HydrophobicContact CG-CG 3.89Å; L277-E281 WeakPolarHBondContact O-CG 3.41Å; L277-E281 PolarHBondContact O-N 2.89Å; K279-E281 VanDerWaalsContact C-N 3.34Å; K279-E281 PolarHBondContact O-N 2.81Å; E281-K284 PolarHBondContact O-N 3.26Å; E281-F285 WeakPolarHBondContact O-CD2 3.4Å; E281-F285 PolarHBondContact O-N 3.42Å
282	K	84.4	Confident	87.5	Confident	97 Å²	97	80.7 Å²	80.7	42%	0.422	38%	0.375	S	S	.	.	H	α-helix	trans	-60.6	-48	177.2	-71.9	-177.6	179.6	-174	0	112.8	Q278 K279 Y280 K284 F285 E286	Q278-K282 WeakPolarHBondContact O-CG 3.36Å; Q278-K282 PolarHBondContact O-N 3.34Å; K279-K282 PolarHBondContact O-N 3.04Å; Y280-K282 PolarHBondContact O-N 3.37Å; K282-K284 VanDerWaalsContact C-N 3.31Å; K282-K284 PolarHBondContact O-N 2.95Å; K282-F285 PolarHBondContact O-N 2.69Å; K282-E286 WeakPolarHBondContact O-CG 3.33Å; K282-E286 PolarHBondContact O-N 3.5Å
283	E	88.3	Confident	87.4	Confident	111 Å²	111	77.3 Å²	77.3	52%	0.519	36%	0.358	S	S	.	.	H	α-helix	trans	-60	-42.2	178.1	-74.5	174.2	-174.2	0	0	111.3	K279 Y280 F285 E286 E287	K279-E283 WeakPolarHBondContact O-CG 3.26Å; K279-E283 PolarHBondContact O-N 2.78Å; Y280-E283 PolarHBondContact O-N 3.26Å; E283-F285 PolarHBondContact O-N 3.45Å; E283-E286 PolarHBondContact O-N 2.91Å; E283-E287 WeakPolarHBondContact O-CG 3.45Å; E283-E287 PolarHBondContact O-N 2.97Å
284	K	87	Confident	87.4	Confident	53 Å²	53	78.6 Å²	78.6	23%	0.23	37%	0.372	C	S	.	.	H	α-helix	trans	-65.6	-37	176	-73.1	-51.1	-178.4	-159.2	0	113.4	Y280 E281 K282 E287 M288	Y280-K284 HydrophobicContact CD1-CG 4.38Å; Y280-K284 HydrophobicContact CD2-CG 4.16Å; Y280-K284 HydrophobicContact CE1-CG 3.92Å; Y280-K284 HydrophobicContact CE2-CD 4.14Å; Y280-K284 VanDerWaalsContact CE2-CE 3.46Å; Y280-K284 HydrophobicContact CE2-CG 3.7Å; Y280-K284 HydrophobicContact CG-CG 4.49Å; Y280-K284 WeakPolarHBondContact O-CB 3.39Å; Y280-K284 WeakPolarHBondContact O-CG 3.35Å; Y280-K284 PolarHBondContact O-N 3.42Å; E281-K284 PolarHBondContact O-N 3.26Å; K282-K284 VanDerWaalsContact C-N 3.31Å; K282-K284 PolarHBondContact O-N 2.95Å; K284-E287 WeakPolarHBondContact CD-OE2 3.49Å; K284-E287 IonicContact NZ-OE1 2.82Å; K284-E287 PolarHBondContact NZ-OE1 2.91Å; K284-E287 IonicContact NZ-OE2 2.77Å; K284-E287 PolarHBondContact NZ-OE2 3.28Å; K284-M288 WeakPolarHBondContact O-CE 3.4Å; K284-M288 WeakPolarHBondContact O-CG 3.09Å; K284-M288 PolarHBondContact O-N 3.26Å
285	F	86.4	Confident	87.4	Confident	4 Å²	4	72.2 Å²	72.2	2%	0.018	35%	0.349	C	S	.	.	H	α-helix	trans	-64.4	-45.4	172.7	-81.5	-63.3	0	0	0	112.5	F255 P257 E281 K282 E283 E287 M288 I289 A310 L313	F255-F285 HydrophobicContact CB-CE1 4.45Å; F255-F285 WeakPolarHBondContact O-CE1 3.34Å; P257-F285 VanDerWaalsContact CD-CZ 3.42Å; P257-F285 HydrophobicContact CG-CD2 4.48Å; P257-F285 HydrophobicContact CG-CE2 3.65Å; P257-F285 HydrophobicContact CG-CZ 3.87Å; E281-F285 WeakPolarHBondContact O-CD2 3.4Å; E281-F285 PolarHBondContact O-N 3.42Å; K282-F285 PolarHBondContact O-N 2.69Å; E283-F285 PolarHBondContact O-N 3.45Å; F285-E287 VanDerWaalsContact C-N 3.34Å; F285-E287 PolarHBondContact O-N 3.49Å; F285-M288 HydrophobicContact CD1-CE 3.54Å; F285-M288 HydrophobicContact CE1-CE 3.97Å; F285-M288 HydrophobicContact CG-CE 4.16Å; F285-M288 PolarHBondContact O-N 2.93Å; F285-I289 WeakPolarHBondContact O-CG1 3.34Å; F285-I289 PolarHBondContact O-N 3.37Å; F285-A310 HydrophobicContact CD1-CB 3.94Å; F285-A310 HydrophobicContact CE1-CB 3.56Å; F285-A310 HydrophobicContact CZ-CB 4.05Å; F285-L313 HydrophobicContact CB-CD1 3.77Å; F285-L313 HydrophobicContact CG-CD1 4.38Å
286	E	86.8	Confident	87.2	Confident	103 Å²	103	67.8 Å²	67.8	48%	0.481	34%	0.341	S	S	.	.	H	α-helix	trans	-61.2	-42.8	176.7	-73.1	178.6	-177.2	0	0	111.5	K282 E283 M288 I289 Q290	K282-E286 WeakPolarHBondContact O-CG 3.33Å; K282-E286 PolarHBondContact O-N 3.5Å; E283-E286 PolarHBondContact O-N 2.91Å; E286-M288 PolarHBondContact O-N 2.92Å; E286-I289 PolarHBondContact O-N 3.34Å; E286-Q290 VanDerWaalsContact O-CB 3.26Å; E286-Q290 WeakPolarHBondContact O-CB 3.49Å; E286-Q290 PolarHBondContact O-N 3.12Å
287	E	88.3	Confident	87.3	Confident	81 Å²	81	65.4 Å²	65.4	38%	0.379	32%	0.321	S	S	.	.	H	α-helix	trans	-56.6	-47.6	173.2	-76.6	177.8	-159.9	0	0	111.7	E283 K284 F285 Q290 Q291	E283-E287 WeakPolarHBondContact O-CG 3.45Å; E283-E287 PolarHBondContact O-N 2.97Å; K284-E287 WeakPolarHBondContact CD-OE2 3.49Å; K284-E287 IonicContact NZ-OE1 2.82Å; K284-E287 PolarHBondContact NZ-OE1 2.91Å; K284-E287 IonicContact NZ-OE2 2.77Å; K284-E287 PolarHBondContact NZ-OE2 3.28Å; F285-E287 VanDerWaalsContact C-N 3.34Å; F285-E287 PolarHBondContact O-N 3.49Å; E287-Q290 PolarHBondContact O-N 3.46Å; E287-Q291 WeakPolarHBondContact O-CG 3.35Å; E287-Q291 PolarHBondContact O-N 3.24Å
288	M	88.2	Confident	87.4	Confident	21 Å²	21	65.2 Å²	65.2	10%	0.103	32%	0.32	C	S	.	.	H	α-helix	trans	-62.9	-44.2	179.6	-73.1	-175.7	-74.1	0	0	111.9	F255 E256 K284 F285 E286 Q291 V292 F345	F255-M288 HydrophobicContact CD1-CB 4.43Å; E256-M288 WeakPolarHBondContact O-CE 3.15Å; K284-M288 WeakPolarHBondContact O-CE 3.4Å; K284-M288 WeakPolarHBondContact O-CG 3.09Å; K284-M288 PolarHBondContact O-N 3.26Å; F285-M288 HydrophobicContact CD1-CE 3.54Å; F285-M288 HydrophobicContact CE1-CE 3.97Å; F285-M288 HydrophobicContact CG-CE 4.16Å; F285-M288 PolarHBondContact O-N 2.93Å; E286-M288 PolarHBondContact O-N 2.92Å; M288-Q291 PolarHBondContact O-N 3.26Å; M288-V292 WeakPolarHBondContact O-CG2 3.39Å; M288-V292 PolarHBondContact O-N 3.36Å; M288-V292 VanDerWaalsContact O-N 3.15Å; M288-F345 HydrophobicContact CG-CD2 4.01Å; M288-F345 HydrophobicContact CG-CE2 4.16Å; M288-F345 HydrophobicContact CG-CG 4.39Å; M288-F345 HydrophobicContact SD-CD2 3.84Å; M288-F345 HydrophobicContact SD-CE2 3.5Å; M288-F345 VanDerWaalsContact SD-CE2 3.5Å; M288-F345 HydrophobicContact SD-CZ 4.14Å
289	I	87.9	Confident	87.7	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-65.9	-41.6	178.2	-65.2	168.6	0	0	0	110.5	F255 F285 E286 Q291 V292 K293 L313 L314 N317	F255-I289 HydrophobicContact CE1-CG1 4.37Å; F285-I289 WeakPolarHBondContact O-CG1 3.34Å; F285-I289 PolarHBondContact O-N 3.37Å; E286-I289 PolarHBondContact O-N 3.34Å; I289-Q291 VanDerWaalsContact C-N 3.32Å; I289-Q291 PolarHBondContact O-N 3.31Å; I289-V292 PolarHBondContact O-N 2.97Å; I289-K293 PolarHBondContact O-N 3.37Å; I289-L313 HydrophobicContact CD1-CB 3.66Å; I289-L314 HydrophobicContact CD1-CD2 4.18Å; I289-L314 HydrophobicContact CD1-CG 4.18Å; I289-L314 HydrophobicContact CG1-CD2 3.9Å; I289-L314 HydrophobicContact CG1-CG 4.4Å; I289-N317 HydrophobicContact CG2-CB 3.69Å
290	Q	88.1	Confident	87.9	Confident	140 Å²	140	54.4 Å²	54.4	65%	0.654	27%	0.272	S	S	*	.	H	α-helix	trans	-64.5	-37.4	178.1	-167.8	174	15.7	0	0	111.6	E286 E287 K293 S294	E286-Q290 VanDerWaalsContact O-CB 3.26Å; E286-Q290 WeakPolarHBondContact O-CB 3.49Å; E286-Q290 PolarHBondContact O-N 3.12Å; E287-Q290 PolarHBondContact O-N 3.46Å; Q290-K293 PolarHBondContact O-N 2.92Å; Q290-S294 VanDerWaalsContact O-CB 3.29Å; Q290-S294 WeakPolarHBondContact O-CB 3.35Å; Q290-S294 PolarHBondContact O-N 3.19Å; Q290-S294 PolarHBondContact O-OG 3.22Å
291	Q	87.8	Confident	88.1	Confident	63 Å²	63	49.5 Å²	49.5	29%	0.294	25%	0.253	S	S	.	.	H	α-helix	trans	-59.2	-49.2	172.1	-75.8	177	11	0	0	110.9	E287 M288 I289 K293 S294 T295	E287-Q291 WeakPolarHBondContact O-CG 3.35Å; E287-Q291 PolarHBondContact O-N 3.24Å; M288-Q291 PolarHBondContact O-N 3.26Å; I289-Q291 VanDerWaalsContact C-N 3.32Å; I289-Q291 PolarHBondContact O-N 3.31Å; Q291-K293 PolarHBondContact O-N 3.08Å; Q291-S294 PolarHBondContact O-N 3.24Å; Q291-S294 PolarHBondContact O-OG 3.36Å; Q291-T295 PolarHBondContact O-N 3.24Å
292	V	88.6	Confident	88.5	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-60.4	-46.6	178.1	-179.6	0	0	0	0	111.3	A249 L251 F255 M288 I289 S294 T295 A297 L319 F345 L348	A249-V292 HydrophobicContact CB-CG1 4.18Å; L251-V292 HydrophobicContact CD1-CG2 4.47Å; F255-V292 HydrophobicContact CE1-CG2 4.29Å; F255-V292 HydrophobicContact CZ-CG2 4.1Å; M288-V292 WeakPolarHBondContact O-CG2 3.39Å; M288-V292 PolarHBondContact O-N 3.36Å; M288-V292 VanDerWaalsContact O-N 3.15Å; I289-V292 PolarHBondContact O-N 2.97Å; V292-S294 PolarHBondContact O-N 3.47Å; V292-T295 PolarHBondContact O-N 3.19Å; V292-T295 PolarHBondContact O-OG1 3.31Å; V292-A297 HydrophobicContact CG1-CB 3.93Å; V292-L319 HydrophobicContact CB-CD2 4.11Å; V292-L319 HydrophobicContact CG1-CD1 4.45Å; V292-L319 HydrophobicContact CG1-CD2 3.69Å; V292-F345 HydrophobicContact CG2-CD1 3.95Å; V292-F345 HydrophobicContact CG2-CE1 4.19Å; V292-L348 HydrophobicContact CB-CD2 4.22Å; V292-L348 HydrophobicContact CG1-CD2 4.24Å; V292-L348 HydrophobicContact CG2-CD2 4.01Å
293	K	87.8	Confident	88.8	Confident	82 Å²	82	43.8 Å²	43.8	36%	0.357	23%	0.228	S	C	.	.	H	α-helix	trans	-62.5	-39.1	176.8	-86.3	-169.6	164.7	-177.8	0	114.2	I289 Q290 Q291 T295 G296 N317	I289-K293 PolarHBondContact O-N 3.37Å; Q290-K293 PolarHBondContact O-N 2.92Å; Q291-K293 PolarHBondContact O-N 3.08Å; K293-T295 PolarHBondContact O-N 3.44Å; K293-G296 WeakPolarHBondContact O-CA 3.14Å; K293-G296 PolarHBondContact O-N 3.23Å; K293-N317 WeakPolarHBondContact CE-O 3.41Å; K293-N317 PolarHBondContact NZ-O 3.43Å; K293-N317 PolarHBondContact NZ-OD1 2.85Å
294	S	88.4	Confident	88.9	Confident	96 Å²	96	44.9 Å²	44.9	67%	0.671	23%	0.227	S	C	*	.	H	α-helix	trans	-62.6	-25.2	-178.2	67.4	0	0	0	0	112.5	Q290 Q291 V292 G296	Q290-S294 VanDerWaalsContact O-CB 3.29Å; Q290-S294 WeakPolarHBondContact O-CB 3.35Å; Q290-S294 PolarHBondContact O-N 3.19Å; Q290-S294 PolarHBondContact O-OG 3.22Å; Q291-S294 PolarHBondContact O-N 3.24Å; Q291-S294 PolarHBondContact O-OG 3.36Å; V292-S294 PolarHBondContact O-N 3.47Å; S294-G296 VanDerWaalsContact C-N 3.27Å; S294-G296 PolarHBondContact O-N 2.89Å
295	T	86.9	Confident	88.8	Confident	16 Å²	16	42.6 Å²	42.6	10%	0.098	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-11.7	172.5	68.7	0	0	0	0	114.2	Q291 V292 K293 L348 L353	Q291-T295 PolarHBondContact O-N 3.24Å; V292-T295 PolarHBondContact O-N 3.19Å; V292-T295 PolarHBondContact O-OG1 3.31Å; K293-T295 PolarHBondContact O-N 3.44Å; T295-L348 HydrophobicContact CG2-CB 4.2Å; T295-L348 HydrophobicContact CG2-CD2 3.85Å; T295-L348 HydrophobicContact CG2-CG 3.82Å; T295-L348 WeakPolarHBondContact CG2-O 3.4Å; T295-L348 WeakPolarHBondContact OG1-CD2 3.42Å; T295-L353 WeakPolarHBondContact O-CD1 3.41Å
296	G	86.7	Confident	88.7	Confident	38 Å²	38	42.8 Å²	42.8	39%	0.392	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	19.9	-178.2	0	0	0	0	0	114.4	K247 K293 S294	K247-G296 VanDerWaalsContact CD-O 3.29Å; K247-G296 WeakPolarHBondContact CD-O 3.29Å; K293-G296 WeakPolarHBondContact O-CA 3.14Å; K293-G296 PolarHBondContact O-N 3.23Å; S294-G296 VanDerWaalsContact C-N 3.27Å; S294-G296 PolarHBondContact O-N 2.89Å
297	A	88.8	Confident	88.4	Confident	9 Å²	9	41.3 Å²	41.3	7%	0.074	22%	0.215	C	C	.	.			trans	-70.8	142.4	172.5	0	0	0	0	0	111.1	K247 A249 V292 L353	K247-A297 CarbonylContact O-C 3.51Å; K247-A297 WeakPolarHBondContact O-CA 3.41Å; A249-A297 HydrophobicContact CB-CB 3.93Å; V292-A297 HydrophobicContact CG1-CB 3.93Å; A297-L353 HydrophobicContact CB-CD1 4Å; A297-L353 HydrophobicContact CB-CD2 3.87Å
298	N	90.1	Very high	88	Confident	46 Å²	46	43.2 Å²	43.2	25%	0.246	23%	0.228	C	C	.	.	S	Bend	trans	-115.6	-8.3	177.2	63.4	11.9	0	0	0	113.6	D245 A246 K247 P320	D245-N298 PolarHBondContact O-ND2 2.78Å; A246-N298 WeakPolarHBondContact CA-ND2 3.39Å; A246-N298 VanDerWaalsContact CA-OD1 3.25Å; A246-N298 WeakPolarHBondContact CA-OD1 3.23Å; K247-N298 VanDerWaalsContact N-CG 3.27Å; K247-N298 PolarHBondContact N-ND2 2.98Å; K247-N298 PolarHBondContact N-OD1 3.28Å; K247-N298 PolarHBondContact O-N 3.24Å; K247-N298 PolarHBondContact O-OD1 3.23Å; N298-P320 WeakPolarHBondContact O-CD 3.46Å
299	L	91.3	Very high	87.7	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	130.8	174.3	178.3	64.6	0	0	0	109.3	F234 L243 K247 I248 A249 I301 P320 V322 V359	F234-L299 HydrophobicContact CE1-CD1 3.75Å; L243-L299 HydrophobicContact CD1-CB 4.35Å; L243-L299 HydrophobicContact CD1-CD1 4.12Å; K247-L299 PolarHBondContact O-N 3Å; I248-L299 WeakPolarHBondContact CA-O 3.4Å; I248-L299 HydrophobicContact CD1-CD2 4.19Å; I248-L299 HydrophobicContact CG1-CB 4.31Å; I248-L299 HydrophobicContact CG1-CD2 4.04Å; I248-L299 HydrophobicContact CG2-CD2 4.33Å; A249-L299 PolarHBondContact N-O 3.47Å; L299-I301 HydrophobicContact CD2-CD1 4.12Å; L299-I301 HydrophobicContact CD2-CG1 4.3Å; L299-I301 HydrophobicContact CG-CG1 4.3Å; L299-P320 HydrophobicContact CD1-CB 3.91Å; L299-P320 WeakPolarHBondContact CD1-O 3.44Å; L299-V322 HydrophobicContact CD1-CG2 4.39Å; L299-V359 HydrophobicContact CD2-CB 4.32Å; L299-V359 HydrophobicContact CD2-CG1 3.89Å; L299-V359 HydrophobicContact CD2-CG2 3.96Å
300	A	91.9	Very high	87.5	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	120.9	173.3	0	0	0	0	0	110.9	F255 L319 P320 A321 V322	F255-A300 HydrophobicContact CE2-CB 4.13Å; F255-A300 HydrophobicContact CZ-CB 4.22Å; A300-L319 HydrophobicContact CB-CD2 4.29Å; A300-L319 HydrophobicContact CB-CG 4.49Å; A300-P320 PolarHBondContact N-O 2.85Å; A300-A321 HydrophobicContact CB-CB 4.27Å; A300-A321 CarbonylContact O-C 3.4Å; A300-A321 WeakPolarHBondContact O-CA 3.43Å; A300-V322 PolarHBondContact O-N 2.51Å
301	I	92.7	Very high	87.3	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	117.7	176.5	-80.7	179.1	0	0	0	107.9	I248 A249 L251 L299 V322 I325 I330 I333 I374	I248-I301 HydrophobicContact CG2-CB 4.28Å; I248-I301 HydrophobicContact CG2-CD1 3.6Å; I248-I301 HydrophobicContact CG2-CG1 4.04Å; A249-I301 PolarHBondContact O-N 3.11Å; L251-I301 PolarHBondContact N-O 3.28Å; L299-I301 HydrophobicContact CD2-CD1 4.12Å; L299-I301 HydrophobicContact CD2-CG1 4.3Å; L299-I301 HydrophobicContact CG-CG1 4.3Å; I301-V322 HydrophobicContact CG1-CB 4.34Å; I301-V322 HydrophobicContact CG1-CG2 4.36Å; I301-I325 HydrophobicContact CB-CD1 3.95Å; I301-I325 HydrophobicContact CD1-CD1 4.38Å; I301-I325 HydrophobicContact CG1-CD1 3.92Å; I301-I325 HydrophobicContact CG2-CD1 3.29Å; I301-I330 HydrophobicContact CG2-CD1 4.39Å; I301-I330 HydrophobicContact CG2-CG1 4.23Å; I301-I333 HydrophobicContact CD1-CD1 4.21Å; I301-I333 HydrophobicContact CD1-CG2 4.08Å; I301-I333 HydrophobicContact CG2-CD1 4.44Å; I301-I374 HydrophobicContact CD1-CD1 3.99Å
302	C	92.4	Very high	87.3	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	134.2	-178.8	-65.1	0	0	0	0	111.6	L251 F255 W304 F306 V322 W324 I325	L251-C302 WeakPolarHBondContact O-CA 3.46Å; F255-C302 VanDerWaalsContact CD2-SG 3.53Å; F255-C302 WeakPolarHBondContact CE2-SG 3.4Å; C302-W304 WeakPolarHBondContact CB-O 3.42Å; C302-F306 HydrophobicContact CB-CD1 4.28Å; C302-F306 HydrophobicContact CB-CE1 4.2Å; C302-V322 PolarHBondContact N-O 2.88Å; C302-W324 PolarHBondContact O-N 2.97Å; C302-I325 PolarHBondContact O-N 3.14Å
303	Q	91.6	Very high	87.2	Confident	55 Å²	55	43 Å²	43	26%	0.257	23%	0.228	S	C	.	.	S	Bend	trans	-63.9	-43.1	171	-169	-179.9	11	0	0	111.4	L251 W324 I325 I330	L251-Q303 PolarHBondContact O-N 3.44Å; Q303-W324 CarbonylContact O-C 3.47Å; Q303-W324 VanDerWaalsContact O-CA 3.3Å; Q303-W324 WeakPolarHBondContact O-CA 3.41Å; Q303-I325 WeakPolarHBondContact CA-O 3.47Å; Q303-I325 WeakPolarHBondContact CG-O 3.49Å; Q303-I325 PolarHBondContact O-N 3.41Å; Q303-I330 HydrophobicContact CB-CD1 3.97Å
304	W	89.9	Confident	87.2	Confident	134 Å²	134	39.1 Å²	39.1	51%	0.508	21%	0.211	S	C	.	.	S	Bend	trans	-91.5	164.7	-179.1	-62.4	99.3	0	0	0	112.3	T252 P254 C302 W324	T252-W304 PolarHBondContact O-NE1 2.89Å; P254-W304 HydrophobicContact CB-CB 3.84Å; C302-W304 WeakPolarHBondContact CB-O 3.42Å; W304-W324 HydrophobicContact CE3-CZ3 4.39Å; W304-W324 PolarHBondContact O-N 3.16Å
305	G	84.4	Confident	87.1	Confident	6 Å²	6	36.2 Å²	36.2	6%	0.062	19%	0.187	C	C	.	.			trans	-63.4	167.8	167.2	0	0	0	0	0	113.1	P254 W324	P254-G305 WeakPolarHBondContact CB-O 3.25Å; G305-W324 VanDerWaalsContact CA-CE2 3.41Å
306	F	85	Confident	87.2	Confident	7 Å²	7	41.3 Å²	41.3	3%	0.031	21%	0.21	C	C	.	.			trans	-142.9	153.9	166	41.1	-110.8	0	0	0	109.5	S235 F255 C302 A310 N311 A321 R323	S235-F306 VanDerWaalsContact CB-CE2 3.43Å; S235-F306 VanDerWaalsContact CB-CZ 3.5Å; F255-F306 HydrophobicContact CB-CB 3.65Å; F255-F306 HydrophobicContact CB-CD1 4.39Å; F255-F306 HydrophobicContact CB-CG 4.28Å; F255-F306 AromaticContact CD2-CD1 3.88Å; F255-F306 HydrophobicContact CD2-CD1 3.88Å; F255-F306 HydrophobicContact CD2-CE1 4.44Å; F255-F306 WeakPolarHBondContact O-CB 3.36Å; C302-F306 HydrophobicContact CB-CD1 4.28Å; C302-F306 HydrophobicContact CB-CE1 4.2Å; F306-A310 HydrophobicContact CB-CB 4.41Å; F306-N311 WeakPolarHBondContact CE2-OD1 3.38Å; F306-A321 HydrophobicContact CE1-CB 3.95Å; F306-A321 HydrophobicContact CZ-CB 3.62Å; F306-R323 HydrophobicContact CD1-CB 4.03Å; F306-R323 HydrophobicContact CD2-CB 4.44Å; F306-R323 HydrophobicContact CE1-CB 3.57Å; F306-R323 HydrophobicContact CE1-CG 4.42Å; F306-R323 HydrophobicContact CE2-CB 3.92Å; F306-R323 HydrophobicContact CE2-CG 3.94Å; F306-R323 HydrophobicContact CG-CB 4.47Å; F306-R323 HydrophobicContact CZ-CB 3.51Å; F306-R323 HydrophobicContact CZ-CG 3.86Å
307	D	80.2	Confident	87.1	Confident	73 Å²	73	41.8 Å²	41.8	39%	0.39	20%	0.203	S	C	.	.			trans	-67.9	158	-174.9	-68.3	-35.1	0	0	0	112.5	E309 A310 N311	D307-E309 VanDerWaalsContact C-N 3.28Å; D307-E309 PolarHBondContact O-N 3.24Å; D307-A310 WeakPolarHBondContact O-CB 3.42Å; D307-A310 PolarHBondContact O-N 2.96Å; D307-A310 VanDerWaalsContact O-N 3.13Å; D307-N311 PolarHBondContact O-N 3.29Å
308	D	79.8	Confident	87	Confident	120 Å²	120	49.5 Å²	49.5	64%	0.642	24%	0.238	S	C	*	.	H	α-helix	trans	-65.9	-29.8	-178.2	-71.4	-21.6	0	0	0	112.9	N311 H312 R323	D308-N311 VanDerWaalsContact O-CB 3.27Å; D308-N311 WeakPolarHBondContact O-CB 3.48Å; D308-N311 PolarHBondContact O-N 3.21Å; D308-H312 PolarHBondContact O-N 3.28Å; D308-H312 VanDerWaalsContact O-N 3.14Å; D308-R323 IonicContact OD1-NH1 3.15Å
309	E	81.5	Confident	86.9	Confident	101 Å²	101	47.4 Å²	47.4	47%	0.472	23%	0.227	S	C	.	.	H	α-helix	trans	-64.6	-42.8	172.4	-64.2	-167	165.2	0	0	111.5	D307 N311 H312 L313	D307-E309 VanDerWaalsContact C-N 3.28Å; D307-E309 PolarHBondContact O-N 3.24Å; E309-N311 VanDerWaalsContact C-N 3.29Å; E309-N311 PolarHBondContact O-N 3.27Å; E309-H312 PolarHBondContact O-N 3.38Å; E309-L313 WeakPolarHBondContact O-CG 3.36Å; E309-L313 PolarHBondContact O-N 2.83Å; E309-L313 VanDerWaalsContact O-N 3.09Å
310	A	82.8	Confident	86.9	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.008	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-39.8	176.4	0	0	0	0	0	110.9	F255 F285 F306 D307 H312 L313 L314	F255-A310 HydrophobicContact CB-CB 4.33Å; F285-A310 HydrophobicContact CD1-CB 3.94Å; F285-A310 HydrophobicContact CE1-CB 3.56Å; F285-A310 HydrophobicContact CZ-CB 4.05Å; F306-A310 HydrophobicContact CB-CB 4.41Å; D307-A310 WeakPolarHBondContact O-CB 3.42Å; D307-A310 PolarHBondContact O-N 2.96Å; D307-A310 VanDerWaalsContact O-N 3.13Å; A310-H312 PolarHBondContact O-N 2.75Å; A310-L313 PolarHBondContact O-N 3.3Å; A310-L314 WeakPolarHBondContact O-CB 3.37Å; A310-L314 WeakPolarHBondContact O-CD1 3.42Å; A310-L314 VanDerWaalsContact O-CG 3.23Å; A310-L314 WeakPolarHBondContact O-CG 2.88Å; A310-L314 PolarHBondContact O-N 3.41Å
311	N	85.6	Confident	86.8	Confident	5 Å²	5	47.6 Å²	47.6	3%	0.027	23%	0.228	C	C	.	.	H	α-helix	trans	-56.5	-46.9	174.6	-103.9	-34.6	0	0	0	113.5	S235 F306 D307 D308 E309 L314 L315 R323	S235-N311 WeakPolarHBondContact CB-OD1 3.47Å; S235-N311 PolarHBondContact OG-OD1 3.4Å; F306-N311 WeakPolarHBondContact CE2-OD1 3.38Å; D307-N311 PolarHBondContact O-N 3.29Å; D308-N311 VanDerWaalsContact O-CB 3.27Å; D308-N311 WeakPolarHBondContact O-CB 3.48Å; D308-N311 PolarHBondContact O-N 3.21Å; E309-N311 VanDerWaalsContact C-N 3.29Å; E309-N311 PolarHBondContact O-N 3.27Å; N311-L314 PolarHBondContact O-N 3.36Å; N311-L315 PolarHBondContact O-N 3.27Å; N311-R323 PolarHBondContact ND2-NH1 3.09Å
312	H	86.3	Confident	86.8	Confident	95 Å²	95	47.6 Å²	47.6	44%	0.44	23%	0.228	S	C	.	.	H	α-helix	trans	-66.2	-40	178.7	-173.3	-87.6	0	0	0	111.6	D308 E309 A310 L315 Q316	D308-H312 PolarHBondContact O-N 3.28Å; D308-H312 VanDerWaalsContact O-N 3.14Å; E309-H312 PolarHBondContact O-N 3.38Å; A310-H312 PolarHBondContact O-N 2.75Å; H312-L315 PolarHBondContact O-N 3.07Å; H312-Q316 PolarHBondContact CE1-NE2 2.85Å; H312-Q316 WeakPolarHBondContact O-CG 3.4Å; H312-Q316 PolarHBondContact O-N 3.43Å
313	L	86.4	Confident	86.7	Confident	20 Å²	20	51.1 Å²	51.1	11%	0.105	24%	0.241	C	C	.	.	H	α-helix	trans	-66.6	-38.4	176.3	-69	172.4	0	0	0	112.4	F285 I289 E309 A310 L315 Q316 N317	F285-L313 HydrophobicContact CB-CD1 3.77Å; F285-L313 HydrophobicContact CG-CD1 4.38Å; I289-L313 HydrophobicContact CD1-CB 3.66Å; E309-L313 WeakPolarHBondContact O-CG 3.36Å; E309-L313 PolarHBondContact O-N 2.83Å; E309-L313 VanDerWaalsContact O-N 3.09Å; A310-L313 PolarHBondContact O-N 3.3Å; L313-L315 VanDerWaalsContact C-N 3.34Å; L313-Q316 PolarHBondContact O-N 3.4Å; L313-N317 WeakPolarHBondContact O-CB 3.31Å; L313-N317 PolarHBondContact O-N 3.14Å; L313-N317 PolarHBondContact O-ND2 2.71Å
314	L	88.1	Confident	86.7	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.5	-42.5	173.6	-76.2	163.9	0	0	0	111.2	M239 F255 I289 A310 N311 N317 E318 L319 A321	M239-L314 HydrophobicContact CE-CB 4.19Å; F255-L314 HydrophobicContact CE1-CD2 4.17Å; F255-L314 HydrophobicContact CZ-CD2 4.17Å; I289-L314 HydrophobicContact CD1-CD2 4.18Å; I289-L314 HydrophobicContact CD1-CG 4.18Å; I289-L314 HydrophobicContact CG1-CD2 3.9Å; I289-L314 HydrophobicContact CG1-CG 4.4Å; A310-L314 WeakPolarHBondContact O-CB 3.37Å; A310-L314 WeakPolarHBondContact O-CD1 3.42Å; A310-L314 VanDerWaalsContact O-CG 3.23Å; A310-L314 WeakPolarHBondContact O-CG 2.88Å; A310-L314 PolarHBondContact O-N 3.41Å; N311-L314 PolarHBondContact O-N 3.36Å; L314-N317 CarbonylContact O-C 3.45Å; L314-N317 PolarHBondContact O-N 2.89Å; L314-E318 PolarHBondContact O-N 3.12Å; L314-L319 HydrophobicContact CD2-CB 4.32Å; L314-L319 HydrophobicContact CD2-CD2 3.77Å; L314-L319 HydrophobicContact CD2-CG 4.32Å; L314-L319 PolarHBondContact O-N 3.1Å; L314-A321 HydrophobicContact CD1-CB 3.87Å
315	L	87.6	Confident	86.7	Confident	34 Å²	34	49.1 Å²	49.1	18%	0.178	23%	0.232	C	C	.	.	H	α-helix	trans	-64	-47.9	175.6	179.1	71.5	0	0	0	112.5	Q238 M239 N311 H312 L313 N317 E318	Q238-L315 HydrophobicContact CB-CD1 4.21Å; Q238-L315 HydrophobicContact CB-CD2 4.07Å; M239-L315 HydrophobicContact CE-CB 4.41Å; M239-L315 HydrophobicContact CG-CD1 3.78Å; N311-L315 PolarHBondContact O-N 3.27Å; H312-L315 PolarHBondContact O-N 3.07Å; L313-L315 VanDerWaalsContact C-N 3.34Å; L315-N317 PolarHBondContact O-N 2.98Å; L315-E318 PolarHBondContact O-N 3.11Å
316	Q	87.4	Confident	87	Confident	124 Å²	124	50.2 Å²	50.2	58%	0.579	24%	0.243	S	C	*	.	H	α-helix	trans	-59.2	-30.5	177	-75.6	-176.3	-28.8	0	0	112.2	H312 L313 E318	H312-Q316 PolarHBondContact CE1-NE2 2.85Å; H312-Q316 WeakPolarHBondContact O-CG 3.4Å; H312-Q316 PolarHBondContact O-N 3.43Å; L313-Q316 PolarHBondContact O-N 3.4Å; Q316-E318 VanDerWaalsContact C-N 3.3Å
317	N	85.1	Confident	87.2	Confident	47 Å²	47	51 Å²	51	25%	0.251	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	10.8	174.7	-79.4	-73.9	0	0	0	113.1	I289 K293 L313 L314 L315 L319	I289-N317 HydrophobicContact CG2-CB 3.69Å; K293-N317 WeakPolarHBondContact CE-O 3.41Å; K293-N317 PolarHBondContact NZ-O 3.43Å; K293-N317 PolarHBondContact NZ-OD1 2.85Å; L313-N317 WeakPolarHBondContact O-CB 3.31Å; L313-N317 PolarHBondContact O-N 3.14Å; L313-N317 PolarHBondContact O-ND2 2.71Å; L314-N317 CarbonylContact O-C 3.45Å; L314-N317 PolarHBondContact O-N 2.89Å; L315-N317 PolarHBondContact O-N 2.98Å; N317-L319 PolarHBondContact O-N 2.98Å
318	E	86.3	Confident	87.6	Confident	171 Å²	171	52.1 Å²	52.1	80%	0.799	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	32.8	177.9	-54.5	-179.9	164.4	0	0	113	L314 L315 Q316 P320	L314-E318 PolarHBondContact O-N 3.12Å; L315-E318 PolarHBondContact O-N 3.11Å; Q316-E318 VanDerWaalsContact C-N 3.3Å; E318-P320 VanDerWaalsContact O-CD 3.26Å; E318-P320 WeakPolarHBondContact O-CD 3.49Å
319	L	88.5	Confident	88	Confident	3 Å²	3	47.9 Å²	47.9	2%	0.016	24%	0.24	C	C	.	.			trans	-113.2	92.9	177.3	-172.5	70.8	0	0	0	109.4	V292 A300 L314 N317 A321	V292-L319 HydrophobicContact CB-CD2 4.11Å; V292-L319 HydrophobicContact CG1-CD1 4.45Å; V292-L319 HydrophobicContact CG1-CD2 3.69Å; A300-L319 HydrophobicContact CB-CD2 4.29Å; A300-L319 HydrophobicContact CB-CG 4.49Å; L314-L319 HydrophobicContact CD2-CB 4.32Å; L314-L319 HydrophobicContact CD2-CD2 3.77Å; L314-L319 HydrophobicContact CD2-CG 4.32Å; L314-L319 PolarHBondContact O-N 3.1Å; N317-L319 PolarHBondContact O-N 2.98Å; L319-A321 PolarHBondContact O-N 3.46Å
320	P	90.8	Very high	88.4	Confident	3 Å²	3	43.3 Å²	43.3	2%	0.019	22%	0.219	C	C	.	.			trans	-53.4	138.7	171.7	-28.4	35.6	0	0	0	111.7	F234 M239 P240 L243 N298 L299 A300 E318	F234-P320 HydrophobicContact CD1-CB 3.99Å; F234-P320 HydrophobicContact CE1-CB 3.82Å; M239-P320 HydrophobicContact SD-CB 4.37Å; P240-P320 HydrophobicContact CG-CG 3.56Å; L243-P320 HydrophobicContact CD1-CB 3.87Å; L243-P320 HydrophobicContact CD1-CG 3.78Å; L243-P320 HydrophobicContact CD2-CG 4.11Å; L243-P320 HydrophobicContact CG-CG 4.45Å; N298-P320 WeakPolarHBondContact O-CD 3.46Å; L299-P320 HydrophobicContact CD1-CB 3.91Å; L299-P320 WeakPolarHBondContact CD1-O 3.44Å; A300-P320 PolarHBondContact N-O 2.85Å; E318-P320 VanDerWaalsContact O-CD 3.26Å; E318-P320 WeakPolarHBondContact O-CD 3.49Å
321	A	91.2	Very high	88.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	150.7	-179.8	0	0	0	0	0	112.1	S235 A300 F306 L314 L319	S235-A321 WeakPolarHBondContact CB-O 3.42Å; S235-A321 PolarHBondContact N-O 3.2Å; S235-A321 PolarHBondContact OG-O 3.45Å; A300-A321 HydrophobicContact CB-CB 4.27Å; A300-A321 CarbonylContact O-C 3.4Å; A300-A321 WeakPolarHBondContact O-CA 3.43Å; F306-A321 HydrophobicContact CE1-CB 3.95Å; F306-A321 HydrophobicContact CZ-CB 3.62Å; L314-A321 HydrophobicContact CD1-CB 3.87Å; L319-A321 PolarHBondContact O-N 3.46Å
322	V	91.4	Very high	88.9	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	130	172.2	-169.4	0	0	0	0	108	K232 F234 L299 A300 I301 C302 I325 L372	K232-V322 HydrophobicContact CB-CG1 3.76Å; K232-V322 HydrophobicContact CG-CG1 4.4Å; F234-V322 HydrophobicContact CD1-CG2 4.35Å; L299-V322 HydrophobicContact CD1-CG2 4.39Å; A300-V322 PolarHBondContact O-N 2.51Å; I301-V322 HydrophobicContact CG1-CB 4.34Å; I301-V322 HydrophobicContact CG1-CG2 4.36Å; C302-V322 PolarHBondContact N-O 2.88Å; V322-I325 HydrophobicContact CB-CD1 3.76Å; V322-I325 HydrophobicContact CG1-CD1 3.56Å; V322-I325 HydrophobicContact CG1-CG1 3.88Å; V322-L372 HydrophobicContact CG2-CD1 3.75Å
323	R	91	Very high	89.1	Confident	74 Å²	74	44.9 Å²	44.9	28%	0.279	23%	0.227	S	C	.	.			trans	-108.4	159.9	179.1	47.1	176.9	-174.3	-171.1	1.6	111.5	F306 D308 N311	F306-R323 HydrophobicContact CD1-CB 4.03Å; F306-R323 HydrophobicContact CD2-CB 4.44Å; F306-R323 HydrophobicContact CE1-CB 3.57Å; F306-R323 HydrophobicContact CE1-CG 4.42Å; F306-R323 HydrophobicContact CE2-CB 3.92Å; F306-R323 HydrophobicContact CE2-CG 3.94Å; F306-R323 HydrophobicContact CG-CB 4.47Å; F306-R323 HydrophobicContact CZ-CB 3.51Å; F306-R323 HydrophobicContact CZ-CG 3.86Å; D308-R323 IonicContact OD1-NH1 3.15Å; N311-R323 PolarHBondContact ND2-NH1 3.09Å
324	W	90.4	Very high	89.4	Confident	144 Å²	144	44.5 Å²	44.5	55%	0.545	23%	0.226	S	C	.	.			trans	61.3	42.1	172	-57.9	107.5	0	0	0	114.1	K232 C302 Q303 W304 G305	K232-W324 VanDerWaalsContact CE-O 3.25Å; K232-W324 WeakPolarHBondContact CE-O 3.32Å; C302-W324 PolarHBondContact O-N 2.97Å; Q303-W324 CarbonylContact O-C 3.47Å; Q303-W324 VanDerWaalsContact O-CA 3.3Å; Q303-W324 WeakPolarHBondContact O-CA 3.41Å; W304-W324 HydrophobicContact CE3-CZ3 4.39Å; W304-W324 PolarHBondContact O-N 3.16Å; G305-W324 VanDerWaalsContact CA-CE2 3.41Å
325	I	91.8	Very high	89.4	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.021	24%	0.243	C	C	.	.			trans	-80.3	135.3	175.3	-68	171.2	0	0	0	109.5	V230 I301 C302 Q303 V322 E329 I330 I333	V230-I325 HydrophobicContact CG1-CG1 4.32Å; I301-I325 HydrophobicContact CB-CD1 3.95Å; I301-I325 HydrophobicContact CD1-CD1 4.38Å; I301-I325 HydrophobicContact CG1-CD1 3.92Å; I301-I325 HydrophobicContact CG2-CD1 3.29Å; C302-I325 PolarHBondContact O-N 3.14Å; Q303-I325 WeakPolarHBondContact CA-O 3.47Å; Q303-I325 WeakPolarHBondContact CG-O 3.49Å; Q303-I325 PolarHBondContact O-N 3.41Å; V322-I325 HydrophobicContact CB-CD1 3.76Å; V322-I325 HydrophobicContact CG1-CD1 3.56Å; V322-I325 HydrophobicContact CG1-CG1 3.88Å; I325-E329 HydrophobicContact CG2-CB 3.76Å; I325-I330 HydrophobicContact CG2-CB 4.24Å; I325-I330 HydrophobicContact CG2-CG1 4.49Å; I325-I333 HydrophobicContact CG2-CD1 4.18Å
326	G	90.1	Very high	89.5	Confident	29 Å²	29	46.2 Å²	46.2	30%	0.299	24%	0.235	S	C	.	.			trans	-63.7	154	179.5	0	0	0	0	0	112.4	E329 I330	G326-E329 PolarHBondContact N-OE2 3.35Å; G326-E329 VanDerWaalsContact N-OE2 3.08Å; G326-E329 PolarHBondContact O-N 3.47Å; G326-I330 PolarHBondContact O-N 3.17Å
327	G	88.9	Confident	89.5	Confident	22 Å²	22	40.4 Å²	40.4	23%	0.227	21%	0.208	C	C	.	.	H	α-helix	trans	-54.8	-54.9	174.3	0	0	0	0	0	112.9	E329 I330 E331	G327-E329 PolarHBondContact O-N 2.82Å; G327-I330 VanDerWaalsContact O-CG2 3.28Å; G327-I330 WeakPolarHBondContact O-CG2 3.47Å; G327-I330 PolarHBondContact O-N 2.84Å; G327-I330 VanDerWaalsContact O-N 3.13Å; G327-E331 PolarHBondContact O-N 2.93Å
328	P	88.3	Confident	89.6	Confident	97 Å²	97	40.6 Å²	40.6	63%	0.63	22%	0.221	S	C	*	.	H	α-helix	trans	-60.3	-33.1	177.7	-25.3	34.9	0	0	0	113.4	L332	P328-L332 PolarHBondContact O-N 3.26Å; P328-L332 VanDerWaalsContact O-N 3.1Å
329	E	88.3	Confident	89.7	Confident	32 Å²	32	32.8 Å²	32.8	15%	0.15	19%	0.187	C	C	.	.	H	α-helix	trans	-69.1	-38.6	177.9	-58.3	-174.7	136.2	0	0	111.8	K210 I325 G326 G327 E331 L332 I333	K210-E329 IonicContact NZ-OE1 3.77Å; K210-E329 PolarHBondContact NZ-OE1 3.27Å; I325-E329 HydrophobicContact CG2-CB 3.76Å; G326-E329 PolarHBondContact N-OE2 3.35Å; G326-E329 VanDerWaalsContact N-OE2 3.08Å; G326-E329 PolarHBondContact O-N 3.47Å; G327-E329 PolarHBondContact O-N 2.82Å; E329-E331 VanDerWaalsContact C-N 3.31Å; E329-E331 PolarHBondContact O-N 3.38Å; E329-L332 PolarHBondContact O-N 2.95Å; E329-I333 WeakPolarHBondContact O-CD1 3.36Å; E329-I333 WeakPolarHBondContact O-CG1 3.38Å; E329-I333 PolarHBondContact O-N 2.99Å
330	I	91.3	Very high	89.9	Confident	4 Å²	4	41.1 Å²	41.1	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-67.6	-35.2	179.7	-144.8	170.4	0	0	0	111.7	I250 T252 I301 Q303 I325 G326 G327 A334 I341	I250-I330 HydrophobicContact CG2-CD1 3.76Å; I250-I330 HydrophobicContact CG2-CG1 3.41Å; I250-I330 VanDerWaalsContact CG2-CG1 3.41Å; T252-I330 HydrophobicContact CG2-CD1 4.34Å; I301-I330 HydrophobicContact CG2-CD1 4.39Å; I301-I330 HydrophobicContact CG2-CG1 4.23Å; Q303-I330 HydrophobicContact CB-CD1 3.97Å; I325-I330 HydrophobicContact CG2-CB 4.24Å; I325-I330 HydrophobicContact CG2-CG1 4.49Å; G326-I330 PolarHBondContact O-N 3.17Å; G327-I330 VanDerWaalsContact O-CG2 3.28Å; G327-I330 WeakPolarHBondContact O-CG2 3.47Å; G327-I330 PolarHBondContact O-N 2.84Å; G327-I330 VanDerWaalsContact O-N 3.13Å; I330-A334 WeakPolarHBondContact O-CB 3.39Å; I330-A334 PolarHBondContact O-N 3.39Å; I330-I341 HydrophobicContact CG2-CD1 4.03Å
331	E	90.2	Very high	90	Very high	113 Å²	113	44 Å²	44	53%	0.528	23%	0.232	S	C	.	.	H	α-helix	trans	-66.5	-46.1	174.6	-70.2	175.4	177.7	0	0	110.9	G327 E329 I333 A334 I335 I341	G327-E331 PolarHBondContact O-N 2.93Å; E329-E331 VanDerWaalsContact C-N 3.31Å; E329-E331 PolarHBondContact O-N 3.38Å; E331-I333 PolarHBondContact O-N 3.43Å; E331-A334 WeakPolarHBondContact O-CB 3.25Å; E331-A334 PolarHBondContact O-N 2.93Å; E331-I335 VanDerWaalsContact O-CG1 3.31Å; E331-I335 WeakPolarHBondContact O-CG1 3.41Å; E331-I335 PolarHBondContact O-N 3.05Å; E331-I341 HydrophobicContact CG-CD1 3.95Å
332	L	88.4	Confident	90.1	Very high	21 Å²	21	44.1 Å²	44.1	11%	0.11	23%	0.233	C	C	.	.	H	α-helix	trans	-60.1	-43	174.7	-80.5	169.5	0	0	0	112.6	E207 K210 V228 P328 E329 A334 I335 A336	E207-L332 WeakPolarHBondContact O-CD2 3.41Å; K210-L332 HydrophobicContact CB-CD1 4.12Å; K210-L332 HydrophobicContact CD-CD1 4.16Å; K210-L332 HydrophobicContact CG-CD1 4.44Å; V228-L332 HydrophobicContact CG2-CB 4.24Å; P328-L332 PolarHBondContact O-N 3.26Å; P328-L332 VanDerWaalsContact O-N 3.1Å; E329-L332 PolarHBondContact O-N 2.95Å; L332-A334 VanDerWaalsContact C-N 3.33Å; L332-A334 PolarHBondContact O-N 3.48Å; L332-I335 PolarHBondContact O-N 2.99Å; L332-A336 VanDerWaalsContact O-CB 3.27Å; L332-A336 WeakPolarHBondContact O-CB 3.44Å; L332-A336 PolarHBondContact O-N 3.43Å
333	I	90.4	Very high	90.1	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-63.7	-41.1	176.3	-65.7	162.7	0	0	0	110.3	V228 V230 I250 I301 I325 E329 E331 T337 I374	V228-I333 HydrophobicContact CB-CG1 4.12Å; V228-I333 HydrophobicContact CG1-CG1 3.87Å; V228-I333 HydrophobicContact CG2-CG1 4.32Å; V230-I333 HydrophobicContact CG2-CD1 3.85Å; I250-I333 HydrophobicContact CD1-CG2 4.01Å; I250-I333 HydrophobicContact CG1-CG2 4.41Å; I301-I333 HydrophobicContact CD1-CD1 4.21Å; I301-I333 HydrophobicContact CD1-CG2 4.08Å; I301-I333 HydrophobicContact CG2-CD1 4.44Å; I325-I333 HydrophobicContact CG2-CD1 4.18Å; E329-I333 WeakPolarHBondContact O-CD1 3.36Å; E329-I333 WeakPolarHBondContact O-CG1 3.38Å; E329-I333 PolarHBondContact O-N 2.99Å; E331-I333 PolarHBondContact O-N 3.43Å; I333-T337 HydrophobicContact CG2-CG2 4.06Å; I333-T337 VanDerWaalsContact O-CB 3.29Å; I333-T337 WeakPolarHBondContact O-CB 3.46Å; I333-T337 WeakPolarHBondContact O-CG2 3.18Å; I333-T337 PolarHBondContact O-N 3.42Å; I333-T337 PolarHBondContact O-OG1 3.29Å; I333-I374 HydrophobicContact CD1-CD1 4.43Å; I333-I374 HydrophobicContact CG1-CD1 4.23Å; I333-I374 HydrophobicContact CG2-CD1 4.16Å
334	A	91.1	Very high	89.9	Confident	11 Å²	11	51.4 Å²	51.4	9%	0.091	27%	0.269	C	S	.	.	H	α-helix	trans	-61.8	-45.9	176.1	0	0	0	0	0	111.7	I250 I330 E331 L332 G338 G339 I341	I250-A334 VanDerWaalsContact CD1-CA 3.46Å; I250-A334 HydrophobicContact CD1-CB 3.84Å; I330-A334 WeakPolarHBondContact O-CB 3.39Å; I330-A334 PolarHBondContact O-N 3.39Å; E331-A334 WeakPolarHBondContact O-CB 3.25Å; E331-A334 PolarHBondContact O-N 2.93Å; L332-A334 VanDerWaalsContact C-N 3.33Å; L332-A334 PolarHBondContact O-N 3.48Å; A334-G338 CarbonylContact O-C 3.6Å; A334-G338 VanDerWaalsContact O-CA 3.31Å; A334-G338 WeakPolarHBondContact O-CA 3.33Å; A334-G338 PolarHBondContact O-N 3.31Å; A334-G339 PolarHBondContact O-N 3.4Å; A334-G339 VanDerWaalsContact O-N 3.16Å; A334-I341 HydrophobicContact CB-CD1 4.27Å; A334-I341 HydrophobicContact CB-CG1 3.81Å
335	I	89.6	Confident	89.7	Confident	71 Å²	71	45.6 Å²	45.6	36%	0.364	25%	0.248	S	C	.	.	H	α-helix	trans	-65.5	-44.7	178.7	-64.9	164.3	0	0	0	111.4	L208 E331 L332 N379	L208-I335 HydrophobicContact CD2-CD1 4.06Å; L208-I335 HydrophobicContact CD2-CG2 3.76Å; E331-I335 VanDerWaalsContact O-CG1 3.31Å; E331-I335 WeakPolarHBondContact O-CG1 3.41Å; E331-I335 PolarHBondContact O-N 3.05Å; L332-I335 PolarHBondContact O-N 2.99Å; I335-N379 WeakPolarHBondContact O-CB 3.17Å; I335-N379 PolarHBondContact O-ND2 3.21Å
336	A	88.6	Confident	89.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.8	-51.8	179.8	0	0	0	0	0	111.2	V228 L332 G338 C377 N379 A382	V228-A336 HydrophobicContact CG2-CB 3.76Å; L332-A336 VanDerWaalsContact O-CB 3.27Å; L332-A336 WeakPolarHBondContact O-CB 3.44Å; L332-A336 PolarHBondContact O-N 3.43Å; A336-G338 VanDerWaalsContact C-N 3.31Å; A336-G338 PolarHBondContact O-N 2.75Å; A336-C377 HydrophobicContact CB-CB 4.24Å; A336-C377 WeakPolarHBondContact O-CB 3.48Å; A336-N379 WeakPolarHBondContact O-CB 3.39Å; A336-N379 PolarHBondContact O-N 2.95Å; A336-N379 VanDerWaalsContact O-N 3.1Å; A336-A382 HydrophobicContact CB-CB 3.72Å
337	T	88.5	Confident	89.3	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.006	28%	0.282	C	S	.	.	H	α-helix	trans	-79.7	-14.3	-174.6	65	0	0	0	0	113.3	I248 I333 G339 G354 T355 A356 I374	I248-T337 HydrophobicContact CD1-CG2 3.8Å; I333-T337 HydrophobicContact CG2-CG2 4.06Å; I333-T337 VanDerWaalsContact O-CB 3.29Å; I333-T337 WeakPolarHBondContact O-CB 3.46Å; I333-T337 WeakPolarHBondContact O-CG2 3.18Å; I333-T337 PolarHBondContact O-N 3.42Å; I333-T337 PolarHBondContact O-OG1 3.29Å; T337-G339 PolarHBondContact O-N 3.29Å; T337-G339 PolarHBondContact OG1-N 2.66Å; T337-G354 WeakPolarHBondContact OG1-CA 3.33Å; T337-T355 PolarHBondContact O-N 3.5Å; T337-A356 HydrophobicContact CG2-CB 4.47Å; T337-I374 HydrophobicContact CG2-CG2 4.4Å
338	G	87.2	Confident	89.3	Confident	51 Å²	51	51.9 Å²	51.9	53%	0.526	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.4	11.9	-172.2	0	0	0	0	0	113.9	A334 A336	A334-G338 CarbonylContact O-C 3.6Å; A334-G338 VanDerWaalsContact O-CA 3.31Å; A334-G338 WeakPolarHBondContact O-CA 3.33Å; A334-G338 PolarHBondContact O-N 3.31Å; A336-G338 VanDerWaalsContact C-N 3.31Å; A336-G338 PolarHBondContact O-N 2.75Å
339	G	88.9	Confident	89.3	Confident	8 Å²	8	49.7 Å²	49.7	8%	0.082	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-76.8	160.6	177.5	0	0	0	0	0	112.2	A334 T337	A334-G339 PolarHBondContact O-N 3.4Å; A334-G339 VanDerWaalsContact O-N 3.16Å; T337-G339 PolarHBondContact O-N 3.29Å; T337-G339 PolarHBondContact OG1-N 2.66Å
340	R	91.9	Very high	89.3	Confident	177 Å²	177	52.3 Å²	52.3	67%	0.668	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-102.2	139.8	171	-68.9	-170.7	179.2	176.9	1.3	109.9	V342 K352	R340-V342 WeakPolarHBondContact O-CG2 3.48Å; R340-V342 PolarHBondContact O-N 3.3Å; R340-K352 HydrophobicContact CB-CB 4.18Å; R340-K352 HydrophobicContact CB-CG 4.23Å; R340-K352 PolarHBondContact N-O 3.32Å
341	I	93.6	Very high	89.2	Confident	64 Å²	64	61 Å²	61	33%	0.328	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-68.9	120.6	172.9	-57.7	169	0	0	0	108.2	I250 T252 I330 E331 A334	I250-I341 HydrophobicContact CG2-CB 4.48Å; I250-I341 HydrophobicContact CG2-CG1 4.04Å; T252-I341 HydrophobicContact CG2-CG2 3.25Å; I330-I341 HydrophobicContact CG2-CD1 4.03Å; E331-I341 HydrophobicContact CG-CD1 3.95Å; A334-I341 HydrophobicContact CB-CD1 4.27Å; A334-I341 HydrophobicContact CB-CG1 3.81Å
342	V	93.1	Very high	89.1	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.012	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-106.5	123.2	-176.9	-179.6	0	0	0	0	110.6	I250 L251 T252 R340 R344 E347 L348 K352	I250-V342 PolarHBondContact O-N 3.48Å; L251-V342 WeakPolarHBondContact CA-O 3.37Å; L251-V342 HydrophobicContact CD2-CB 4.19Å; T252-V342 PolarHBondContact N-O 3.39Å; R340-V342 WeakPolarHBondContact O-CG2 3.48Å; R340-V342 PolarHBondContact O-N 3.3Å; V342-R344 WeakPolarHBondContact CG1-O 3.21Å; V342-E347 HydrophobicContact CG1-CB 4.22Å; V342-L348 HydrophobicContact CB-CD1 4.26Å; V342-L348 HydrophobicContact CG1-CB 4.47Å; V342-L348 HydrophobicContact CG1-CD1 4.34Å; V342-L348 HydrophobicContact CG2-CD1 3.92Å; V342-K352 HydrophobicContact CG2-CB 4.11Å; V342-K352 HydrophobicContact CG2-CD 3.97Å
343	P	90.5	Very high	89.2	Confident	67 Å²	67	58 Å²	58	44%	0.435	31%	0.305	S	S	.	.	S	Bend	trans	-85.5	-20.1	-178.2	32.6	-35.2	0	0	0	114.8	T252 C253	T252-P343 VanDerWaalsContact OG1-CA 3.3Å; T252-P343 WeakPolarHBondContact OG1-CA 3.45Å; C253-P343 WeakPolarHBondContact CB-O 3.36Å
344	R	88.1	Confident	89.2	Confident	160 Å²	160	57.9 Å²	57.9	60%	0.604	30%	0.304	S	S	*	.	S	Bend	trans	-138.6	136.9	-176.6	-69.8	-173	-79.4	-157.6	-5.6	111	V342 C346 E347	V342-R344 WeakPolarHBondContact CG1-O 3.21Å; R344-C346 VanDerWaalsContact C-N 3.27Å; R344-C346 PolarHBondContact O-N 2.85Å; R344-E347 HydrophobicContact CB-CG 4.35Å; R344-E347 IonicContact CZ-OE1 2.78Å; R344-E347 IonicContact NE-OE1 3.29Å; R344-E347 PolarHBondContact NE-OE1 3.45Å; R344-E347 IonicContact NH2-OE1 3.42Å; R344-E347 PolarHBondContact NH2-OE1 2.64Å; R344-E347 PolarHBondContact O-N 2.95Å
345	F	85.6	Confident	89.1	Confident	22 Å²	22	60.3 Å²	60.3	10%	0.096	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-55.1	-38.8	178.9	-62.6	-76.7	0	0	0	113.4	L251 C253 F255 M288 V292 E347 L348	L251-F345 HydrophobicContact CD1-CD1 4.34Å; L251-F345 HydrophobicContact CD1-CE1 3.75Å; C253-F345 HydrophobicContact CB-CE2 4.03Å; C253-F345 HydrophobicContact CB-CZ 4.4Å; C253-F345 WeakPolarHBondContact SG-CE2 3.28Å; C253-F345 WeakPolarHBondContact SG-CZ 3.36Å; F255-F345 AromaticContact CD1-CE1 3.98Å; F255-F345 HydrophobicContact CD1-CE1 3.98Å; F255-F345 AromaticContact CD1-CZ 3.85Å; F255-F345 HydrophobicContact CD1-CZ 3.85Å; F255-F345 HydrophobicContact CD2-CZ 4.36Å; F255-F345 AromaticContact CE1-CE1 3.6Å; F255-F345 HydrophobicContact CE1-CE1 3.6Å; F255-F345 AromaticContact CE1-CZ 3.97Å; F255-F345 HydrophobicContact CE1-CZ 3.97Å; F255-F345 HydrophobicContact CE2-CE1 4.23Å; F255-F345 HydrophobicContact CE2-CZ 4.48Å; F255-F345 HydrophobicContact CG-CE1 4.45Å; F255-F345 HydrophobicContact CG-CZ 4.05Å; F255-F345 AromaticContact CZ-CE1 3.75Å; F255-F345 HydrophobicContact CZ-CE1 3.75Å; F255-F345 HydrophobicContact CZ-CZ 4.3Å; M288-F345 HydrophobicContact CG-CD2 4.01Å; M288-F345 HydrophobicContact CG-CE2 4.16Å; M288-F345 HydrophobicContact CG-CG 4.39Å; M288-F345 HydrophobicContact SD-CD2 3.84Å; M288-F345 HydrophobicContact SD-CE2 3.5Å; M288-F345 VanDerWaalsContact SD-CE2 3.5Å; M288-F345 HydrophobicContact SD-CZ 4.14Å; V292-F345 HydrophobicContact CG2-CD1 3.95Å; V292-F345 HydrophobicContact CG2-CE1 4.19Å; F345-E347 PolarHBondContact O-N 3.37Å; F345-E347 VanDerWaalsContact O-N 3.17Å; F345-L348 WeakPolarHBondContact O-CB 3.27Å; F345-L348 PolarHBondContact O-N 3.03Å
346	C	85.5	Confident	89.1	Confident	110 Å²	110	57.2 Å²	57.2	74%	0.743	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-64.2	-21	178.8	-52.2	0	0	0	0	114.1	R344	R344-C346 VanDerWaalsContact C-N 3.27Å; R344-C346 PolarHBondContact O-N 2.85Å
347	E	87.3	Confident	88.9	Confident	63 Å²	63	57.8 Å²	57.8	29%	0.294	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-92.9	-0.6	179.5	-65.3	178.2	-159.6	0	0	112.2	V342 R344 F345 T349 K352	V342-E347 HydrophobicContact CG1-CB 4.22Å; R344-E347 HydrophobicContact CB-CG 4.35Å; R344-E347 IonicContact CZ-OE1 2.78Å; R344-E347 IonicContact NE-OE1 3.29Å; R344-E347 PolarHBondContact NE-OE1 3.45Å; R344-E347 IonicContact NH2-OE1 3.42Å; R344-E347 PolarHBondContact NH2-OE1 2.64Å; R344-E347 PolarHBondContact O-N 2.95Å; F345-E347 PolarHBondContact O-N 3.37Å; F345-E347 VanDerWaalsContact O-N 3.17Å; E347-T349 PolarHBondContact O-N 2.97Å; E347-K352 WeakPolarHBondContact O-CD 3.47Å; E347-K352 PolarHBondContact O-NZ 3.16Å
348	L	88.3	Confident	88.9	Confident	15 Å²	15	60.1 Å²	60.1	8%	0.079	32%	0.321	C	S	.	.			trans	-69.8	120.7	178.6	-166.6	71.1	0	0	0	109.3	A249 L251 V292 T295 V342 F345 L353	A249-L348 HydrophobicContact CB-CD1 4.32Å; A249-L348 HydrophobicContact CB-CD2 4.47Å; L251-L348 HydrophobicContact CD2-CD1 4.12Å; V292-L348 HydrophobicContact CB-CD2 4.22Å; V292-L348 HydrophobicContact CG1-CD2 4.24Å; V292-L348 HydrophobicContact CG2-CD2 4.01Å; T295-L348 HydrophobicContact CG2-CB 4.2Å; T295-L348 HydrophobicContact CG2-CD2 3.85Å; T295-L348 HydrophobicContact CG2-CG 3.82Å; T295-L348 WeakPolarHBondContact CG2-O 3.4Å; T295-L348 WeakPolarHBondContact OG1-CD2 3.42Å; V342-L348 HydrophobicContact CB-CD1 4.26Å; V342-L348 HydrophobicContact CG1-CB 4.47Å; V342-L348 HydrophobicContact CG1-CD1 4.34Å; V342-L348 HydrophobicContact CG2-CD1 3.92Å; F345-L348 WeakPolarHBondContact O-CB 3.27Å; F345-L348 PolarHBondContact O-N 3.03Å; L348-L353 HydrophobicContact CD1-CD2 4.01Å; L348-L353 HydrophobicContact CG-CD2 4.45Å
349	T	89.3	Confident	89.1	Confident	51 Å²	51	57.7 Å²	57.7	31%	0.313	30%	0.296	S	S	.	.			trans	-127.5	151.4	177.3	54.9	0	0	0	0	109.1	E347 E351 K352	E347-T349 PolarHBondContact O-N 2.97Å; T349-E351 PolarHBondContact O-N 3.45Å; T349-E351 VanDerWaalsContact O-N 3.11Å; T349-K352 PolarHBondContact O-N 3.07Å; T349-K352 WeakPolarHBondContact OG1-CD 3.36Å; T349-K352 WeakPolarHBondContact OG1-CE 3.26Å; T349-K352 VanDerWaalsContact OG1-CG 3.26Å; T349-K352 WeakPolarHBondContact OG1-CG 3.24Å
350	P	88.8	Confident	89.1	Confident	86 Å²	86	61.9 Å²	61.9	56%	0.558	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-54.6	-32.7	179.9	-27	34.3	0	0	0	113.9	K352 L353	P350-K352 VanDerWaalsContact C-N 3.25Å; P350-K352 PolarHBondContact O-N 3.24Å; P350-L353 PolarHBondContact O-N 3.33Å
351	E	88.1	Confident	88.9	Confident	187 Å²	187	54.3 Å²	54.3	87%	0.874	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-67.8	-21.1	177.7	-61	178.4	179.9	0	0	114.2	T349	T349-E351 PolarHBondContact O-N 3.45Å; T349-E351 VanDerWaalsContact O-N 3.11Å
352	K	88.8	Confident	88.4	Confident	53 Å²	53	53.1 Å²	53.1	23%	0.23	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-90.2	-8.5	-179.1	-68.2	176.4	-169.6	177.2	0	112.4	R340 V342 E347 T349 P350	R340-K352 HydrophobicContact CB-CB 4.18Å; R340-K352 HydrophobicContact CB-CG 4.23Å; R340-K352 PolarHBondContact N-O 3.32Å; V342-K352 HydrophobicContact CG2-CB 4.11Å; V342-K352 HydrophobicContact CG2-CD 3.97Å; E347-K352 WeakPolarHBondContact O-CD 3.47Å; E347-K352 PolarHBondContact O-NZ 3.16Å; T349-K352 PolarHBondContact O-N 3.07Å; T349-K352 WeakPolarHBondContact OG1-CD 3.36Å; T349-K352 WeakPolarHBondContact OG1-CE 3.26Å; T349-K352 VanDerWaalsContact OG1-CG 3.26Å; T349-K352 WeakPolarHBondContact OG1-CG 3.24Å; P350-K352 VanDerWaalsContact C-N 3.25Å; P350-K352 PolarHBondContact O-N 3.24Å
353	L	90.4	Very high	87.7	Confident	17 Å²	17	56.9 Å²	56.9	9%	0.089	31%	0.305	C	S	.	.			trans	-71.4	140.1	179.6	-61.2	178.2	0	0	0	110.8	K247 A249 T295 A297 L348 P350	K247-L353 HydrophobicContact CB-CD1 4.4Å; A249-L353 HydrophobicContact CB-CD2 3.87Å; T295-L353 WeakPolarHBondContact O-CD1 3.41Å; A297-L353 HydrophobicContact CB-CD1 4Å; A297-L353 HydrophobicContact CB-CD2 3.87Å; L348-L353 HydrophobicContact CD1-CD2 4.01Å; L348-L353 HydrophobicContact CG-CD2 4.45Å; P350-L353 PolarHBondContact O-N 3.33Å
354	G	89.6	Confident	86.7	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	150.3	170.1	0	0	0	0	0	111.1	K247 I248 T337	K247-G354 CarbonylContact C-O 3.51Å; K247-G354 WeakPolarHBondContact CA-O 3.3Å; I248-G354 PolarHBondContact N-O 2.83Å; I248-G354 PolarHBondContact O-N 3.35Å; T337-G354 WeakPolarHBondContact OG1-CA 3.33Å
355	T	89.9	Confident	85.5	Confident	61 Å²	61	50.9 Å²	50.9	37%	0.374	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	127.3	176.7	52.5	0	0	0	0	110.8	A246 T337	A246-T355 WeakPolarHBondContact O-CA 3.32Å; T337-T355 PolarHBondContact O-N 3.5Å
356	A	88.3	Confident	84.2	Confident	6 Å²	6	57 Å²	57	5%	0.05	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	143.4	173.9	0	0	0	0	0	110.8	D245 A246 I248 T337 I374	D245-A356 CarbonylContact C-O 3.59Å; A246-A356 WeakPolarHBondContact CA-O 3.39Å; A246-A356 HydrophobicContact CB-CB 4.33Å; A246-A356 PolarHBondContact N-O 3.15Å; A246-A356 PolarHBondContact O-N 3.27Å; I248-A356 HydrophobicContact CD1-CB 3.9Å; T337-A356 HydrophobicContact CG2-CB 4.47Å; A356-I374 HydrophobicContact CB-CG2 3.65Å
357	G	85.6	Confident	82.9	Confident	13 Å²	13	55.4 Å²	55.4	13%	0.134	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	-39.2	-179.2	0	0	0	0	0	113.2	N244 D245 T375 E376	N244-G357 CarbonylContact C-O 3.29Å; N244-G357 WeakPolarHBondContact CA-O 3.48Å; D245-G357 PolarHBondContact N-O 2.77Å; G357-T375 PolarHBondContact N-O 2.9Å; G357-E376 PolarHBondContact N-O 3.28Å
358	L	89.3	Confident	81.8	Confident	49 Å²	49	61.4 Å²	61.4	26%	0.257	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	127.1	-178.2	-178	74.8	0	0	0	111.5	L243 N244 K360 T375	L243-L358 WeakPolarHBondContact O-CA 3.26Å; N244-L358 WeakPolarHBondContact OD1-CD1 3.43Å; L358-K360 HydrophobicContact CG-CB 4.46Å; L358-T375 PolarHBondContact N-O 3.14Å; L358-T375 VanDerWaalsContact N-O 3.17Å; L358-T375 PolarHBondContact O-N 3.08Å; L358-T375 PolarHBondContact O-OG1 2.9Å
359	V	90.3	Very high	81	Confident	0 Å²	0	64 Å²	64	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	118.3	166.6	-179.7	0	0	0	0	108.1	F234 A242 L243 A246 I248 L299 L372 V373 I374	F234-V359 HydrophobicContact CZ-CG1 4.22Å; A242-V359 CarbonylContact C-O 3.53Å; A242-V359 WeakPolarHBondContact CA-O 3.15Å; L243-V359 HydrophobicContact CB-CB 4.4Å; L243-V359 PolarHBondContact N-O 3.06Å; L243-V359 PolarHBondContact O-N 2.99Å; A246-V359 HydrophobicContact CB-CB 4.42Å; A246-V359 HydrophobicContact CB-CG2 3.53Å; I248-V359 HydrophobicContact CD1-CG2 4.1Å; L299-V359 HydrophobicContact CD2-CB 4.32Å; L299-V359 HydrophobicContact CD2-CG1 3.89Å; L299-V359 HydrophobicContact CD2-CG2 3.96Å; V359-L372 HydrophobicContact CG1-CD1 3.89Å; V359-L372 HydrophobicContact CG1-CD2 3.85Å; V359-L372 HydrophobicContact CG1-CG 3.86Å; V359-V373 WeakPolarHBondContact CA-O 3.32Å; V359-I374 HydrophobicContact CG1-CG1 4.31Å; V359-I374 HydrophobicContact CG2-CB 4.48Å; V359-I374 HydrophobicContact CG2-CG1 4.19Å; V359-I374 HydrophobicContact CG2-CG2 4.09Å
360	K	90	Very high	80.6	Confident	96 Å²	96	63.6 Å²	63.6	42%	0.417	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	134.2	-177.4	-175.5	179.8	175.9	-174.3	0	111	K241 A242 L358 I362 V373	K241-K360 WeakPolarHBondContact O-CA 3.3Å; A242-K360 HydrophobicContact CB-CG 4.34Å; L358-K360 HydrophobicContact CG-CB 4.46Å; K360-I362 HydrophobicContact CD-CG1 4.17Å; K360-I362 HydrophobicContact CG-CG1 4.1Å; K360-V373 PolarHBondContact N-O 3.08Å; K360-V373 PolarHBondContact O-N 3.13Å
361	E	87.8	Confident	80.5	Confident	19 Å²	19	59.6 Å²	59.6	9%	0.089	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	116.9	163.4	-177.3	179	-127	0	0	108.9	E233 F234 K241 H370 M371	E233-E361 WeakPolarHBondContact CB-OE1 3.46Å; F234-E361 HydrophobicContact CD2-CB 3.84Å; F234-E361 HydrophobicContact CD2-CG 4.47Å; F234-E361 HydrophobicContact CE2-CB 3.75Å; F234-E361 PolarHBondContact N-OE1 3.37Å; K241-E361 HydrophobicContact CB-CB 4.33Å; K241-E361 WeakPolarHBondContact CD-OE2 3.35Å; K241-E361 WeakPolarHBondContact CE-OE2 3.26Å; K241-E361 WeakPolarHBondContact CG-OE2 3.23Å; K241-E361 IonicContact NZ-OE2 3.9Å; K241-E361 PolarHBondContact O-N 3.13Å; E361-H370 HydrophobicContact CG-CB 3.8Å; E361-H370 WeakPolarHBondContact OE1-CB 3.43Å; E361-H370 IonicContact OE1-CG 3.33Å; E361-M371 CarbonylContact C-O 3.51Å; E361-M371 WeakPolarHBondContact CA-O 3.3Å
362	I	82.8	Confident	80.6	Confident	39 Å²	39	50.7 Å²	50.7	20%	0.2	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	120.3	177.2	-47	-178.5	0	0	0	107.9	K360 F364 M371 V373	K360-I362 HydrophobicContact CD-CG1 4.17Å; K360-I362 HydrophobicContact CG-CG1 4.1Å; I362-F364 HydrophobicContact CB-CD2 4.17Å; I362-F364 HydrophobicContact CB-CE1 4.24Å; I362-F364 HydrophobicContact CB-CE2 3.56Å; I362-F364 HydrophobicContact CB-CZ 3.61Å; I362-F364 HydrophobicContact CD1-CE2 4.47Å; I362-F364 HydrophobicContact CD1-CZ 3.93Å; I362-F364 HydrophobicContact CG1-CZ 4.36Å; I362-F364 HydrophobicContact CG2-CD1 3.82Å; I362-F364 HydrophobicContact CG2-CD2 4.05Å; I362-F364 HydrophobicContact CG2-CE1 3.37Å; I362-F364 HydrophobicContact CG2-CE2 3.62Å; I362-F364 HydrophobicContact CG2-CG 4.17Å; I362-F364 HydrophobicContact CG2-CZ 3.26Å; I362-M371 PolarHBondContact N-O 3.19Å; I362-M371 PolarHBondContact O-N 3.42Å; I362-V373 HydrophobicContact CD1-CB 4Å; I362-V373 HydrophobicContact CD1-CG2 3.58Å; I362-V373 HydrophobicContact CG1-CB 4.4Å; I362-V373 HydrophobicContact CG1-CG2 3.98Å
363	S	77.4	Confident	80.7	Confident	81 Å²	81	48.5 Å²	48.5	57%	0.566	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	130.6	167	57.8	0	0	0	0	109.1	H370	S363-H370 WeakPolarHBondContact CB-ND1 3.27Å
364	F	69.6	Low	80.7	Confident	38 Å²	38	47.8 Å²	47.8	17%	0.167	27%	0.273	C	S	.	.			trans	-126.1	120.2	-176	-74.9	-62.4	0	0	0	112	I362 D369 M371 F386 R388	I362-F364 HydrophobicContact CB-CD2 4.17Å; I362-F364 HydrophobicContact CB-CE1 4.24Å; I362-F364 HydrophobicContact CB-CE2 3.56Å; I362-F364 HydrophobicContact CB-CZ 3.61Å; I362-F364 HydrophobicContact CD1-CE2 4.47Å; I362-F364 HydrophobicContact CD1-CZ 3.93Å; I362-F364 HydrophobicContact CG1-CZ 4.36Å; I362-F364 HydrophobicContact CG2-CD1 3.82Å; I362-F364 HydrophobicContact CG2-CD2 4.05Å; I362-F364 HydrophobicContact CG2-CE1 3.37Å; I362-F364 HydrophobicContact CG2-CE2 3.62Å; I362-F364 HydrophobicContact CG2-CG 4.17Å; I362-F364 HydrophobicContact CG2-CZ 3.26Å; F364-D369 PolarHBondContact N-O 3.03Å; F364-M371 HydrophobicContact CE2-CB 4.48Å; F364-F386 HydrophobicContact CD1-CE1 4.49Å; F364-F386 HydrophobicContact CD2-CE1 4.04Å; F364-F386 AromaticContact CD2-CZ 3.93Å; F364-F386 HydrophobicContact CD2-CZ 3.93Å; F364-F386 HydrophobicContact CE1-CE1 4.13Å; F364-F386 AromaticContact CE2-CE1 3.65Å; F364-F386 HydrophobicContact CE2-CE1 3.65Å; F364-F386 AromaticContact CE2-CZ 3.83Å; F364-F386 HydrophobicContact CE2-CZ 3.83Å; F364-F386 HydrophobicContact CG-CE1 4.43Å; F364-F386 HydrophobicContact CZ-CD1 4.4Å; F364-F386 AromaticContact CZ-CE1 3.69Å; F364-F386 HydrophobicContact CZ-CE1 3.69Å; F364-F386 HydrophobicContact CZ-CZ 4.34Å; F364-R388 VanDerWaalsContact CG-NH1 3.25Å
365	G	63	Low	80.6	Confident	62 Å²	62	49.3 Å²	49.3	64%	0.639	28%	0.283	S	S	*	.	S	Bend	trans	81.3	-161.1	175.2	0	0	0	0	0	114.4
366	T	57.4	Low	80.2	Confident	152 Å²	152	53 Å²	53	93%	0.933	30%	0.296	S	S	*	.	S	Bend	trans	-90.8	-20.6	178.1	25.5	0	0	0	0	113.5
367	T	59.2	Low	79.8	Confident	76 Å²	76	53.4 Å²	53.4	47%	0.466	30%	0.298	S	S	.	.	S	Bend	trans	-70.5	131.7	166.8	36.3	0	0	0	0	108.1	D369	T367-D369 PolarHBondContact O-N 3.11Å
368	K	64	Low	79.2	Confident	188 Å²	188	61.1 Å²	61.1	82%	0.817	33%	0.328	S	S	*	.			trans	-70.1	32.4	-178.9	-67.3	-178.8	175.5	179.1	0	113	H370	K368-H370 PolarHBondContact O-CD2 3.33Å
369	D	71.6	Confident	78.5	Confident	69 Å²	69	61.2 Å²	61.2	37%	0.369	33%	0.329	S	S	.	.			trans	-82.7	126	-178.5	-76.7	20.6	0	0	0	108.7	K214 F364 T367	K214-D369 IonicContact NZ-OD2 3.6Å; K214-D369 PolarHBondContact NZ-OD2 3.39Å; F364-D369 PolarHBondContact N-O 3.03Å; T367-D369 PolarHBondContact O-N 3.11Å
370	H	81.3	Confident	77.6	Confident	43 Å²	43	65.2 Å²	65.2	20%	0.199	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	133.3	179.2	-65.9	-59.5	0	0	0	108.9	E233 E361 S363 K368	E233-H370 HydrophobicContact CB-CB 4.05Å; E233-H370 IonicContact OE2-CD2 3.53Å; E361-H370 HydrophobicContact CG-CB 3.8Å; E361-H370 WeakPolarHBondContact OE1-CB 3.43Å; E361-H370 IonicContact OE1-CG 3.33Å; S363-H370 WeakPolarHBondContact CB-ND1 3.27Å; K368-H370 PolarHBondContact O-CD2 3.33Å
371	M	87.3	Confident	77	Confident	2 Å²	2	65.1 Å²	65.1	1%	0.01	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	143.3	172.7	-62.3	-172	99.9	0	0	109.9	E212 K214 V229 D231 E361 I362 F364 F386	E212-M371 HydrophobicContact CG-CE 3.83Å; K214-M371 HydrophobicContact CB-SD 4.36Å; K214-M371 HydrophobicContact CG-CE 3.87Å; K214-M371 HydrophobicContact CG-SD 3.58Å; K214-M371 VanDerWaalsContact CG-SD 3.58Å; V229-M371 HydrophobicContact CG1-CB 4.24Å; V229-M371 HydrophobicContact CG1-CE 3.79Å; V229-M371 HydrophobicContact CG1-SD 4.03Å; D231-M371 HydrophobicContact CB-CE 3.57Å; E361-M371 CarbonylContact C-O 3.51Å; E361-M371 WeakPolarHBondContact CA-O 3.3Å; I362-M371 PolarHBondContact N-O 3.19Å; I362-M371 PolarHBondContact O-N 3.42Å; F364-M371 HydrophobicContact CE2-CB 4.48Å; M371-F386 HydrophobicContact CE-CE2 4.16Å; M371-F386 HydrophobicContact SD-CD2 4.35Å; M371-F386 HydrophobicContact SD-CE2 3.35Å; M371-F386 WeakPolarHBondContact SD-CE2 3.41Å; M371-F386 HydrophobicContact SD-CZ 3.65Å
372	L	89.6	Confident	76.9	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.005	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	124.2	175.6	-171.3	132.2	0	0	0	109.3	V230 K232 F234 V322 V359 I374	V230-L372 PolarHBondContact N-O 2.79Å; V230-L372 PolarHBondContact O-N 3.33Å; K232-L372 WeakPolarHBondContact O-CB 3.39Å; K232-L372 PolarHBondContact O-N 2.96Å; F234-L372 HydrophobicContact CD1-CD1 4.23Å; F234-L372 HydrophobicContact CD2-CD1 4.37Å; F234-L372 HydrophobicContact CE1-CD1 3.75Å; F234-L372 HydrophobicContact CE2-CD1 3.9Å; F234-L372 HydrophobicContact CZ-CD1 3.56Å; V322-L372 HydrophobicContact CG2-CD1 3.75Å; V359-L372 HydrophobicContact CG1-CD1 3.89Å; V359-L372 HydrophobicContact CG1-CD2 3.85Å; V359-L372 HydrophobicContact CG1-CG 3.86Å; L372-I374 HydrophobicContact CD2-CD1 3.83Å; L372-I374 HydrophobicContact CD2-CG1 3.52Å
373	V	90.6	Very high	77.3	Confident	7 Å²	7	62.5 Å²	62.5	4%	0.042	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	123.4	178.6	-177.3	0	0	0	0	108.7	I225 V229 V359 K360 I362 T375	I225-V373 HydrophobicContact CD1-CG1 4.17Å; I225-V373 HydrophobicContact CG2-CG1 3.73Å; V229-V373 HydrophobicContact CG1-CG2 4.33Å; V229-V373 HydrophobicContact CG2-CG1 4.44Å; V229-V373 HydrophobicContact CG2-CG2 4.2Å; V359-V373 WeakPolarHBondContact CA-O 3.32Å; K360-V373 PolarHBondContact N-O 3.08Å; K360-V373 PolarHBondContact O-N 3.13Å; I362-V373 HydrophobicContact CD1-CB 4Å; I362-V373 HydrophobicContact CD1-CG2 3.58Å; I362-V373 HydrophobicContact CG1-CB 4.4Å; I362-V373 HydrophobicContact CG1-CG2 3.98Å; V373-T375 HydrophobicContact CG1-CG2 3.69Å
374	I	90.2	Very high	78	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	115.2	176.1	-52.5	179.1	0	0	0	107.2	G227 V228 I248 I301 I333 T337 A356 V359 L372	G227-I374 WeakPolarHBondContact CA-O 3.42Å; V228-I374 PolarHBondContact N-O 3.12Å; V228-I374 VanDerWaalsContact N-O 3.15Å; V228-I374 PolarHBondContact O-N 3.39Å; I248-I374 HydrophobicContact CD1-CD1 4.38Å; I248-I374 HydrophobicContact CD1-CG2 4.11Å; I301-I374 HydrophobicContact CD1-CD1 3.99Å; I333-I374 HydrophobicContact CD1-CD1 4.43Å; I333-I374 HydrophobicContact CG1-CD1 4.23Å; I333-I374 HydrophobicContact CG2-CD1 4.16Å; T337-I374 HydrophobicContact CG2-CG2 4.4Å; A356-I374 HydrophobicContact CB-CG2 3.65Å; V359-I374 HydrophobicContact CG1-CG1 4.31Å; V359-I374 HydrophobicContact CG2-CB 4.48Å; V359-I374 HydrophobicContact CG2-CG1 4.19Å; V359-I374 HydrophobicContact CG2-CG2 4.09Å; L372-I374 HydrophobicContact CD2-CD1 3.83Å; L372-I374 HydrophobicContact CD2-CG1 3.52Å
375	T	86.9	Confident	79.1	Confident	33 Å²	33	56.9 Å²	56.9	20%	0.202	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	164.5	-178.4	51.7	0	0	0	0	111.8	I225 G357 L358 V373	I225-T375 HydrophobicContact CG2-CG2 3.82Å; G357-T375 PolarHBondContact N-O 2.9Å; L358-T375 PolarHBondContact N-O 3.14Å; L358-T375 VanDerWaalsContact N-O 3.17Å; L358-T375 PolarHBondContact O-N 3.08Å; L358-T375 PolarHBondContact O-OG1 2.9Å; V373-T375 HydrophobicContact CG1-CG2 3.69Å
376	E	82.6	Confident	80.5	Confident	139 Å²	139	54 Å²	54	65%	0.65	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	60.6	46.5	179.7	-58	179.1	172	0	0	112.3	G357	G357-E376 PolarHBondContact N-O 3.28Å
377	C	79.1	Confident	82.1	Confident	13 Å²	13	46.8 Å²	46.8	9%	0.088	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	153.5	176.9	-55	0	0	0	0	111.4	A336 N379	A336-C377 HydrophobicContact CB-CB 4.24Å; A336-C377 WeakPolarHBondContact O-CB 3.48Å; C377-N379 PolarHBondContact O-N 3.4Å
378	K	72.4	Confident	83.4	Confident	175 Å²	175	43.7 Å²	43.7	76%	0.761	21%	0.208	S	C	*	.	S	Bend	trans	-58.5	-35.1	179.4	-173.9	178	-179.5	-177.7	0	112.9
379	N	75.1	Confident	84.5	Confident	52 Å²	52	34.7 Å²	34.7	28%	0.278	17%	0.169	S	C	.	.			trans	-104.8	110.7	174.8	-174.7	11.6	0	0	0	109.5	I335 A336 C377 R381	I335-N379 WeakPolarHBondContact O-CB 3.17Å; I335-N379 PolarHBondContact O-ND2 3.21Å; A336-N379 WeakPolarHBondContact O-CB 3.39Å; A336-N379 PolarHBondContact O-N 2.95Å; A336-N379 VanDerWaalsContact O-N 3.1Å; C377-N379 PolarHBondContact O-N 3.4Å; N379-R381 PolarHBondContact O-N 3.18Å; N379-R381 WeakPolarHBondContact OD1-CB 3.17Å; N379-R381 VanDerWaalsContact OD1-CG 3.29Å; N379-R381 WeakPolarHBondContact OD1-CG 3.38Å; N379-R381 PolarHBondContact OD1-N 3.24Å
380	T	71	Confident	85.2	Confident	84 Å²	84	34.3 Å²	34.3	52%	0.515	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-4.8	179	40.7	0	0	0	0	113.8	T195 A382	T195-T380 WeakPolarHBondContact CG2-O 3.32Å; T380-A382 VanDerWaalsContact C-N 3.27Å; T380-A382 PolarHBondContact O-N 3.11Å
381	R	79.1	Confident	85.4	Confident	93 Å²	93	35.7 Å²	35.7	35%	0.351	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-11.8	-174.2	-62.1	-176.2	95.6	168	12.2	114.7	V196 D198 L208 N379	V196-R381 WeakPolarHBondContact CG2-O 3.4Å; D198-R381 VanDerWaalsContact CB-NH2 3.34Å; D198-R381 IonicContact OD2-CZ 3.31Å; D198-R381 IonicContact OD2-NH1 3.84Å; D198-R381 IonicContact OD2-NH2 2.98Å; D198-R381 PolarHBondContact OD2-NH2 3.09Å; L208-R381 HydrophobicContact CD1-CB 4.46Å; N379-R381 PolarHBondContact O-N 3.18Å; N379-R381 WeakPolarHBondContact OD1-CB 3.17Å; N379-R381 VanDerWaalsContact OD1-CG 3.29Å; N379-R381 WeakPolarHBondContact OD1-CG 3.38Å; N379-R381 PolarHBondContact OD1-N 3.24Å
382	A	85.4	Confident	85.4	Confident	2 Å²	2	40.6 Å²	40.6	2%	0.017	21%	0.212	C	C	.	.			trans	-98.5	122.7	173.2	0	0	0	0	0	109.6	L208 G227 A336 T380	L208-A382 WeakPolarHBondContact O-CA 3.44Å; G227-A382 PolarHBondContact N-O 3.3Å; A336-A382 HydrophobicContact CB-CB 3.72Å; T380-A382 VanDerWaalsContact C-N 3.27Å; T380-A382 PolarHBondContact O-N 3.11Å
383	V	90.5	Very high	85.2	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.012	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	145.7	-177.6	-62.3	0	0	0	0	110.5	A192 T195 V196 L208 I209 K210 L224 G227	A192-V383 HydrophobicContact CB-CG2 4.1Å; T195-V383 HydrophobicContact CG2-CG1 3.68Å; V196-V383 HydrophobicContact CG2-CG1 4.4Å; V196-V383 HydrophobicContact CG2-CG2 3.66Å; L208-V383 PolarHBondContact O-N 3.36Å; I209-V383 WeakPolarHBondContact CA-O 3.48Å; I209-V383 HydrophobicContact CB-CG2 4.31Å; I209-V383 HydrophobicContact CG1-CG2 3.84Å; I209-V383 HydrophobicContact CG2-CG2 4.19Å; K210-V383 PolarHBondContact N-O 3.47Å; L224-V383 HydrophobicContact CD1-CB 4.19Å; G227-V383 CarbonylContact O-C 3.47Å
384	T	91.5	Very high	85	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.006	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	123.6	173.8	-54.6	0	0	0	0	109.9	K210 E212 I225 G227 V228 V229	K210-T384 HydrophobicContact CB-CG2 4.06Å; K210-T384 HydrophobicContact CD-CG2 4.4Å; K210-T384 HydrophobicContact CG-CG2 4.25Å; K210-T384 CarbonylContact O-C 3.56Å; K210-T384 WeakPolarHBondContact O-CA 3.42Å; E212-T384 HydrophobicContact CB-CG2 4.09Å; I225-T384 PolarHBondContact N-O 3.03Å; I225-T384 PolarHBondContact O-N 2.99Å; G227-T384 WeakPolarHBondContact O-CB 3.31Å; G227-T384 PolarHBondContact O-N 3.49Å; G227-T384 VanDerWaalsContact O-N 3.17Å; G227-T384 PolarHBondContact O-OG1 2.76Å; V228-T384 WeakPolarHBondContact CA-OG1 3.43Å; V229-T384 HydrophobicContact CB-CG2 3.85Å; V229-T384 HydrophobicContact CG2-CG2 3.76Å; V229-T384 PolarHBondContact N-OG1 3.36Å
385	I	93.1	Very high	85	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	115.3	168.9	-56.8	175.2	0	0	0	107.1	I188 A192 I209 K210 V211 E212 T222 L224 I387 L402 L406	I188-I385 HydrophobicContact CG2-CD1 4.21Å; I188-I385 HydrophobicContact CG2-CG1 4.11Å; I188-I385 HydrophobicContact CG2-CG2 3.82Å; A192-I385 HydrophobicContact CB-CD1 3.98Å; A192-I385 HydrophobicContact CB-CG1 4.27Å; I209-I385 HydrophobicContact CG2-CD1 4.24Å; K210-I385 PolarHBondContact O-N 3.33Å; V211-I385 HydrophobicContact CG2-CD1 4.48Å; E212-I385 PolarHBondContact N-O 3.46Å; T222-I385 HydrophobicContact CG2-CG2 4.4Å; L224-I385 HydrophobicContact CD1-CG1 3.92Å; I385-I387 HydrophobicContact CG2-CG1 4.16Å; I385-L402 HydrophobicContact CG2-CD1 3.93Å; I385-L406 HydrophobicContact CD1-CD1 4.05Å; I385-L406 HydrophobicContact CD1-CD2 4.2Å
386	F	91.8	Very high	85	Confident	1 Å²	1	48.5 Å²	48.5	0%	0.004	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	106.6	-178.4	-179.4	-120.1	0	0	0	110.8	E212 K214 T222 Q223 I225 F364 M371 R388	E212-F386 HydrophobicContact CB-CD2 4.45Å; E212-F386 CarbonylContact O-C 3.58Å; E212-F386 WeakPolarHBondContact O-CA 3.36Å; K214-F386 HydrophobicContact CB-CE2 3.93Å; K214-F386 HydrophobicContact CB-CZ 4.05Å; K214-F386 HydrophobicContact CG-CE2 4.28Å; T222-F386 WeakPolarHBondContact CA-O 3.39Å; T222-F386 WeakPolarHBondContact CG2-O 3.48Å; Q223-F386 HydrophobicContact CG-CB 4.25Å; Q223-F386 HydrophobicContact CG-CD1 4.13Å; Q223-F386 PolarHBondContact N-O 2.88Å; Q223-F386 VanDerWaalsContact N-O 3.07Å; Q223-F386 PolarHBondContact O-N 3.48Å; I225-F386 HydrophobicContact CD1-CB 3.82Å; I225-F386 HydrophobicContact CD1-CG 4.39Å; F364-F386 HydrophobicContact CD1-CE1 4.49Å; F364-F386 HydrophobicContact CD2-CE1 4.04Å; F364-F386 AromaticContact CD2-CZ 3.93Å; F364-F386 HydrophobicContact CD2-CZ 3.93Å; F364-F386 HydrophobicContact CE1-CE1 4.13Å; F364-F386 AromaticContact CE2-CE1 3.65Å; F364-F386 HydrophobicContact CE2-CE1 3.65Å; F364-F386 AromaticContact CE2-CZ 3.83Å; F364-F386 HydrophobicContact CE2-CZ 3.83Å; F364-F386 HydrophobicContact CG-CE1 4.43Å; F364-F386 HydrophobicContact CZ-CD1 4.4Å; F364-F386 AromaticContact CZ-CE1 3.69Å; F364-F386 HydrophobicContact CZ-CE1 3.69Å; F364-F386 HydrophobicContact CZ-CZ 4.34Å; M371-F386 HydrophobicContact CE-CE2 4.16Å; M371-F386 HydrophobicContact SD-CD2 4.35Å; M371-F386 HydrophobicContact SD-CE2 3.35Å; M371-F386 WeakPolarHBondContact SD-CE2 3.41Å; M371-F386 HydrophobicContact SD-CZ 3.65Å; F386-R388 HydrophobicContact CD1-CG 4.36Å; F386-R388 VanDerWaalsContact CE1-CD 3.48Å; F386-R388 HydrophobicContact CE1-CG 4.02Å
387	I	91.1	Very high	85.2	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	138.2	-175.5	-54.3	171.1	0	0	0	110.4	V211 E212 G213 K214 T222 I385 A398 K399 L402	V211-I387 HydrophobicContact CG1-CD1 3.43Å; V211-I387 VanDerWaalsContact CG1-CD1 3.43Å; V211-I387 HydrophobicContact CG1-CG1 4.21Å; E212-I387 PolarHBondContact O-N 3.2Å; G213-I387 WeakPolarHBondContact CA-O 3.43Å; K214-I387 PolarHBondContact N-O 3.14Å; T222-I387 HydrophobicContact CG2-CB 4.4Å; T222-I387 HydrophobicContact CG2-CG1 4.08Å; I385-I387 HydrophobicContact CG2-CG1 4.16Å; I387-A398 HydrophobicContact CG2-CB 3.91Å; I387-K399 HydrophobicContact CD1-CB 4.27Å; I387-K399 HydrophobicContact CD1-CG 3.65Å; I387-L402 HydrophobicContact CD1-CD1 3.39Å; I387-L402 HydrophobicContact CG1-CD1 3.7Å
388	R	87.6	Confident	85.6	Confident	11 Å²	11	41.4 Å²	41.4	4%	0.042	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	149.7	174.7	-63.2	-58.7	-66.6	-90	6	110.9	K214 G216 K218 L219 D221 T222 F364 F386	K214-R388 PolarHBondContact O-NE 2.94Å; G216-R388 VanDerWaalsContact C-NH2 3.33Å; G216-R388 VanDerWaalsContact O-CZ 3.3Å; G216-R388 PolarHBondContact O-NE 2.81Å; G216-R388 PolarHBondContact O-NH2 2.76Å; G216-R388 VanDerWaalsContact O-NH2 3.13Å; K218-R388 VanDerWaalsContact O-CB 3.3Å; K218-R388 WeakPolarHBondContact O-CB 2.87Å; L219-R388 WeakPolarHBondContact CA-O 3.29Å; L219-R388 VanDerWaalsContact CD2-O 3.3Å; L219-R388 WeakPolarHBondContact CD2-O 3.4Å; D221-R388 HydrophobicContact CB-CB 4.16Å; D221-R388 HydrophobicContact CB-CG 4.19Å; T222-R388 PolarHBondContact OG1-N 3.15Å; F364-R388 VanDerWaalsContact CG-NH1 3.25Å; F386-R388 HydrophobicContact CD1-CG 4.36Å; F386-R388 VanDerWaalsContact CE1-CD 3.48Å; F386-R388 HydrophobicContact CE1-CG 4.02Å
389	G	87.4	Confident	86.5	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.2	149.3	179.6	0	0	0	0	0	112.3	G216 N391	G216-G389 PolarHBondContact N-O 3.37Å; G389-N391 PolarHBondContact O-N 3.13Å
390	G	85.4	Confident	87.1	Confident	60 Å²	60	35.3 Å²	35.3	62%	0.619	18%	0.183	S	C	*	.	S	Bend	trans	-69.4	-21.6	-178.7	0	0	0	0	0	114
391	N	86.3	Confident	87.9	Confident	72 Å²	72	31.3 Å²	31.3	39%	0.385	16%	0.159	S	C	.	.	S	Bend	trans	-138.9	146.7	-178.9	-167.5	-8	0	0	0	110.4	G389 M393 I394 I395	G389-N391 PolarHBondContact O-N 3.13Å; N391-M393 VanDerWaalsContact C-N 3.28Å; N391-M393 VanDerWaalsContact ND2-CE 3.27Å; N391-M393 WeakPolarHBondContact ND2-CE 3.39Å; N391-M393 PolarHBondContact O-N 3.4Å; N391-I394 HydrophobicContact CB-CD1 4.25Å; N391-I394 HydrophobicContact CB-CG1 4.36Å; N391-I394 PolarHBondContact O-N 3.24Å; N391-I394 VanDerWaalsContact O-N 3.16Å; N391-I395 WeakPolarHBondContact O-CG1 3.19Å; N391-I395 PolarHBondContact O-N 2.7Å
392	K	86.6	Confident	88.5	Confident	106 Å²	106	26.9 Å²	26.9	46%	0.461	14%	0.142	S	C	.	.	H	α-helix	trans	-54	-43.3	176.4	-172.1	-170.9	175.3	-158.2	0	111.6	E67 V215 I394 I395 E396	E67-K392 IonicContact OE1-NZ 3.95Å; E67-K392 PolarHBondContact OE1-NZ 2.78Å; V215-K392 HydrophobicContact CG2-CB 4.31Å; K392-I394 VanDerWaalsContact C-N 3.31Å; K392-I394 PolarHBondContact O-N 3.47Å; K392-I395 WeakPolarHBondContact O-CB 3.47Å; K392-I395 PolarHBondContact O-N 2.78Å; K392-E396 HydrophobicContact CG-CG 4.43Å; K392-E396 PolarHBondContact O-N 2.9Å
393	M	85.2	Confident	88.7	Confident	76 Å²	76	30.2 Å²	30.2	37%	0.374	16%	0.157	S	C	.	.	H	α-helix	trans	-57.2	-43	179.1	-68	-172.6	-76.7	0	0	112.5	V70 N391 I395 E397	V70-M393 HydrophobicContact CG2-SD 4.35Å; N391-M393 VanDerWaalsContact C-N 3.28Å; N391-M393 VanDerWaalsContact ND2-CE 3.27Å; N391-M393 WeakPolarHBondContact ND2-CE 3.39Å; N391-M393 PolarHBondContact O-N 3.4Å; M393-I395 VanDerWaalsContact C-N 3.3Å; M393-I395 PolarHBondContact O-N 2.9Å; M393-E397 WeakPolarHBondContact O-CB 3.22Å; M393-E397 PolarHBondContact O-N 2.99Å
394	I	87.1	Confident	88.7	Confident	63 Å²	63	30.5 Å²	30.5	32%	0.323	16%	0.158	S	C	.	.	H	α-helix	trans	-67.5	-34.9	179.4	-64.1	174.6	0	0	0	110.8	L219 N391 K392 A398	L219-I394 HydrophobicContact CD1-CG2 3.6Å; L219-I394 HydrophobicContact CD2-CG2 3.96Å; L219-I394 HydrophobicContact CG-CG2 3.97Å; N391-I394 HydrophobicContact CB-CD1 4.25Å; N391-I394 HydrophobicContact CB-CG1 4.36Å; N391-I394 PolarHBondContact O-N 3.24Å; N391-I394 VanDerWaalsContact O-N 3.16Å; K392-I394 VanDerWaalsContact C-N 3.31Å; K392-I394 PolarHBondContact O-N 3.47Å; I394-A398 WeakPolarHBondContact O-CB 3.31Å; I394-A398 PolarHBondContact O-N 3.41Å
395	I	89.2	Confident	88.7	Confident	3 Å²	3	30.4 Å²	30.4	2%	0.015	16%	0.158	C	C	.	.	H	α-helix	trans	-71	-46	-179.7	-64.6	166.9	0	0	0	110.7	K214 V215 N391 K392 M393 E397 A398 K399	K214-I395 VanDerWaalsContact C-CD1 3.47Å; K214-I395 WeakPolarHBondContact O-CD1 3.37Å; V215-I395 HydrophobicContact CB-CD1 4.12Å; V215-I395 HydrophobicContact CG2-CD1 3.66Å; N391-I395 WeakPolarHBondContact O-CG1 3.19Å; N391-I395 PolarHBondContact O-N 2.7Å; K392-I395 WeakPolarHBondContact O-CB 3.47Å; K392-I395 PolarHBondContact O-N 2.78Å; M393-I395 VanDerWaalsContact C-N 3.3Å; M393-I395 PolarHBondContact O-N 2.9Å; I395-E397 VanDerWaalsContact C-N 3.32Å; I395-A398 PolarHBondContact O-N 3.32Å; I395-K399 WeakPolarHBondContact O-CG 3.42Å; I395-K399 PolarHBondContact O-N 2.99Å
396	E	87.4	Confident	88.7	Confident	65 Å²	65	30.6 Å²	30.6	30%	0.304	16%	0.159	S	C	.	.	H	α-helix	trans	-63.9	-40.8	177.4	-65.2	-52.8	127.8	0	0	111.1	K392 A398 K399 R400	K392-E396 HydrophobicContact CG-CG 4.43Å; K392-E396 PolarHBondContact O-N 2.9Å; E396-A398 VanDerWaalsContact C-N 3.33Å; E396-A398 PolarHBondContact O-N 3.17Å; E396-K399 PolarHBondContact O-N 3.49Å; E396-K399 IonicContact OE1-NZ 3.74Å; E396-K399 PolarHBondContact OE1-NZ 3Å; E396-K399 IonicContact OE2-NZ 3.62Å; E396-R400 WeakPolarHBondContact O-CG 3.39Å; E396-R400 PolarHBondContact O-N 3.13Å; E396-R400 VanDerWaalsContact O-N 3.09Å
397	E	86.1	Confident	88.7	Confident	3 Å²	3	30.6 Å²	30.6	1%	0.014	16%	0.159	C	C	.	.	H	α-helix	trans	-65.2	-37.4	172.7	-173.6	59.8	-166.1	0	0	112.1	T71 V177 M393 I395 R400 A401	T71-E397 WeakPolarHBondContact CA-OE2 3.38Å; T71-E397 WeakPolarHBondContact CB-OE2 3.48Å; T71-E397 PolarHBondContact OG1-OE2 3.09Å; V177-E397 HydrophobicContact CB-CG 4.12Å; V177-E397 HydrophobicContact CG2-CG 3.78Å; M393-E397 WeakPolarHBondContact O-CB 3.22Å; M393-E397 PolarHBondContact O-N 2.99Å; I395-E397 VanDerWaalsContact C-N 3.32Å; E397-R400 PolarHBondContact O-N 3.11Å; E397-R400 IonicContact OE2-NH1 2.7Å; E397-A401 WeakPolarHBondContact O-CB 3.07Å; E397-A401 PolarHBondContact O-N 3.16Å
398	A	89.3	Confident	88.7	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.008	16%	0.16	C	C	.	.	H	α-helix	trans	-68.8	-35.9	177.1	0	0	0	0	0	112.8	I178 L219 I387 I394 I395 E396 L402	I178-A398 HydrophobicContact CD1-CB 3.88Å; I178-A398 HydrophobicContact CG1-CB 4.16Å; L219-A398 HydrophobicContact CD2-CB 4.02Å; I387-A398 HydrophobicContact CG2-CB 3.91Å; I394-A398 WeakPolarHBondContact O-CB 3.31Å; I394-A398 PolarHBondContact O-N 3.41Å; I395-A398 PolarHBondContact O-N 3.32Å; E396-A398 VanDerWaalsContact C-N 3.33Å; E396-A398 PolarHBondContact O-N 3.17Å; A398-L402 WeakPolarHBondContact O-CB 3.33Å; A398-L402 PolarHBondContact O-N 3.24Å
399	K	90	Very high	88.9	Confident	45 Å²	45	30.1 Å²	30.1	20%	0.196	16%	0.158	C	C	.	.	H	α-helix	trans	-60.1	-47.7	172.3	-75.6	176.2	-178.7	169.1	0	110.7	V211 I387 I395 E396 L402 H403	V211-K399 HydrophobicContact CG1-CB 4.36Å; V211-K399 HydrophobicContact CG1-CG 3.93Å; I387-K399 HydrophobicContact CD1-CB 4.27Å; I387-K399 HydrophobicContact CD1-CG 3.65Å; I395-K399 WeakPolarHBondContact O-CG 3.42Å; I395-K399 PolarHBondContact O-N 2.99Å; E396-K399 PolarHBondContact O-N 3.49Å; E396-K399 IonicContact OE1-NZ 3.74Å; E396-K399 PolarHBondContact OE1-NZ 3Å; E396-K399 IonicContact OE2-NZ 3.62Å; K399-L402 PolarHBondContact O-N 3.17Å; K399-H403 WeakPolarHBondContact O-CB 3.38Å; K399-H403 PolarHBondContact O-N 3.46Å
400	R	87.9	Confident	89.1	Confident	54 Å²	54	31.2 Å²	31.2	20%	0.204	16%	0.161	C	C	.	.	H	α-helix	trans	-61.8	-49.7	176.8	-68.4	174.5	-170.6	153.2	0.4	111.5	T71 E396 E397 L402 H403 D404	T71-R400 PolarHBondContact OG1-NH1 3.41Å; E396-R400 WeakPolarHBondContact O-CG 3.39Å; E396-R400 PolarHBondContact O-N 3.13Å; E396-R400 VanDerWaalsContact O-N 3.09Å; E397-R400 PolarHBondContact O-N 3.11Å; E397-R400 IonicContact OE2-NH1 2.7Å; R400-L402 VanDerWaalsContact C-N 3.27Å; R400-L402 PolarHBondContact O-N 2.84Å; R400-H403 WeakPolarHBondContact O-CB 3.29Å; R400-H403 PolarHBondContact O-N 3.44Å; R400-D404 PolarHBondContact O-N 3.26Å; R400-D404 VanDerWaalsContact O-OD1 3.11Å
401	A	88.8	Confident	89.3	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-56.9	-40.7	177.8	0	0	0	0	0	113	L173 K176 I178 E397 A405	L173-A401 HydrophobicContact CD2-CB 4.01Å; L173-A401 VanDerWaalsContact CD2-O 3.24Å; L173-A401 WeakPolarHBondContact CD2-O 3.39Å; K176-A401 HydrophobicContact CB-CB 4.18Å; K176-A401 HydrophobicContact CD-CB 3.41Å; K176-A401 VanDerWaalsContact CD-CB 3.41Å; K176-A401 HydrophobicContact CG-CB 4.41Å; I178-A401 HydrophobicContact CD1-CB 3.48Å; I178-A401 VanDerWaalsContact CD1-CB 3.48Å; I178-A401 HydrophobicContact CG1-CB 4.01Å; E397-A401 WeakPolarHBondContact O-CB 3.07Å; E397-A401 PolarHBondContact O-N 3.16Å; A401-A405 PolarHBondContact O-N 3.38Å
402	L	90.8	Very high	89.4	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-70	-37.8	174.5	-84.3	168.3	0	0	0	112.6	M185 A189 I385 I387 A398 K399 R400 D404 A405 L406	M185-L402 HydrophobicContact CB-CD2 4.04Å; M185-L402 HydrophobicContact SD-CD1 4.01Å; M185-L402 HydrophobicContact SD-CD2 4.3Å; M185-L402 HydrophobicContact SD-CG 4.44Å; A189-L402 HydrophobicContact CB-CD2 4.27Å; I385-L402 HydrophobicContact CG2-CD1 3.93Å; I387-L402 HydrophobicContact CD1-CD1 3.39Å; I387-L402 HydrophobicContact CG1-CD1 3.7Å; A398-L402 WeakPolarHBondContact O-CB 3.33Å; A398-L402 PolarHBondContact O-N 3.24Å; K399-L402 PolarHBondContact O-N 3.17Å; R400-L402 VanDerWaalsContact C-N 3.27Å; R400-L402 PolarHBondContact O-N 2.84Å; L402-D404 VanDerWaalsContact C-N 3.33Å; L402-D404 PolarHBondContact O-N 3.23Å; L402-A405 PolarHBondContact O-N 3.13Å; L402-L406 WeakPolarHBondContact O-CB 3.24Å; L402-L406 WeakPolarHBondContact O-CG 3.42Å; L402-L406 PolarHBondContact O-N 3.45Å
403	H	90.5	Very high	89.5	Confident	72 Å²	72	20.5 Å²	20.5	33%	0.333	10%	0.096	S	C	.	.	H	α-helix	trans	-56.4	-49	174.7	-175.8	67.2	0	0	0	111.1	K399 R400 A405 L406 C407	K399-H403 WeakPolarHBondContact O-CB 3.38Å; K399-H403 PolarHBondContact O-N 3.46Å; R400-H403 WeakPolarHBondContact O-CB 3.29Å; R400-H403 PolarHBondContact O-N 3.44Å; H403-A405 VanDerWaalsContact C-N 3.33Å; H403-A405 PolarHBondContact O-N 3.4Å; H403-L406 WeakPolarHBondContact O-CB 3.19Å; H403-L406 PolarHBondContact O-N 3.38Å; H403-L406 VanDerWaalsContact O-N 3.11Å; H403-C407 PolarHBondContact O-N 3.12Å; H403-C407 PolarHBondContact O-SG 3.14Å
404	D	90.3	Very high	89.6	Confident	7 Å²	7	21.5 Å²	21.5	4%	0.037	10%	0.095	C	C	.	.	H	α-helix	trans	-63.4	-40.5	179.7	-60.3	9	0	0	0	111.6	G103 T172 K176 R400 L402 L406 C407 V408	G103-D404 VanDerWaalsContact O-CA 3.26Å; G103-D404 WeakPolarHBondContact O-CA 3.39Å; G103-D404 WeakPolarHBondContact O-CB 3.36Å; G103-D404 VanDerWaalsContact O-CG 3.27Å; T172-D404 HydrophobicContact CG2-CB 4.02Å; K176-D404 WeakPolarHBondContact CE-OD2 3.42Å; K176-D404 IonicContact NZ-OD2 3.26Å; K176-D404 PolarHBondContact NZ-OD2 2.87Å; R400-D404 PolarHBondContact O-N 3.26Å; R400-D404 VanDerWaalsContact O-OD1 3.11Å; L402-D404 VanDerWaalsContact C-N 3.33Å; L402-D404 PolarHBondContact O-N 3.23Å; D404-L406 VanDerWaalsContact C-N 3.34Å; D404-L406 PolarHBondContact O-N 2.99Å; D404-C407 PolarHBondContact O-N 3.4Å; D404-V408 WeakPolarHBondContact O-CG2 3.28Å; D404-V408 PolarHBondContact O-N 3.2Å
405	A	91.4	Very high	89.6	Confident	0 Å²	0	20 Å²	20	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62.5	-41.3	174.9	0	0	0	0	0	111.9	L173 A189 A401 L402 H403 V408 I409	L173-A405 HydrophobicContact CD1-CB 4.18Å; L173-A405 HydrophobicContact CD2-CB 3.99Å; L173-A405 HydrophobicContact CG-CB 3.96Å; A189-A405 HydrophobicContact CB-CB 4.3Å; A401-A405 PolarHBondContact O-N 3.38Å; L402-A405 PolarHBondContact O-N 3.13Å; H403-A405 VanDerWaalsContact C-N 3.33Å; H403-A405 PolarHBondContact O-N 3.4Å; A405-V408 PolarHBondContact O-N 3.23Å; A405-I409 VanDerWaalsContact O-CD1 3.29Å; A405-I409 WeakPolarHBondContact O-CD1 3.44Å; A405-I409 VanDerWaalsContact O-CG1 3.23Å; A405-I409 WeakPolarHBondContact O-CG1 3.1Å; A405-I409 PolarHBondContact O-N 3.43Å
406	L	92.8	Very high	89.5	Confident	3 Å²	3	22.2 Å²	22.2	2%	0.016	10%	0.1	C	C	.	.	H	α-helix	trans	-62.2	-44.4	174	-69	169	0	0	0	110.7	A189 A192 I193 F206 I209 V211 I385 L402 H403 D404 V408 I409 R410	A189-L406 HydrophobicContact CB-CD2 4.01Å; A189-L406 HydrophobicContact CB-CG 4.45Å; A192-L406 HydrophobicContact CB-CD2 4.26Å; I193-L406 HydrophobicContact CD1-CB 4.05Å; I193-L406 HydrophobicContact CD1-CD2 3.91Å; I193-L406 WeakPolarHBondContact CD1-O 3.26Å; I193-L406 HydrophobicContact CG1-CD2 3.56Å; F206-L406 HydrophobicContact CE1-CB 3.96Å; F206-L406 HydrophobicContact CZ-CB 4.46Å; I209-L406 HydrophobicContact CD1-CD2 4.39Å; I209-L406 HydrophobicContact CG2-CD1 4.06Å; V211-L406 HydrophobicContact CG2-CD1 4.26Å; I385-L406 HydrophobicContact CD1-CD1 4.05Å; I385-L406 HydrophobicContact CD1-CD2 4.2Å; L402-L406 WeakPolarHBondContact O-CB 3.24Å; L402-L406 WeakPolarHBondContact O-CG 3.42Å; L402-L406 PolarHBondContact O-N 3.45Å; H403-L406 WeakPolarHBondContact O-CB 3.19Å; H403-L406 PolarHBondContact O-N 3.38Å; H403-L406 VanDerWaalsContact O-N 3.11Å; D404-L406 VanDerWaalsContact C-N 3.34Å; D404-L406 PolarHBondContact O-N 2.99Å; L406-V408 PolarHBondContact O-N 2.98Å; L406-I409 PolarHBondContact O-N 2.95Å; L406-R410 WeakPolarHBondContact O-CB 3.33Å; L406-R410 PolarHBondContact O-N 3.21Å
407	C	91.9	Very high	89.6	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.007	10%	0.099	C	C	.	.	H	α-helix	trans	-60.5	-43.3	176.9	-68.9	0	0	0	0	112.9	I102 F206 H403 D404 R410 N411	I102-C407 VanDerWaalsContact O-CB 3.25Å; I102-C407 WeakPolarHBondContact O-CB 3.29Å; F206-C407 VanDerWaalsContact CE2-SG 3.57Å; F206-C407 HydrophobicContact CZ-CB 4.38Å; F206-C407 VanDerWaalsContact CZ-SG 3.56Å; H403-C407 PolarHBondContact O-N 3.12Å; H403-C407 PolarHBondContact O-SG 3.14Å; D404-C407 PolarHBondContact O-N 3.4Å; C407-R410 WeakPolarHBondContact O-CB 3.35Å; C407-R410 PolarHBondContact O-N 2.68Å; C407-N411 PolarHBondContact O-N 2.92Å; C407-N411 PolarHBondContact O-ND2 3.46Å; C407-N411 VanDerWaalsContact O-ND2 3.16Å; C407-N411 PolarHBondContact O-OD1 3.26Å
408	V	91.3	Very high	89.9	Confident	2 Å²	2	22.7 Å²	22.7	1%	0.012	10%	0.098	C	C	.	.	H	α-helix	trans	-63.9	-43	176.1	170.9	0	0	0	0	112	D104 T168 T172 D404 A405 L406 N411 L412 T509	D104-V408 HydrophobicContact CB-CG2 3.59Å; T168-V408 HydrophobicContact CG2-CG1 3.72Å; T172-V408 HydrophobicContact CG2-CG2 4.08Å; D404-V408 WeakPolarHBondContact O-CG2 3.28Å; D404-V408 PolarHBondContact O-N 3.2Å; A405-V408 PolarHBondContact O-N 3.23Å; L406-V408 PolarHBondContact O-N 2.98Å; V408-N411 WeakPolarHBondContact O-CB 3.18Å; V408-N411 PolarHBondContact O-N 3.4Å; V408-L412 PolarHBondContact O-N 3.5Å; V408-L412 VanDerWaalsContact O-N 3.15Å; V408-T509 HydrophobicContact CG1-CG2 3.91Å
409	I	90.8	Very high	90	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-68	-38.9	177.7	-62.5	157.1	0	0	0	110.8	A169 A189 V190 I193 A405 L406 N411 L412 V413	A169-I409 HydrophobicContact CB-CD1 3.87Å; A169-I409 HydrophobicContact CB-CG1 4.1Å; A189-I409 HydrophobicContact CB-CD1 3.69Å; V190-I409 HydrophobicContact CB-CD1 4.3Å; V190-I409 HydrophobicContact CG2-CD1 3.48Å; V190-I409 VanDerWaalsContact CG2-CD1 3.48Å; V190-I409 HydrophobicContact CG2-CG1 4.05Å; I193-I409 HydrophobicContact CB-CG2 3.9Å; I193-I409 HydrophobicContact CD1-CB 3.88Å; I193-I409 HydrophobicContact CD1-CG2 3.98Å; I193-I409 HydrophobicContact CG1-CG2 4.27Å; I193-I409 HydrophobicContact CG2-CG2 3.89Å; A405-I409 VanDerWaalsContact O-CD1 3.29Å; A405-I409 WeakPolarHBondContact O-CD1 3.44Å; A405-I409 VanDerWaalsContact O-CG1 3.23Å; A405-I409 WeakPolarHBondContact O-CG1 3.1Å; A405-I409 PolarHBondContact O-N 3.43Å; L406-I409 PolarHBondContact O-N 2.95Å; I409-N411 VanDerWaalsContact C-N 3.26Å; I409-N411 PolarHBondContact O-N 3.3Å; I409-L412 WeakPolarHBondContact O-CB 3.37Å; I409-L412 PolarHBondContact O-N 2.97Å; I409-L412 VanDerWaalsContact O-N 3.15Å; I409-V413 WeakPolarHBondContact O-CG2 3.47Å; I409-V413 PolarHBondContact O-N 3.35Å; I409-V413 VanDerWaalsContact O-N 3.08Å
410	R	90.9	Very high	90.1	Very high	22 Å²	22	21.2 Å²	21.2	8%	0.083	9%	0.092	C	C	.	.	H	α-helix	trans	-55.6	-44	171.7	169.5	-172	72.9	173.2	-0.5	111	E101 I193 V204 F206 L406 C407 L412 V413 R414	E101-R410 PolarHBondContact O-NH2 3.04Å; I193-R410 HydrophobicContact CD1-CB 4.2Å; V204-R410 HydrophobicContact CB-CB 4.32Å; V204-R410 HydrophobicContact CB-CG 4Å; V204-R410 HydrophobicContact CG2-CB 4.31Å; V204-R410 HydrophobicContact CG2-CG 4.18Å; F206-R410 HydrophobicContact CE1-CB 4.46Å; F206-R410 HydrophobicContact CZ-CB 3.97Å; F206-R410 HydrophobicContact CZ-CG 4.35Å; L406-R410 WeakPolarHBondContact O-CB 3.33Å; L406-R410 PolarHBondContact O-N 3.21Å; C407-R410 WeakPolarHBondContact O-CB 3.35Å; C407-R410 PolarHBondContact O-N 2.68Å; R410-L412 VanDerWaalsContact C-N 3.28Å; R410-L412 PolarHBondContact O-N 2.96Å; R410-V413 WeakPolarHBondContact O-CB 3.29Å; R410-V413 PolarHBondContact O-N 3.21Å; R410-R414 PolarHBondContact O-N 2.91Å; R410-R414 VanDerWaalsContact O-N 3.08Å
411	N	90.4	Very high	90.2	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-62.9	-37.2	180	-65.3	-20.1	0	0	0	111.6	I102 C407 V408 I409 R414 D415 T509 I511	I102-N411 WeakPolarHBondContact CG2-ND2 3.46Å; I102-N411 PolarHBondContact O-ND2 2.69Å; C407-N411 PolarHBondContact O-N 2.92Å; C407-N411 PolarHBondContact O-ND2 3.46Å; C407-N411 VanDerWaalsContact O-ND2 3.16Å; C407-N411 PolarHBondContact O-OD1 3.26Å; V408-N411 WeakPolarHBondContact O-CB 3.18Å; V408-N411 PolarHBondContact O-N 3.4Å; I409-N411 VanDerWaalsContact C-N 3.26Å; I409-N411 PolarHBondContact O-N 3.3Å; N411-R414 PolarHBondContact O-N 3.27Å; N411-D415 PolarHBondContact O-N 3.1Å; N411-D415 VanDerWaalsContact O-O 3.13Å; N411-T509 HydrophobicContact CB-CG2 3.99Å; N411-I511 HydrophobicContact CB-CG2 3.73Å
412	L	88.5	Confident	90.1	Very high	4 Å²	4	19.2 Å²	19.2	2%	0.021	9%	0.088	C	C	.	.	H	α-helix	trans	-66.6	-35.8	174	-67.3	173.2	0	0	0	113.3	C157 L165 T168 V408 I409 R410 R414 D415 N416 V418 T509	C157-L412 PolarHBondContact SG-O 3.27Å; C157-L412 VanDerWaalsContact SG-O 3.38Å; L165-L412 HydrophobicContact CD2-CB 3.94Å; L165-L412 HydrophobicContact CD2-CD1 3.53Å; L165-L412 HydrophobicContact CD2-CG 4.36Å; T168-L412 HydrophobicContact CG2-CD1 3.92Å; V408-L412 PolarHBondContact O-N 3.5Å; V408-L412 VanDerWaalsContact O-N 3.15Å; I409-L412 WeakPolarHBondContact O-CB 3.37Å; I409-L412 PolarHBondContact O-N 2.97Å; I409-L412 VanDerWaalsContact O-N 3.15Å; R410-L412 VanDerWaalsContact C-N 3.28Å; R410-L412 PolarHBondContact O-N 2.96Å; L412-R414 VanDerWaalsContact C-N 3.33Å; L412-D415 WeakPolarHBondContact CA-O 2.96Å; L412-D415 CarbonylContact O-C 3.51Å; L412-D415 VanDerWaalsContact O-C 3.29Å; L412-N416 WeakPolarHBondContact O-CA 3.38Å; L412-N416 PolarHBondContact O-N 3.43Å; L412-V418 HydrophobicContact CD2-CG1 3.48Å; L412-V418 VanDerWaalsContact CD2-CG1 3.48Å; L412-T509 HydrophobicContact CD2-CG2 3.73Å; L412-T509 HydrophobicContact CG-CG2 3.83Å
413	V	87.9	Confident	90.1	Very high	9 Å²	9	19.2 Å²	19.2	6%	0.055	9%	0.089	C	C	.	.	H	α-helix	trans	-64.5	-40	174.7	174.1	0	0	0	0	110.8	I193 A197 V204 I409 R410	I193-V413 HydrophobicContact CG2-CG2 4.05Å; A197-V413 HydrophobicContact CB-CG1 4.38Å; V204-V413 HydrophobicContact CG2-CB 4.21Å; V204-V413 HydrophobicContact CG2-CG1 4.11Å; V204-V413 HydrophobicContact CG2-CG2 4.36Å; I409-V413 WeakPolarHBondContact O-CG2 3.47Å; I409-V413 PolarHBondContact O-N 3.35Å; I409-V413 VanDerWaalsContact O-N 3.08Å; R410-V413 WeakPolarHBondContact O-CB 3.29Å; R410-V413 PolarHBondContact O-N 3.21Å
414	R	87.7	Confident	90.2	Very high	97 Å²	97	15.8 Å²	15.8	37%	0.366	7%	0.073	S	C	.	.	H	α-helix	trans	-69.7	-52.7	176.9	-74	176.6	173.7	-177.5	-0.4	112.1	K202 D203 R410 N411 L412	K202-R414 VanDerWaalsContact O-CG 3.24Å; K202-R414 WeakPolarHBondContact O-CG 3.41Å; D203-R414 IonicContact OD1-CZ 3.17Å; D203-R414 IonicContact OD1-NE 2.85Å; D203-R414 PolarHBondContact OD1-NE 3.07Å; D203-R414 IonicContact OD1-NH2 2.73Å; D203-R414 PolarHBondContact OD1-NH2 3.25Å; R410-R414 PolarHBondContact O-N 2.91Å; R410-R414 VanDerWaalsContact O-N 3.08Å; N411-R414 PolarHBondContact O-N 3.27Å; L412-R414 VanDerWaalsContact C-N 3.33Å
415	D	86.9	Confident	90.4	Very high	31 Å²	31	15.8 Å²	15.8	17%	0.166	7%	0.073	C	C	.	.			trans	-132.9	114.9	178.8	-170.9	-4.5	0	0	0	109.9	N411 L412 R417	N411-D415 PolarHBondContact O-N 3.1Å; N411-D415 VanDerWaalsContact O-O 3.13Å; L412-D415 WeakPolarHBondContact CA-O 2.96Å; L412-D415 CarbonylContact O-C 3.51Å; L412-D415 VanDerWaalsContact O-C 3.29Å; D415-R417 PolarHBondContact O-N 3.32Å; D415-R417 VanDerWaalsContact O-N 3.1Å; D415-R417 WeakPolarHBondContact OD1-CB 2.66Å; D415-R417 WeakPolarHBondContact OD1-CG 3.14Å; D415-R417 IonicContact OD1-CZ 3.87Å; D415-R417 PolarHBondContact OD1-N 2.88Å; D415-R417 IonicContact OD1-NE 3.47Å; D415-R417 PolarHBondContact OD1-NE 2.88Å; D415-R417 IonicContact OD1-NH2 3.59Å; D415-R417 IonicContact OD2-CZ 3.72Å; D415-R417 IonicContact OD2-NE 2.83Å; D415-R417 PolarHBondContact OD2-NE 3.37Å; D415-R417 VanDerWaalsContact OD2-NE 3.15Å; D415-R417 IonicContact OD2-NH2 3.61Å; D415-R417 PolarHBondContact OD2-NH2 3.42Å
416	N	87.4	Confident	90.5	Very high	50 Å²	50	16.2 Å²	16.2	27%	0.267	8%	0.075	S	C	.	.			trans	-82.1	15.8	-172.5	65.6	-21.6	0	0	0	113.5	T154 F155 L412	T154-N416 WeakPolarHBondContact CG2-ND2 3.23Å; F155-N416 PolarHBondContact N-O 3.04Å; F155-N416 WeakPolarHBondContact O-CB 3.42Å; L412-N416 WeakPolarHBondContact O-CA 3.38Å; L412-N416 PolarHBondContact O-N 3.43Å
417	R	90.6	Very high	90.6	Very high	77 Å²	77	16.1 Å²	16.1	29%	0.291	8%	0.075	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	132.8	-179.6	-67	-179.4	-65.9	162.6	3	111.3	D149 A152 E153 D415 L510	D149-R417 IonicContact OD1-CZ 2.89Å; D149-R417 IonicContact OD1-NH1 2.73Å; D149-R417 PolarHBondContact OD1-NH1 3.47Å; A152-R417 HydrophobicContact CB-CB 4.29Å; E153-R417 WeakPolarHBondContact O-CA 3.24Å; D415-R417 PolarHBondContact O-N 3.32Å; D415-R417 VanDerWaalsContact O-N 3.1Å; D415-R417 WeakPolarHBondContact OD1-CB 2.66Å; D415-R417 WeakPolarHBondContact OD1-CG 3.14Å; D415-R417 IonicContact OD1-CZ 3.87Å; D415-R417 PolarHBondContact OD1-N 2.88Å; D415-R417 IonicContact OD1-NE 3.47Å; D415-R417 PolarHBondContact OD1-NE 2.88Å; D415-R417 IonicContact OD1-NH2 3.59Å; D415-R417 IonicContact OD2-CZ 3.72Å; D415-R417 IonicContact OD2-NE 2.83Å; D415-R417 PolarHBondContact OD2-NE 3.37Å; D415-R417 VanDerWaalsContact OD2-NE 3.15Å; D415-R417 IonicContact OD2-NH2 3.61Å; D415-R417 PolarHBondContact OD2-NH2 3.42Å; R417-L510 HydrophobicContact CB-CB 4.01Å; R417-L510 HydrophobicContact CB-CD2 3.73Å; R417-L510 HydrophobicContact CG-CD2 4.48Å; R417-L510 VanDerWaalsContact CZ-CD2 3.5Å; R417-L510 WeakPolarHBondContact O-CB 3.44Å; R417-L510 PolarHBondContact O-N 3.21Å; R417-L510 VanDerWaalsContact O-N 3.1Å
418	V	91.4	Very high	90.7	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	155.6	-179.5	-64	0	0	0	0	111.3	A152 E153 F155 L412 I507 E508	A152-V418 CarbonylContact C-O 3.47Å; A152-V418 VanDerWaalsContact CA-O 3.25Å; A152-V418 WeakPolarHBondContact CA-O 3.4Å; E153-V418 HydrophobicContact CB-CG2 4.33Å; E153-V418 PolarHBondContact N-O 3.34Å; E153-V418 WeakPolarHBondContact O-CG2 3.48Å; E153-V418 PolarHBondContact O-N 2.87Å; F155-V418 HydrophobicContact CD1-CG2 4Å; F155-V418 HydrophobicContact CD2-CB 4.3Å; F155-V418 HydrophobicContact CD2-CG1 3.87Å; F155-V418 HydrophobicContact CD2-CG2 3.53Å; F155-V418 HydrophobicContact CE1-CG2 4.03Å; F155-V418 HydrophobicContact CE2-CB 4.49Å; F155-V418 HydrophobicContact CE2-CG1 4.44Å; F155-V418 HydrophobicContact CE2-CG2 3.58Å; F155-V418 HydrophobicContact CG-CG1 4.37Å; F155-V418 HydrophobicContact CG-CG2 3.76Å; F155-V418 HydrophobicContact CZ-CG2 3.82Å; L412-V418 HydrophobicContact CD2-CG1 3.48Å; L412-V418 VanDerWaalsContact CD2-CG1 3.48Å; V418-I507 HydrophobicContact CB-CG2 3.67Å; V418-I507 HydrophobicContact CG1-CG2 3.78Å; V418-I507 HydrophobicContact CG2-CG2 4.15Å; V418-E508 WeakPolarHBondContact CA-O 3.5Å
419	V	92.5	Very high	90.8	Very high	4 Å²	4	16.3 Å²	16.3	2%	0.024	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	156.6	171.4	-68.5	0	0	0	0	109.1	A152 E508 L510 K513	A152-V419 HydrophobicContact CB-CG1 4.1Å; V419-E508 HydrophobicContact CG2-CB 4.43Å; V419-E508 PolarHBondContact N-O 3.46Å; V419-E508 PolarHBondContact O-N 2.93Å; V419-E508 VanDerWaalsContact O-O 3.09Å; V419-L510 HydrophobicContact CG1-CB 4.32Å; V419-L510 HydrophobicContact CG1-CD1 3.65Å; V419-K513 HydrophobicContact CG2-CB 4.27Å; V419-K513 HydrophobicContact CG2-CG 3.82Å
420	Y	91.9	Very high	91	Very high	11 Å²	11	16.3 Å²	16.3	4%	0.043	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	123.7	178.1	-64	-77	0	0	0	110.2	E153 S425 F488 M501 K502 I507	E153-Y420 HydrophobicContact CG-CE2 4.33Å; E153-Y420 PolarHBondContact OE2-OH 2.84Å; Y420-S425 PolarHBondContact O-N 2.95Å; Y420-F488 HydrophobicContact CD2-CB 4.26Å; Y420-F488 AromaticContact CD2-CD1 3.19Å; Y420-F488 HydrophobicContact CD2-CD1 3.19Å; Y420-F488 AromaticContact CD2-CE1 3.5Å; Y420-F488 HydrophobicContact CD2-CE1 3.5Å; Y420-F488 AromaticContact CD2-CG 3.76Å; Y420-F488 HydrophobicContact CD2-CG 3.76Å; Y420-F488 HydrophobicContact CD2-CZ 4.31Å; Y420-F488 AromaticContact CE2-CD1 3.75Å; Y420-F488 HydrophobicContact CE2-CD1 3.75Å; Y420-F488 HydrophobicContact CE2-CD2 4.46Å; Y420-F488 AromaticContact CE2-CE1 3.71Å; Y420-F488 HydrophobicContact CE2-CE1 3.71Å; Y420-F488 HydrophobicContact CE2-CE2 4.45Å; Y420-F488 HydrophobicContact CE2-CG 4.12Å; Y420-F488 HydrophobicContact CE2-CZ 4.08Å; Y420-F488 HydrophobicContact CG-CB 4.49Å; Y420-F488 HydrophobicContact CG-CD1 4.09Å; Y420-F488 HydrophobicContact CG-CG 4.46Å; Y420-M501 HydrophobicContact CD1-CB 4.46Å; Y420-M501 HydrophobicContact CG-CB 4.5Å; Y420-K502 HydrophobicContact CD1-CB 4.1Å; Y420-K502 VanDerWaalsContact CE1-CA 3.47Å; Y420-K502 HydrophobicContact CE1-CB 3.65Å; Y420-K502 HydrophobicContact CE1-CD 4.43Å; Y420-K502 HydrophobicContact CE1-CG 3.81Å; Y420-K502 HydrophobicContact CE2-CB 4.31Å; Y420-K502 HydrophobicContact CE2-CD 4.2Å; Y420-K502 HydrophobicContact CE2-CG 4.42Å; Y420-K502 VanDerWaalsContact OH-CD 3.28Å; Y420-K502 WeakPolarHBondContact OH-CD 3.44Å; Y420-K502 WeakPolarHBondContact OH-CE 3.36Å; Y420-K502 WeakPolarHBondContact OH-CG 3.47Å; Y420-I507 HydrophobicContact CD1-CG1 4.34Å; Y420-I507 HydrophobicContact CE1-CG1 4.16Å
421	G	89.1	Confident	91.2	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-139.9	-174.1	0	0	0	0	0	113.4	G423 A424 M501 V506 E508	G421-G423 PolarHBondContact O-N 3.26Å; G421-A424 VanDerWaalsContact O-CB 3.29Å; G421-A424 WeakPolarHBondContact O-CB 3.41Å; G421-A424 PolarHBondContact O-N 3.18Å; G421-M501 WeakPolarHBondContact O-CG 3.49Å; G421-V506 PolarHBondContact N-O 3Å; G421-V506 VanDerWaalsContact N-O 3.17Å; G421-E508 WeakPolarHBondContact CA-OE2 3.15Å
422	G	87.7	Confident	91.3	Very high	12 Å²	12	17.3 Å²	17.3	12%	0.124	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	26.8	175.1	0	0	0	0	0	113.9	A424 I491	G422-A424 VanDerWaalsContact C-N 3.27Å; G422-A424 PolarHBondContact O-N 3.28Å; G422-I491 PolarHBondContact O-N 2.98Å
423	G	90.3	Very high	91.7	Very high	1 Å²	1	17.1 Å²	17.1	1%	0.01	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.1	-5.6	-176.5	0	0	0	0	0	114.7	G421 E426 I427	G421-G423 PolarHBondContact O-N 3.26Å; G423-E426 VanDerWaalsContact C-OE2 3.27Å; G423-E426 WeakPolarHBondContact CA-OE2 3.5Å; G423-I427 WeakPolarHBondContact O-CD1 3.31Å; G423-I427 WeakPolarHBondContact O-CG1 3.45Å; G423-I427 PolarHBondContact O-N 3.44Å; G423-I427 VanDerWaalsContact O-N 3.13Å
424	A	93.1	Very high	92	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-65.2	-47.1	-178.4	0	0	0	0	0	111.3	G421 G422 E426 I427 A428 Q481 L489 M501	G421-A424 VanDerWaalsContact O-CB 3.29Å; G421-A424 WeakPolarHBondContact O-CB 3.41Å; G421-A424 PolarHBondContact O-N 3.18Å; G422-A424 VanDerWaalsContact C-N 3.27Å; G422-A424 PolarHBondContact O-N 3.28Å; A424-E426 VanDerWaalsContact C-N 3.31Å; A424-E426 PolarHBondContact O-N 3.08Å; A424-I427 PolarHBondContact O-N 3.37Å; A424-A428 WeakPolarHBondContact O-CB 3.41Å; A424-A428 PolarHBondContact O-N 2.93Å; A424-Q481 PolarHBondContact O-NE2 2.74Å; A424-Q481 VanDerWaalsContact O-NE2 3.12Å; A424-L489 WeakPolarHBondContact CA-O 3.48Å; A424-L489 WeakPolarHBondContact CB-O 3.48Å; A424-M501 HydrophobicContact CB-CG 3.95Å
425	S	93.2	Very high	92.2	Very high	7 Å²	7	19.1 Å²	19.1	5%	0.049	10%	0.099	C	C	.	.	H	α-helix	trans	-61.1	-38.3	179.2	73.1	0	0	0	0	112.8	Y420 C429	Y420-S425 PolarHBondContact O-N 2.95Å; S425-C429 WeakPolarHBondContact O-CB 3.19Å; S425-C429 PolarHBondContact O-N 3.46Å; S425-C429 PolarHBondContact O-SG 2.94Å
426	E	94.8	Very high	92.5	Very high	9 Å²	9	18.9 Å²	18.9	4%	0.042	10%	0.101	C	C	.	.	H	α-helix	trans	-71.3	-44.3	-178.8	-67.5	82.3	171.7	0	0	111.4	G423 A424 A428 C429 A430 I458 P459 K513	G423-E426 VanDerWaalsContact C-OE2 3.27Å; G423-E426 WeakPolarHBondContact CA-OE2 3.5Å; A424-E426 VanDerWaalsContact C-N 3.31Å; A424-E426 PolarHBondContact O-N 3.08Å; E426-A428 VanDerWaalsContact C-N 3.33Å; E426-A428 PolarHBondContact O-N 3.43Å; E426-C429 PolarHBondContact O-N 3.4Å; E426-A430 WeakPolarHBondContact O-CB 3.36Å; E426-A430 PolarHBondContact O-N 3.11Å; E426-I458 HydrophobicContact CG-CB 4.14Å; E426-I458 HydrophobicContact CG-CG2 4.03Å; E426-P459 HydrophobicContact CB-CG 4.46Å; E426-K513 WeakPolarHBondContact OE1-CE 3.42Å; E426-K513 IonicContact OE1-NZ 2.85Å; E426-K513 PolarHBondContact OE1-NZ 3.41Å
427	I	94.2	Very high	92.8	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-63.6	-43	176	-62.3	165.9	0	0	0	110	G423 A424 C429 A430 L431 P459 V477 R478 Q481	G423-I427 WeakPolarHBondContact O-CD1 3.31Å; G423-I427 WeakPolarHBondContact O-CG1 3.45Å; G423-I427 PolarHBondContact O-N 3.44Å; G423-I427 VanDerWaalsContact O-N 3.13Å; A424-I427 PolarHBondContact O-N 3.37Å; I427-C429 VanDerWaalsContact C-N 3.33Å; I427-C429 PolarHBondContact O-N 2.94Å; I427-A430 PolarHBondContact O-N 3.4Å; I427-L431 HydrophobicContact CG2-CD1 4.26Å; I427-L431 WeakPolarHBondContact O-CG 3.5Å; I427-L431 PolarHBondContact O-N 2.84Å; I427-P459 HydrophobicContact CD1-CB 4.12Å; I427-P459 HydrophobicContact CD1-CG 4.28Å; I427-P459 HydrophobicContact CG1-CB 4.21Å; I427-P459 HydrophobicContact CG1-CG 3.81Å; I427-V477 HydrophobicContact CD1-CB 4.28Å; I427-V477 HydrophobicContact CD1-CG1 3.65Å; I427-R478 HydrophobicContact CG2-CB 4.21Å; I427-R478 HydrophobicContact CG2-CG 4.36Å; I427-Q481 VanDerWaalsContact CG2-OE1 3.23Å
428	A	93.8	Very high	92.8	Very high	6 Å²	6	17.5 Å²	17.5	5%	0.05	10%	0.1	C	C	.	.	H	α-helix	trans	-65.4	-39.3	-179.2	0	0	0	0	0	111.5	M151 A424 E426 A432 P487	M151-A428 HydrophobicContact CE-CB 3.47Å; M151-A428 VanDerWaalsContact CE-CB 3.47Å; M151-A428 HydrophobicContact SD-CB 3.58Å; M151-A428 VanDerWaalsContact SD-CB 3.58Å; A424-A428 WeakPolarHBondContact O-CB 3.41Å; A424-A428 PolarHBondContact O-N 2.93Å; E426-A428 VanDerWaalsContact C-N 3.33Å; E426-A428 PolarHBondContact O-N 3.43Å; A428-A432 PolarHBondContact O-N 2.93Å; A428-A432 VanDerWaalsContact O-N 3.12Å; A428-P487 HydrophobicContact CB-CB 4.01Å
429	C	94.5	Very high	92.8	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.007	14%	0.135	C	C	.	.	H	α-helix	trans	-64.9	-43.4	171.3	-70.1	0	0	0	0	112.1	A144 S425 E426 I427 L431 A432 V433 L455	A144-C429 HydrophobicContact CB-CB 4.03Å; S425-C429 WeakPolarHBondContact O-CB 3.19Å; S425-C429 PolarHBondContact O-N 3.46Å; S425-C429 PolarHBondContact O-SG 2.94Å; E426-C429 PolarHBondContact O-N 3.4Å; I427-C429 VanDerWaalsContact C-N 3.33Å; I427-C429 PolarHBondContact O-N 2.94Å; C429-L431 VanDerWaalsContact C-N 3.31Å; C429-L431 PolarHBondContact O-N 3.44Å; C429-A432 PolarHBondContact O-N 3.27Å; C429-V433 WeakPolarHBondContact O-CB 3.34Å; C429-V433 VanDerWaalsContact O-CG2 3.29Å; C429-V433 WeakPolarHBondContact O-CG2 3.5Å; C429-V433 PolarHBondContact O-N 2.92Å; C429-L455 HydrophobicContact CB-CD1 3.77Å
430	A	94.9	Very high	92.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-60.5	-40.4	178	0	0	0	0	0	111.9	E426 I427 N434 A452 L455 E456	E426-A430 WeakPolarHBondContact O-CB 3.36Å; E426-A430 PolarHBondContact O-N 3.11Å; I427-A430 PolarHBondContact O-N 3.4Å; A430-N434 VanDerWaalsContact O-CB 3.31Å; A430-N434 WeakPolarHBondContact O-CB 3.38Å; A430-N434 PolarHBondContact O-N 3.37Å; A430-N434 PolarHBondContact O-ND2 3.35Å; A430-N434 VanDerWaalsContact O-ND2 3.09Å; A430-A452 HydrophobicContact CB-CB 4.15Å; A430-A452 WeakPolarHBondContact CB-O 3.49Å; A430-A452 WeakPolarHBondContact O-CB 3.43Å; A430-L455 HydrophobicContact CB-CB 4.11Å; A430-L455 HydrophobicContact CB-CD1 4.35Å; A430-E456 HydrophobicContact CB-CG 4.05Å
431	L	94.1	Very high	92.1	Very high	23 Å²	23	30.9 Å²	30.9	12%	0.12	18%	0.181	C	C	.	.	H	α-helix	trans	-63.4	-46.2	174.6	-72.5	172.4	0	0	0	112	I427 C429 N434 Q435 R478 Q481 V482	I427-L431 HydrophobicContact CG2-CD1 4.26Å; I427-L431 WeakPolarHBondContact O-CG 3.5Å; I427-L431 PolarHBondContact O-N 2.84Å; C429-L431 VanDerWaalsContact C-N 3.31Å; C429-L431 PolarHBondContact O-N 3.44Å; L431-N434 PolarHBondContact O-N 3.02Å; L431-Q435 WeakPolarHBondContact O-CG 3.42Å; L431-Q435 PolarHBondContact O-N 2.78Å; L431-R478 HydrophobicContact CD2-CG 3.96Å; L431-Q481 HydrophobicContact CD1-CB 4.1Å; L431-V482 HydrophobicContact CD1-CG2 3.76Å; L431-V482 HydrophobicContact CD2-CG2 3.82Å; L431-V482 HydrophobicContact CG-CG2 4.45Å
432	A	94	Very high	91.9	Very high	21 Å²	21	33 Å²	33	17%	0.174	20%	0.195	C	C	.	.	H	α-helix	trans	-64.7	-42.6	179	0	0	0	0	0	112.3	T147 A428 C429 Q435 A436	T147-A432 HydrophobicContact CG2-CB 3.8Å; T147-A432 WeakPolarHBondContact OG1-CB 3.25Å; A428-A432 PolarHBondContact O-N 2.93Å; A428-A432 VanDerWaalsContact O-N 3.12Å; C429-A432 PolarHBondContact O-N 3.27Å; A432-Q435 PolarHBondContact O-N 3.34Å; A432-A436 PolarHBondContact O-N 2.88Å
433	V	95	Very high	91.7	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.3	-41.4	176.3	172.8	0	0	0	0	110.8	A140 I143 A144 C429 A436 A437 M448 F451 A452	A140-V433 HydrophobicContact CB-CG1 3.84Å; I143-V433 HydrophobicContact CB-CG2 4.5Å; I143-V433 HydrophobicContact CG2-CG2 4.29Å; A144-V433 HydrophobicContact CB-CG2 4.22Å; C429-V433 WeakPolarHBondContact O-CB 3.34Å; C429-V433 VanDerWaalsContact O-CG2 3.29Å; C429-V433 WeakPolarHBondContact O-CG2 3.5Å; C429-V433 PolarHBondContact O-N 2.92Å; V433-A436 PolarHBondContact O-N 3.45Å; V433-A437 WeakPolarHBondContact O-CB 3.37Å; V433-A437 PolarHBondContact O-N 3.08Å; V433-M448 HydrophobicContact CG1-CB 4.17Å; V433-M448 VanDerWaalsContact CG1-O 3.23Å; V433-M448 WeakPolarHBondContact CG1-O 3.35Å; V433-F451 HydrophobicContact CG1-CD1 4.4Å; V433-F451 HydrophobicContact CG2-CD1 4.46Å; V433-A452 HydrophobicContact CB-CB 4.25Å; V433-A452 HydrophobicContact CG1-CB 4.11Å
434	N	94.3	Very high	91.6	Very high	23 Å²	23	39.5 Å²	39.5	12%	0.123	23%	0.225	C	C	.	.	H	α-helix	trans	-62.6	-43.5	175.8	-84.1	-39.9	0	0	0	112.5	A430 L431 A436 A437 D438 A452	A430-N434 VanDerWaalsContact O-CB 3.31Å; A430-N434 WeakPolarHBondContact O-CB 3.38Å; A430-N434 PolarHBondContact O-N 3.37Å; A430-N434 PolarHBondContact O-ND2 3.35Å; A430-N434 VanDerWaalsContact O-ND2 3.09Å; L431-N434 PolarHBondContact O-N 3.02Å; N434-A436 VanDerWaalsContact C-N 3.31Å; N434-A436 PolarHBondContact O-N 2.91Å; N434-A437 WeakPolarHBondContact O-CB 3.43Å; N434-A437 PolarHBondContact O-N 3.34Å; N434-D438 PolarHBondContact O-N 3.25Å; N434-D438 VanDerWaalsContact O-N 3.07Å; N434-A452 WeakPolarHBondContact ND2-CB 3.47Å; N434-A452 WeakPolarHBondContact OD1-CB 3.5Å
435	Q	92.9	Very high	91.6	Very high	126 Å²	126	41.4 Å²	41.4	59%	0.589	23%	0.234	S	C	*	.	H	α-helix	trans	-62.4	-39	174.9	-71.6	173.3	5.4	0	0	112.1	L431 A432 A437 D438 N439	L431-Q435 WeakPolarHBondContact O-CG 3.42Å; L431-Q435 PolarHBondContact O-N 2.78Å; A432-Q435 PolarHBondContact O-N 3.34Å; Q435-A437 VanDerWaalsContact C-N 3.34Å; Q435-D438 PolarHBondContact O-N 3.29Å; Q435-N439 PolarHBondContact O-N 3.25Å; Q435-N439 PolarHBondContact O-ND2 3.13Å; Q435-N439 VanDerWaalsContact O-ND2 3.09Å
436	A	92.9	Very high	91.5	Very high	26 Å²	26	46 Å²	46	22%	0.215	25%	0.251	C	S	.	.	H	α-helix	trans	-68.2	-35.6	175.1	0	0	0	0	0	112	I143 A432 V433 N434 D438 N439 C440 M448	I143-A436 HydrophobicContact CD1-CB 3.77Å; I143-A436 HydrophobicContact CG2-CB 4.25Å; A432-A436 PolarHBondContact O-N 2.88Å; V433-A436 PolarHBondContact O-N 3.45Å; N434-A436 VanDerWaalsContact C-N 3.31Å; N434-A436 PolarHBondContact O-N 2.91Å; A436-D438 VanDerWaalsContact C-N 3.32Å; A436-D438 PolarHBondContact O-N 3.35Å; A436-N439 PolarHBondContact O-N 3.5Å; A436-C440 PolarHBondContact O-N 2.86Å; A436-M448 HydrophobicContact CB-CE 3.69Å
437	A	93.1	Very high	91.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.4	-37.1	175.5	0	0	0	0	0	111.8	V433 N434 Q435 N439 C440 Q445 M448 R449	V433-A437 WeakPolarHBondContact O-CB 3.37Å; V433-A437 PolarHBondContact O-N 3.08Å; N434-A437 WeakPolarHBondContact O-CB 3.43Å; N434-A437 PolarHBondContact O-N 3.34Å; Q435-A437 VanDerWaalsContact C-N 3.34Å; A437-N439 VanDerWaalsContact C-N 3.26Å; A437-N439 PolarHBondContact O-N 3.41Å; A437-C440 PolarHBondContact O-N 3.47Å; A437-C440 VanDerWaalsContact O-N 3.16Å; A437-Q445 HydrophobicContact CB-CG 4.27Å; A437-Q445 VanDerWaalsContact O-CG 3.31Å; A437-Q445 WeakPolarHBondContact O-CG 3.29Å; A437-Q445 PolarHBondContact O-NE2 3Å; A437-M448 HydrophobicContact CB-CB 3.77Å; A437-M448 HydrophobicContact CB-CE 4.41Å; A437-M448 HydrophobicContact CB-SD 4.45Å; A437-R449 HydrophobicContact CB-CG 3.91Å
438	D	92.2	Very high	91.5	Very high	98 Å²	98	46 Å²	46	52%	0.524	25%	0.252	S	S	.	.	H	α-helix	trans	-65.3	-30	176.7	-69.3	-23.7	0	0	0	112.9	N434 Q435 A436 C440 R449	N434-D438 PolarHBondContact O-N 3.25Å; N434-D438 VanDerWaalsContact O-N 3.07Å; Q435-D438 PolarHBondContact O-N 3.29Å; A436-D438 VanDerWaalsContact C-N 3.32Å; A436-D438 PolarHBondContact O-N 3.35Å; D438-C440 VanDerWaalsContact C-N 3.35Å; D438-R449 IonicContact OD1-CZ 3.75Å; D438-R449 IonicContact OD1-NE 2.71Å; D438-R449 IonicContact OD1-NH2 3.62Å; D438-R449 PolarHBondContact OD1-NH2 3.35Å
439	N	90.5	Very high	91.5	Very high	139 Å²	139	50.1 Å²	50.1	74%	0.743	27%	0.266	S	S	*	.	H	α-helix	trans	-82.8	-11.8	176.2	-66.7	-47	0	0	0	113.4	Q435 A436 A437 P441	Q435-N439 PolarHBondContact O-N 3.25Å; Q435-N439 PolarHBondContact O-ND2 3.13Å; Q435-N439 VanDerWaalsContact O-ND2 3.09Å; A436-N439 PolarHBondContact O-N 3.5Å; A437-N439 VanDerWaalsContact C-N 3.26Å; A437-N439 PolarHBondContact O-N 3.41Å; N439-P441 WeakPolarHBondContact O-CD 3.33Å
440	C	86.4	Confident	91.6	Very high	24 Å²	24	50.5 Å²	50.5	16%	0.162	27%	0.269	C	S	.	.			trans	-93.1	114.7	-178.3	-162.3	0	0	0	0	110.5	A436 A437 D438 S442 M448	A436-C440 PolarHBondContact O-N 2.86Å; A437-C440 PolarHBondContact O-N 3.47Å; A437-C440 VanDerWaalsContact O-N 3.16Å; D438-C440 VanDerWaalsContact C-N 3.35Å; C440-S442 VanDerWaalsContact C-N 3.27Å; C440-S442 PolarHBondContact O-N 3.31Å; C440-S442 PolarHBondContact SG-OG 2.97Å; C440-M448 HydrophobicContact CB-SD 4.28Å
441	P	82.4	Confident	91.6	Very high	133 Å²	133	50.5 Å²	50.5	86%	0.864	27%	0.269	S	S	*	.			trans	-82.9	0.9	-179.4	33.4	-35.7	0	0	0	113.6	N439	N439-P441 WeakPolarHBondContact O-CD 3.33Å
442	S	85.9	Confident	91.7	Very high	43 Å²	43	49.4 Å²	49.4	30%	0.301	26%	0.263	S	S	.	.	S	Bend	trans	-90.7	167.9	-173.8	80.1	0	0	0	0	112.5	C440 E444 Q445	C440-S442 VanDerWaalsContact C-N 3.27Å; C440-S442 PolarHBondContact O-N 3.31Å; C440-S442 PolarHBondContact SG-OG 2.97Å; S442-E444 PolarHBondContact O-N 3.42Å; S442-E444 VanDerWaalsContact O-N 3.1Å; S442-E444 WeakPolarHBondContact OG-CB 3.36Å; S442-E444 PolarHBondContact OG-N 3.21Å; S442-E444 PolarHBondContact OG-OE2 2.97Å; S442-Q445 WeakPolarHBondContact O-CB 3.32Å; S442-Q445 PolarHBondContact O-N 3.24Å
443	L	84.1	Confident	91.8	Very high	119 Å²	119	51.4 Å²	51.4	62%	0.623	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-20.6	172.2	-93.7	152.8	0	0	0	113.4	Q445 Y446	L443-Q445 PolarHBondContact O-N 3.42Å; L443-Y446 HydrophobicContact CD2-CD2 4.34Å; L443-Y446 PolarHBondContact O-N 3.37Å
444	E	86.9	Confident	91.8	Very high	31 Å²	31	51.4 Å²	51.4	15%	0.145	27%	0.271	C	S	.	.	H	α-helix	trans	-66.9	-19.3	177.8	-63	157	177.7	0	0	111.6	Q139 S442 Y446 A447 M448	Q139-E444 VanDerWaalsContact NE2-CD 3.29Å; Q139-E444 PolarHBondContact NE2-OE2 3.04Å; Q139-E444 PolarHBondContact OE1-OE2 3.18Å; S442-E444 PolarHBondContact O-N 3.42Å; S442-E444 VanDerWaalsContact O-N 3.1Å; S442-E444 WeakPolarHBondContact OG-CB 3.36Å; S442-E444 PolarHBondContact OG-N 3.21Å; S442-E444 PolarHBondContact OG-OE2 2.97Å; E444-Y446 PolarHBondContact O-N 3.41Å; E444-A447 WeakPolarHBondContact O-CB 3.41Å; E444-A447 PolarHBondContact O-N 3.03Å; E444-M448 WeakPolarHBondContact O-CG 3.38Å; E444-M448 PolarHBondContact O-N 3.3Å
445	Q	92.8	Very high	91.8	Very high	40 Å²	40	50.4 Å²	50.4	19%	0.187	27%	0.265	C	S	.	.	H	α-helix	trans	-50.9	-41.7	172.3	176.7	175.9	56.4	0	0	112.4	A437 S442 L443 M448 R449	A437-Q445 HydrophobicContact CB-CG 4.27Å; A437-Q445 VanDerWaalsContact O-CG 3.31Å; A437-Q445 WeakPolarHBondContact O-CG 3.29Å; A437-Q445 PolarHBondContact O-NE2 3Å; S442-Q445 WeakPolarHBondContact O-CB 3.32Å; S442-Q445 PolarHBondContact O-N 3.24Å; L443-Q445 PolarHBondContact O-N 3.42Å; Q445-M448 PolarHBondContact O-N 3.4Å; Q445-R449 WeakPolarHBondContact O-CG 3.48Å; Q445-R449 PolarHBondContact O-N 3.47Å
446	Y	92.6	Very high	91.9	Very high	105 Å²	105	44.9 Å²	44.9	41%	0.412	24%	0.24	S	C	.	.	H	α-helix	trans	-66.9	-41.2	179.1	-67.8	-76.3	0	0	0	111.9	I128 L443 E444 R449 S450	I128-Y446 HydrophobicContact CD1-CG 4.4Å; L443-Y446 HydrophobicContact CD2-CD2 4.34Å; L443-Y446 PolarHBondContact O-N 3.37Å; E444-Y446 PolarHBondContact O-N 3.41Å; Y446-R449 PolarHBondContact O-N 3.12Å; Y446-S450 WeakPolarHBondContact O-CB 3.46Å; Y446-S450 PolarHBondContact O-N 3.29Å; Y446-S450 PolarHBondContact O-OG 3Å
447	A	93.7	Very high	92	Very high	3 Å²	3	44.9 Å²	44.9	3%	0.025	24%	0.237	C	C	.	.	H	α-helix	trans	-66.1	-40.4	176.3	0	0	0	0	0	111.5	L123 Y137 E444 R449 S450 F451	L123-A447 HydrophobicContact CD1-CB 4.33Å; Y137-A447 HydrophobicContact CD1-CB 4.07Å; Y137-A447 WeakPolarHBondContact CD1-O 3.36Å; Y137-A447 HydrophobicContact CE1-CB 4.2Å; Y137-A447 WeakPolarHBondContact CE1-O 3.27Å; E444-A447 WeakPolarHBondContact O-CB 3.41Å; E444-A447 PolarHBondContact O-N 3.03Å; A447-R449 PolarHBondContact O-N 3.43Å; A447-S450 PolarHBondContact O-N 3.18Å; A447-F451 WeakPolarHBondContact O-CB 3.48Å; A447-F451 PolarHBondContact O-N 3.34Å
448	M	94.5	Very high	92	Very high	4 Å²	4	45.2 Å²	45.2	2%	0.02	24%	0.239	C	C	.	.	H	α-helix	trans	-62.7	-41.8	175.7	-66.1	177.8	70.8	0	0	112.3	A140 I143 V433 A436 A437 C440 E444 Q445 F451 A452	A140-M448 HydrophobicContact CB-CB 4.47Å; A140-M448 HydrophobicContact CB-CG 4.22Å; I143-M448 HydrophobicContact CD1-CE 3.52Å; V433-M448 HydrophobicContact CG1-CB 4.17Å; V433-M448 VanDerWaalsContact CG1-O 3.23Å; V433-M448 WeakPolarHBondContact CG1-O 3.35Å; A436-M448 HydrophobicContact CB-CE 3.69Å; A437-M448 HydrophobicContact CB-CB 3.77Å; A437-M448 HydrophobicContact CB-CE 4.41Å; A437-M448 HydrophobicContact CB-SD 4.45Å; C440-M448 HydrophobicContact CB-SD 4.28Å; E444-M448 WeakPolarHBondContact O-CG 3.38Å; E444-M448 PolarHBondContact O-N 3.3Å; Q445-M448 PolarHBondContact O-N 3.4Å; M448-F451 WeakPolarHBondContact O-CB 3.24Å; M448-F451 PolarHBondContact O-N 3.48Å; M448-A452 PolarHBondContact O-N 2.74Å
449	R	94.8	Very high	92.1	Very high	93 Å²	93	40.6 Å²	40.6	35%	0.351	21%	0.214	S	C	.	.	H	α-helix	trans	-63.8	-46.1	175.5	-73.7	-178.6	176.3	174	0	111.8	A437 D438 Q445 Y446 A447 F451 A452 D453	A437-R449 HydrophobicContact CB-CG 3.91Å; D438-R449 IonicContact OD1-CZ 3.75Å; D438-R449 IonicContact OD1-NE 2.71Å; D438-R449 IonicContact OD1-NH2 3.62Å; D438-R449 PolarHBondContact OD1-NH2 3.35Å; Q445-R449 WeakPolarHBondContact O-CG 3.48Å; Q445-R449 PolarHBondContact O-N 3.47Å; Y446-R449 PolarHBondContact O-N 3.12Å; A447-R449 PolarHBondContact O-N 3.43Å; R449-F451 VanDerWaalsContact C-N 3.26Å; R449-F451 PolarHBondContact O-N 2.91Å; R449-A452 WeakPolarHBondContact O-CB 3.46Å; R449-A452 PolarHBondContact O-N 3.02Å; R449-A452 VanDerWaalsContact O-N 3.08Å; R449-D453 PolarHBondContact O-N 3.49Å
450	S	95.3	Very high	92.3	Very high	10 Å²	10	36.2 Å²	36.2	7%	0.07	19%	0.189	C	C	.	.	H	α-helix	trans	-59.8	-34.7	174	-77.5	0	0	0	0	113.1	Y446 A447 D453 A454	Y446-S450 WeakPolarHBondContact O-CB 3.46Å; Y446-S450 PolarHBondContact O-N 3.29Å; Y446-S450 PolarHBondContact O-OG 3Å; A447-S450 PolarHBondContact O-N 3.18Å; S450-D453 PolarHBondContact O-N 2.75Å; S450-A454 WeakPolarHBondContact O-CB 3.42Å; S450-A454 PolarHBondContact O-N 3.41Å
451	F	96	Very high	92.6	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-66	-42.6	173.2	-171.9	-83.7	0	0	0	111.8	L116 Y137 A140 A141 A144 V433 A447 M448 R449 A454 L455 I517	L116-F451 HydrophobicContact CD1-CD2 4.45Å; L116-F451 HydrophobicContact CD1-CE2 4.08Å; L116-F451 HydrophobicContact CD2-CB 4.34Å; L116-F451 HydrophobicContact CD2-CD2 3.31Å; L116-F451 HydrophobicContact CD2-CE2 3.75Å; L116-F451 HydrophobicContact CD2-CG 3.97Å; Y137-F451 HydrophobicContact CD1-CB 3.97Å; Y137-F451 HydrophobicContact CD1-CD2 4.05Å; Y137-F451 HydrophobicContact CE1-CB 4.13Å; Y137-F451 HydrophobicContact CG-CD2 4.01Å; A140-F451 HydrophobicContact CB-CB 3.75Å; A140-F451 HydrophobicContact CB-CD1 3.6Å; A140-F451 HydrophobicContact CB-CD2 4.03Å; A140-F451 HydrophobicContact CB-CE1 4.16Å; A140-F451 HydrophobicContact CB-CG 3.52Å; A141-F451 HydrophobicContact CB-CE2 4.16Å; A141-F451 HydrophobicContact CB-CZ 3.92Å; A144-F451 HydrophobicContact CB-CE1 4.34Å; V433-F451 HydrophobicContact CG1-CD1 4.4Å; V433-F451 HydrophobicContact CG2-CD1 4.46Å; A447-F451 WeakPolarHBondContact O-CB 3.48Å; A447-F451 PolarHBondContact O-N 3.34Å; M448-F451 WeakPolarHBondContact O-CB 3.24Å; M448-F451 PolarHBondContact O-N 3.48Å; R449-F451 VanDerWaalsContact C-N 3.26Å; R449-F451 PolarHBondContact O-N 2.91Å; F451-A454 WeakPolarHBondContact O-CB 3.19Å; F451-A454 PolarHBondContact O-N 3.43Å; F451-L455 HydrophobicContact CD1-CD1 3.96Å; F451-L455 HydrophobicContact CD1-CG 4.21Å; F451-L455 HydrophobicContact CE1-CD1 3.73Å; F451-L455 HydrophobicContact CE1-CD2 4.33Å; F451-L455 HydrophobicContact CE1-CG 3.98Å; F451-L455 PolarHBondContact O-N 3.07Å; F451-I517 HydrophobicContact CZ-CG2 3.93Å
452	A	95.6	Very high	93.1	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-63	-41.8	175	0	0	0	0	0	111.9	A430 V433 N434 M448 R449 A454 L455 E456	A430-A452 HydrophobicContact CB-CB 4.15Å; A430-A452 WeakPolarHBondContact CB-O 3.49Å; A430-A452 WeakPolarHBondContact O-CB 3.43Å; V433-A452 HydrophobicContact CB-CB 4.25Å; V433-A452 HydrophobicContact CG1-CB 4.11Å; N434-A452 WeakPolarHBondContact ND2-CB 3.47Å; N434-A452 WeakPolarHBondContact OD1-CB 3.5Å; M448-A452 PolarHBondContact O-N 2.74Å; R449-A452 WeakPolarHBondContact O-CB 3.46Å; R449-A452 PolarHBondContact O-N 3.02Å; R449-A452 VanDerWaalsContact O-N 3.08Å; A452-A454 VanDerWaalsContact C-N 3.3Å; A452-A454 PolarHBondContact O-N 3.26Å; A452-L455 WeakPolarHBondContact O-CB 3.32Å; A452-L455 PolarHBondContact O-N 3.37Å; A452-E456 PolarHBondContact O-N 2.97Å
453	D	95.2	Very high	93.5	Very high	63 Å²	63	27.4 Å²	27.4	34%	0.337	13%	0.13	S	C	.	.	H	α-helix	trans	-63.9	-35.3	175.3	-64.8	-23.1	0	0	0	111.7	R449 S450 E456	R449-D453 PolarHBondContact O-N 3.49Å; S450-D453 PolarHBondContact O-N 2.75Å; D453-E456 PolarHBondContact O-N 3.09Å
454	A	95.9	Very high	93.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-67.5	-37.7	174.8	0	0	0	0	0	112.7	A115 L116 Q119 S450 F451 A452 E456 V457	A115-A454 HydrophobicContact CB-CB 4.04Å; L116-A454 HydrophobicContact CD2-CB 3.55Å; L116-A454 HydrophobicContact CG-CB 3.91Å; Q119-A454 HydrophobicContact CG-CB 4.08Å; S450-A454 WeakPolarHBondContact O-CB 3.42Å; S450-A454 PolarHBondContact O-N 3.41Å; F451-A454 WeakPolarHBondContact O-CB 3.19Å; F451-A454 PolarHBondContact O-N 3.43Å; A452-A454 VanDerWaalsContact C-N 3.3Å; A452-A454 PolarHBondContact O-N 3.26Å; A454-E456 PolarHBondContact O-N 2.92Å; A454-V457 WeakPolarHBondContact O-CB 3.34Å; A454-V457 PolarHBondContact O-N 3.5Å; A454-V457 VanDerWaalsContact O-N 3.13Å
455	L	95.1	Very high	94.1	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-61.5	-33.8	174.6	-74.6	172.7	0	0	0	111.9	L112 C429 A430 F451 A452 V457 I458 P459 I517	L112-L455 HydrophobicContact CD1-CD2 3.99Å; L112-L455 HydrophobicContact CD2-CD2 4.49Å; C429-L455 HydrophobicContact CB-CD1 3.77Å; A430-L455 HydrophobicContact CB-CB 4.11Å; A430-L455 HydrophobicContact CB-CD1 4.35Å; F451-L455 HydrophobicContact CD1-CD1 3.96Å; F451-L455 HydrophobicContact CD1-CG 4.21Å; F451-L455 HydrophobicContact CE1-CD1 3.73Å; F451-L455 HydrophobicContact CE1-CD2 4.33Å; F451-L455 HydrophobicContact CE1-CG 3.98Å; F451-L455 PolarHBondContact O-N 3.07Å; A452-L455 WeakPolarHBondContact O-CB 3.32Å; A452-L455 PolarHBondContact O-N 3.37Å; L455-V457 PolarHBondContact O-N 3Å; L455-I458 PolarHBondContact O-N 3.37Å; L455-P459 WeakPolarHBondContact O-CD 3.44Å; L455-I517 HydrophobicContact CD2-CD1 4.48Å
456	E	94.4	Very high	94	Very high	11 Å²	11	25.4 Å²	25.4	5%	0.051	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-15.9	177.5	-69.3	-173.1	173.5	0	0	113.2	A430 A452 D453 A454 I458 P459 M460 M474 R478	A430-E456 HydrophobicContact CB-CG 4.05Å; A452-E456 PolarHBondContact O-N 2.97Å; D453-E456 PolarHBondContact O-N 3.09Å; A454-E456 PolarHBondContact O-N 2.92Å; E456-I458 VanDerWaalsContact C-N 3.35Å; E456-I458 PolarHBondContact O-N 3.19Å; E456-P459 VanDerWaalsContact O-CD 3.27Å; E456-P459 WeakPolarHBondContact O-CD 3.31Å; E456-P459 VanDerWaalsContact O-CG 3.25Å; E456-P459 WeakPolarHBondContact O-CG 3.39Å; E456-M460 HydrophobicContact CB-CE 3.99Å; E456-M460 WeakPolarHBondContact O-CB 3.47Å; E456-M460 WeakPolarHBondContact O-CE 3.26Å; E456-M460 VanDerWaalsContact O-CG 3.29Å; E456-M460 WeakPolarHBondContact O-CG 3.47Å; E456-M460 PolarHBondContact O-N 2.86Å; E456-M474 HydrophobicContact CB-SD 3.8Å; E456-M474 HydrophobicContact CG-SD 4.21Å; E456-M474 WeakPolarHBondContact OE2-CE 3.42Å; E456-R478 IonicContact OE1-CZ 2.62Å; E456-R478 IonicContact OE1-NE 2.69Å; E456-R478 IonicContact OE1-NH1 2.79Å; E456-R478 PolarHBondContact OE1-NH1 2.94Å; E456-R478 IonicContact OE2-NH1 3.86Å
457	V	94.4	Very high	93.9	Very high	25 Å²	25	23.9 Å²	23.9	15%	0.152	14%	0.136	C	C	.	.	H	α-helix	trans	-66.6	-34.4	178.5	178.1	0	0	0	0	112.8	V111 A115 A454 L455 M460 A461	V111-V457 HydrophobicContact CG1-CG1 4.33Å; A115-V457 HydrophobicContact CB-CB 3.84Å; A115-V457 HydrophobicContact CB-CG1 4.05Å; A115-V457 HydrophobicContact CB-CG2 3.77Å; A454-V457 WeakPolarHBondContact O-CB 3.34Å; A454-V457 PolarHBondContact O-N 3.5Å; A454-V457 VanDerWaalsContact O-N 3.13Å; L455-V457 PolarHBondContact O-N 3Å; V457-M460 HydrophobicContact CG2-CE 4.03Å; V457-M460 PolarHBondContact O-N 2.87Å; V457-A461 WeakPolarHBondContact O-CB 3.35Å; V457-A461 PolarHBondContact O-N 3.02Å
458	I	94.2	Very high	93.8	Very high	8 Å²	8	25.9 Å²	25.9	4%	0.041	15%	0.146	C	C	.	.	H	α-helix	trans	-61.3	-56.3	176.8	-64.6	-65.1	0	0	0	111.4	L52 V111 L112 E426 L455 E456 M460 A461 L462	L52-I458 HydrophobicContact CD2-CD1 4.15Å; L52-I458 HydrophobicContact CD2-CG2 4.22Å; V111-I458 HydrophobicContact CB-CD1 3.94Å; V111-I458 HydrophobicContact CG1-CD1 3.73Å; L112-I458 HydrophobicContact CB-CD1 4.45Å; E426-I458 HydrophobicContact CG-CB 4.14Å; E426-I458 HydrophobicContact CG-CG2 4.03Å; L455-I458 PolarHBondContact O-N 3.37Å; E456-I458 VanDerWaalsContact C-N 3.35Å; E456-I458 PolarHBondContact O-N 3.19Å; I458-M460 VanDerWaalsContact C-N 3.33Å; I458-M460 PolarHBondContact O-N 3.43Å; I458-A461 WeakPolarHBondContact O-CB 3.27Å; I458-A461 PolarHBondContact O-N 3.13Å; I458-L462 WeakPolarHBondContact O-CG 3.5Å; I458-L462 PolarHBondContact O-N 3.41Å
459	P	94.3	Very high	93.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.7	-41.4	174.1	14.6	-22.9	0	0	0	112.1	E426 I427 L455 E456 A461 L462 A463 I491	E426-P459 HydrophobicContact CB-CG 4.46Å; I427-P459 HydrophobicContact CD1-CB 4.12Å; I427-P459 HydrophobicContact CD1-CG 4.28Å; I427-P459 HydrophobicContact CG1-CB 4.21Å; I427-P459 HydrophobicContact CG1-CG 3.81Å; L455-P459 WeakPolarHBondContact O-CD 3.44Å; E456-P459 VanDerWaalsContact O-CD 3.27Å; E456-P459 WeakPolarHBondContact O-CD 3.31Å; E456-P459 VanDerWaalsContact O-CG 3.25Å; E456-P459 WeakPolarHBondContact O-CG 3.39Å; P459-A461 VanDerWaalsContact C-N 3.29Å; P459-A461 PolarHBondContact O-N 3.03Å; P459-L462 WeakPolarHBondContact O-CB 3.39Å; P459-L462 PolarHBondContact O-N 3.18Å; P459-L462 VanDerWaalsContact O-N 3.13Å; P459-A463 PolarHBondContact O-N 3.28Å; P459-I491 VanDerWaalsContact CA-CD1 3.45Å; P459-I491 HydrophobicContact CB-CD1 3.31Å; P459-I491 HydrophobicContact CB-CG1 4.3Å; P459-I491 WeakPolarHBondContact O-CD1 3.34Å
460	M	93.9	Very high	93.5	Very high	47 Å²	47	25.3 Å²	25.3	23%	0.232	16%	0.156	C	C	.	.	H	α-helix	trans	-58.2	-41.1	176.2	-75.3	-171.2	-81.3	0	0	112.7	E456 V457 I458 A463 E464 P470 M474	E456-M460 HydrophobicContact CB-CE 3.99Å; E456-M460 WeakPolarHBondContact O-CB 3.47Å; E456-M460 WeakPolarHBondContact O-CE 3.26Å; E456-M460 VanDerWaalsContact O-CG 3.29Å; E456-M460 WeakPolarHBondContact O-CG 3.47Å; E456-M460 PolarHBondContact O-N 2.86Å; V457-M460 HydrophobicContact CG2-CE 4.03Å; V457-M460 PolarHBondContact O-N 2.87Å; I458-M460 VanDerWaalsContact C-N 3.33Å; I458-M460 PolarHBondContact O-N 3.43Å; M460-A463 PolarHBondContact O-N 3.29Å; M460-E464 WeakPolarHBondContact O-CB 3.29Å; M460-E464 PolarHBondContact O-N 3.47Å; M460-P470 HydrophobicContact CB-CB 4.22Å; M460-P470 HydrophobicContact CG-CB 4.32Å; M460-M474 HydrophobicContact CE-SD 4.1Å; M460-M474 HydrophobicContact CG-SD 3.48Å; M460-M474 WeakPolarHBondContact CG-SD 3.44Å; M460-M474 HydrophobicContact SD-CE 4.16Å; M460-M474 HydrophobicContact SD-SD 3.76Å
461	A	93.4	Very high	93.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.5	-41	175.7	0	0	0	0	0	112.1	K49 L52 V457 I458 P459 A463 E464 N465	K49-A461 HydrophobicContact CD-CB 4.24Å; K49-A461 VanDerWaalsContact CE-CB 3.49Å; K49-A461 HydrophobicContact CG-CB 3.67Å; L52-A461 HydrophobicContact CD2-CB 3.9Å; V457-A461 WeakPolarHBondContact O-CB 3.35Å; V457-A461 PolarHBondContact O-N 3.02Å; I458-A461 WeakPolarHBondContact O-CB 3.27Å; I458-A461 PolarHBondContact O-N 3.13Å; P459-A461 VanDerWaalsContact C-N 3.29Å; P459-A461 PolarHBondContact O-N 3.03Å; A461-A463 PolarHBondContact O-N 3.35Å; A461-E464 PolarHBondContact O-N 2.86Å; A461-N465 WeakPolarHBondContact O-CB 3.39Å; A461-N465 PolarHBondContact O-N 3.5Å; A461-N465 PolarHBondContact O-ND2 3.41Å
462	L	92.8	Very high	93.2	Very high	16 Å²	16	36.7 Å²	36.7	8%	0.084	21%	0.211	C	C	.	.	H	α-helix	trans	-62.1	-41.8	175.7	-69.4	174.5	0	0	0	112.4	L52 G53 I458 P459 S466 I491	L52-L462 HydrophobicContact CD2-CD2 4.19Å; L52-L462 HydrophobicContact CD2-CG 4.24Å; L52-L462 HydrophobicContact CG-CD2 3.99Å; G53-L462 VanDerWaalsContact CA-CD2 3.41Å; I458-L462 WeakPolarHBondContact O-CG 3.5Å; I458-L462 PolarHBondContact O-N 3.41Å; P459-L462 WeakPolarHBondContact O-CB 3.39Å; P459-L462 PolarHBondContact O-N 3.18Å; P459-L462 VanDerWaalsContact O-N 3.13Å; L462-S466 VanDerWaalsContact O-CB 3.32Å; L462-S466 WeakPolarHBondContact O-CB 3.31Å; L462-S466 PolarHBondContact O-N 3.02Å; L462-S466 VanDerWaalsContact O-N 3.13Å; L462-S466 PolarHBondContact O-OG 3.34Å; L462-I491 HydrophobicContact CB-CD1 4.48Å
463	A	93.4	Very high	92.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.3	-45.9	175.1	0	0	0	0	0	111.6	P459 M460 A461 S466 G467 L468 P470 I491	P459-A463 PolarHBondContact O-N 3.28Å; M460-A463 PolarHBondContact O-N 3.29Å; A461-A463 PolarHBondContact O-N 3.35Å; A463-S466 CarbonylContact O-C 3.57Å; A463-S466 PolarHBondContact O-N 3.37Å; A463-S466 VanDerWaalsContact O-N 3.15Å; A463-G467 PolarHBondContact O-N 3.24Å; A463-L468 HydrophobicContact CB-CB 4.18Å; A463-L468 PolarHBondContact O-N 3.04Å; A463-P470 HydrophobicContact CB-CB 4.28Å; A463-I491 HydrophobicContact CB-CD1 4.12Å; A463-I491 HydrophobicContact CB-CG2 4.23Å
464	E	92.8	Very high	92.7	Very high	102 Å²	102	35.7 Å²	35.7	48%	0.477	21%	0.206	S	C	.	.	H	α-helix	trans	-59	-48.9	179	-173.4	173.8	-167.3	0	0	111.4	K49 M460 A461 S466 G467 P470	K49-E464 WeakPolarHBondContact CE-OE2 3.2Å; K49-E464 IonicContact NZ-OE2 2.69Å; K49-E464 PolarHBondContact NZ-OE2 3.43Å; M460-E464 WeakPolarHBondContact O-CB 3.29Å; M460-E464 PolarHBondContact O-N 3.47Å; A461-E464 PolarHBondContact O-N 2.86Å; E464-S466 PolarHBondContact O-N 3.05Å; E464-G467 PolarHBondContact O-N 3.41Å; E464-G467 VanDerWaalsContact O-N 3.09Å; E464-P470 HydrophobicContact CB-CG 3.91Å
465	N	92	Very high	92.5	Very high	33 Å²	33	39.6 Å²	39.6	18%	0.176	23%	0.23	C	C	.	.	H	α-helix	trans	-66.3	-24.1	178.7	-64.8	-17.5	0	0	0	112.6	K49 L52 A461 G467	K49-N465 PolarHBondContact O-ND2 3.27Å; L52-N465 PolarHBondContact O-ND2 2.91Å; A461-N465 WeakPolarHBondContact O-CB 3.39Å; A461-N465 PolarHBondContact O-N 3.5Å; A461-N465 PolarHBondContact O-ND2 3.41Å; N465-G467 VanDerWaalsContact C-N 3.33Å
466	S	90.4	Very high	92.3	Very high	12 Å²	12	44.7 Å²	44.7	8%	0.084	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	2.4	177.1	-56.1	0	0	0	0	113.7	N55 L462 A463 E464 L468 C493 H495	N55-S466 PolarHBondContact ND2-OG 3.2Å; N55-S466 VanDerWaalsContact ND2-OG 3.13Å; L462-S466 VanDerWaalsContact O-CB 3.32Å; L462-S466 WeakPolarHBondContact O-CB 3.31Å; L462-S466 PolarHBondContact O-N 3.02Å; L462-S466 VanDerWaalsContact O-N 3.13Å; L462-S466 PolarHBondContact O-OG 3.34Å; A463-S466 CarbonylContact O-C 3.57Å; A463-S466 PolarHBondContact O-N 3.37Å; A463-S466 VanDerWaalsContact O-N 3.15Å; E464-S466 PolarHBondContact O-N 3.05Å; S466-L468 VanDerWaalsContact C-N 3.26Å; S466-L468 PolarHBondContact O-N 3.36Å; S466-C493 WeakPolarHBondContact OG-CA 3.34Å; S466-C493 WeakPolarHBondContact OG-CB 3.43Å; S466-H495 PolarHBondContact O-NE2 2.77Å
467	G	89.9	Confident	92.1	Very high	73 Å²	73	44.3 Å²	44.3	75%	0.753	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	14.1	-178.8	0	0	0	0	0	114.4	A463 E464 N465	A463-G467 PolarHBondContact O-N 3.24Å; E464-G467 PolarHBondContact O-N 3.41Å; E464-G467 VanDerWaalsContact O-N 3.09Å; N465-G467 VanDerWaalsContact C-N 3.33Å
468	L	91.1	Very high	91.9	Very high	46 Å²	46	47 Å²	47	24%	0.241	26%	0.259	C	S	.	.	S	Bend	trans	-87.7	155.6	175.3	-63	175	0	0	0	110.2	A463 S466 P470 T473 I491	A463-L468 HydrophobicContact CB-CB 4.18Å; A463-L468 PolarHBondContact O-N 3.04Å; S466-L468 VanDerWaalsContact C-N 3.26Å; S466-L468 PolarHBondContact O-N 3.36Å; L468-P470 WeakPolarHBondContact O-CD 3.48Å; L468-T473 HydrophobicContact CD1-CG2 4.27Å; L468-I491 HydrophobicContact CD1-CG2 4.16Å
469	S	92.9	Very high	91.8	Very high	51 Å²	51	49.4 Å²	49.4	36%	0.357	28%	0.281	S	S	.	.			trans	-70.2	114.1	171.2	-179.5	0	0	0	0	109.4	I471 Q472 T473	S469-I471 PolarHBondContact O-N 3.47Å; S469-Q472 PolarHBondContact O-N 3.01Å; S469-T473 VanDerWaalsContact O-CB 3.3Å; S469-T473 WeakPolarHBondContact O-CB 3.38Å; S469-T473 PolarHBondContact O-N 2.91Å; S469-T473 PolarHBondContact O-OG1 3.08Å
470	P	91.6	Very high	91.6	Very high	34 Å²	34	54.5 Å²	54.5	22%	0.221	30%	0.3	C	S	.	.	H	α-helix	trans	-62.2	-43.8	-172.6	-24.9	36	0	0	0	112.5	M460 A463 E464 L468 M474	M460-P470 HydrophobicContact CB-CB 4.22Å; M460-P470 HydrophobicContact CG-CB 4.32Å; A463-P470 HydrophobicContact CB-CB 4.28Å; E464-P470 HydrophobicContact CB-CG 3.91Å; L468-P470 WeakPolarHBondContact O-CD 3.48Å; P470-M474 WeakPolarHBondContact O-CB 3.21Å; P470-M474 PolarHBondContact O-N 3.32Å
471	I	91.6	Very high	91.5	Very high	121 Å²	121	52.6 Å²	52.6	62%	0.621	29%	0.29	S	S	*	.	H	α-helix	trans	-67	-47.1	-176.1	-57.9	172.9	0	0	0	111	S469 T475	S469-I471 PolarHBondContact O-N 3.47Å; I471-T475 WeakPolarHBondContact O-CB 3.31Å; I471-T475 PolarHBondContact O-N 3.05Å; I471-T475 PolarHBondContact O-OG1 2.86Å
472	Q	91.8	Very high	91.4	Very high	127 Å²	127	56.9 Å²	56.9	59%	0.593	32%	0.316	S	S	*	.	H	α-helix	trans	-65	-50.5	-179.5	-67.5	178.2	-20.1	0	0	110.7	S469 M474 T475 E476	S469-Q472 PolarHBondContact O-N 3.01Å; Q472-M474 PolarHBondContact O-N 2.98Å; Q472-T475 PolarHBondContact O-N 3.26Å; Q472-E476 WeakPolarHBondContact O-CG 3.39Å; Q472-E476 PolarHBondContact O-N 3.13Å
473	T	90.3	Very high	91.3	Very high	21 Å²	21	64.5 Å²	64.5	13%	0.129	35%	0.349	C	S	.	.	H	α-helix	trans	-60.4	-46.2	-177.8	-49.6	0	0	0	0	111.3	L468 S469 E476 V477 I491	L468-T473 HydrophobicContact CD1-CG2 4.27Å; S469-T473 VanDerWaalsContact O-CB 3.3Å; S469-T473 WeakPolarHBondContact O-CB 3.38Å; S469-T473 PolarHBondContact O-N 2.91Å; S469-T473 PolarHBondContact O-OG1 3.08Å; T473-E476 PolarHBondContact O-N 2.8Å; T473-V477 HydrophobicContact CG2-CG2 4.47Å; T473-V477 VanDerWaalsContact O-CG2 3.29Å; T473-V477 WeakPolarHBondContact O-CG2 3.22Å; T473-V477 PolarHBondContact O-N 3.37Å; T473-I491 HydrophobicContact CG2-CG1 4.25Å; T473-I491 HydrophobicContact CG2-CG2 4.25Å
474	M	90.5	Very high	91	Very high	21 Å²	21	69 Å²	69	10%	0.103	37%	0.372	C	S	.	.	H	α-helix	trans	-62.8	-44.7	178.4	-176.9	-174.6	76.7	0	0	111.9	E456 M460 P470 Q472 E476 V477 R478	E456-M474 HydrophobicContact CB-SD 3.8Å; E456-M474 HydrophobicContact CG-SD 4.21Å; E456-M474 WeakPolarHBondContact OE2-CE 3.42Å; M460-M474 HydrophobicContact CE-SD 4.1Å; M460-M474 HydrophobicContact CG-SD 3.48Å; M460-M474 WeakPolarHBondContact CG-SD 3.44Å; M460-M474 HydrophobicContact SD-CE 4.16Å; M460-M474 HydrophobicContact SD-SD 3.76Å; P470-M474 WeakPolarHBondContact O-CB 3.21Å; P470-M474 PolarHBondContact O-N 3.32Å; Q472-M474 PolarHBondContact O-N 2.98Å; M474-E476 VanDerWaalsContact C-N 3.33Å; M474-E476 PolarHBondContact O-N 3.32Å; M474-V477 PolarHBondContact O-N 2.89Å; M474-R478 WeakPolarHBondContact O-CB 3.44Å; M474-R478 PolarHBondContact O-N 3.33Å
475	T	91.3	Very high	90.7	Very high	82 Å²	82	70.9 Å²	70.9	50%	0.503	39%	0.386	S	S	.	.	H	α-helix	trans	-62.2	-42.8	179.6	-56.4	0	0	0	0	111.2	I471 Q472 A479	I471-T475 WeakPolarHBondContact O-CB 3.31Å; I471-T475 PolarHBondContact O-N 3.05Å; I471-T475 PolarHBondContact O-OG1 2.86Å; Q472-T475 PolarHBondContact O-N 3.26Å; T475-A479 VanDerWaalsContact O-CB 3.26Å; T475-A479 WeakPolarHBondContact O-CB 3.46Å; T475-A479 PolarHBondContact O-N 3.29Å
476	E	90.9	Very high	90.4	Very high	108 Å²	108	71.3 Å²	71.3	51%	0.505	39%	0.388	S	S	.	.	H	α-helix	trans	-64.7	-49	177.8	-73.2	178.8	-166.2	0	0	112.3	Q472 T473 M474 A479 R480	Q472-E476 WeakPolarHBondContact O-CG 3.39Å; Q472-E476 PolarHBondContact O-N 3.13Å; T473-E476 PolarHBondContact O-N 2.8Å; M474-E476 VanDerWaalsContact C-N 3.33Å; M474-E476 PolarHBondContact O-N 3.32Å; E476-A479 PolarHBondContact O-N 3.36Å; E476-R480 WeakPolarHBondContact O-CG 3.42Å; E476-R480 PolarHBondContact O-N 2.9Å
477	V	91.2	Very high	90.2	Very high	3 Å²	3	72.3 Å²	72.3	2%	0.018	40%	0.395	C	S	.	.	H	α-helix	trans	-63.9	-44.3	179.9	175.4	0	0	0	0	110.6	I427 T473 M474 A479 R480 Q481 L489 N499	I427-V477 HydrophobicContact CD1-CB 4.28Å; I427-V477 HydrophobicContact CD1-CG1 3.65Å; T473-V477 HydrophobicContact CG2-CG2 4.47Å; T473-V477 VanDerWaalsContact O-CG2 3.29Å; T473-V477 WeakPolarHBondContact O-CG2 3.22Å; T473-V477 PolarHBondContact O-N 3.37Å; M474-V477 PolarHBondContact O-N 2.89Å; V477-A479 PolarHBondContact O-N 3Å; V477-R480 PolarHBondContact O-N 3.21Å; V477-Q481 HydrophobicContact CG1-CG 4.48Å; V477-Q481 PolarHBondContact O-N 2.89Å; V477-L489 HydrophobicContact CG1-CB 4.29Å; V477-L489 VanDerWaalsContact CG1-O 3.27Å; V477-L489 WeakPolarHBondContact CG1-O 3.5Å; V477-N499 WeakPolarHBondContact CG2-ND2 3.31Å
478	R	90.4	Very high	90.1	Very high	82 Å²	82	70.7 Å²	70.7	31%	0.309	37%	0.367	S	S	.	.	H	α-helix	trans	-60.1	-45.9	176.4	-176.5	176.7	173	174.5	-4	111.8	I427 L431 E456 M474 R480 Q481 V482	I427-R478 HydrophobicContact CG2-CB 4.21Å; I427-R478 HydrophobicContact CG2-CG 4.36Å; L431-R478 HydrophobicContact CD2-CG 3.96Å; E456-R478 IonicContact OE1-CZ 2.62Å; E456-R478 IonicContact OE1-NE 2.69Å; E456-R478 IonicContact OE1-NH1 2.79Å; E456-R478 PolarHBondContact OE1-NH1 2.94Å; E456-R478 IonicContact OE2-NH1 3.86Å; M474-R478 WeakPolarHBondContact O-CB 3.44Å; M474-R478 PolarHBondContact O-N 3.33Å; R478-R480 VanDerWaalsContact C-N 3.32Å; R478-R480 PolarHBondContact O-N 3.47Å; R478-Q481 PolarHBondContact O-N 3.37Å; R478-V482 WeakPolarHBondContact O-CG2 3.41Å; R478-V482 PolarHBondContact O-N 2.9Å; R478-V482 VanDerWaalsContact O-N 3.16Å
479	A	91.4	Very high	90.1	Very high	59 Å²	59	69.2 Å²	69.2	49%	0.488	36%	0.359	S	S	.	.	H	α-helix	trans	-62.3	-39.3	177.5	0	0	0	0	0	112.1	T475 E476 V477 K483	T475-A479 VanDerWaalsContact O-CB 3.26Å; T475-A479 WeakPolarHBondContact O-CB 3.46Å; T475-A479 PolarHBondContact O-N 3.29Å; E476-A479 PolarHBondContact O-N 3.36Å; V477-A479 PolarHBondContact O-N 3Å; A479-K483 VanDerWaalsContact O-CB 3.29Å; A479-K483 WeakPolarHBondContact O-CB 3.47Å; A479-K483 PolarHBondContact O-N 3.09Å
480	R	90.8	Very high	90	Very high	106 Å²	106	66.8 Å²	66.8	40%	0.4	34%	0.342	S	S	.	.	H	α-helix	trans	-69.1	-43.2	176.1	-70.4	-177.8	-171.4	171.8	8.2	112.6	E476 V477 R478 V482 K483 D484 L489 N499	E476-R480 WeakPolarHBondContact O-CG 3.42Å; E476-R480 PolarHBondContact O-N 2.9Å; V477-R480 PolarHBondContact O-N 3.21Å; R478-R480 VanDerWaalsContact C-N 3.32Å; R478-R480 PolarHBondContact O-N 3.47Å; R480-V482 VanDerWaalsContact C-N 3.26Å; R480-V482 PolarHBondContact O-N 3.07Å; R480-K483 PolarHBondContact O-N 3.41Å; R480-D484 WeakPolarHBondContact O-CB 3.43Å; R480-D484 PolarHBondContact O-N 2.89Å; R480-L489 HydrophobicContact CB-CD1 3.66Å; R480-N499 PolarHBondContact NH1-OD1 3.49Å
481	Q	91.4	Very high	90	Very high	8 Å²	8	65.3 Å²	65.3	4%	0.037	33%	0.332	C	S	.	.	H	α-helix	trans	-55.7	-43.3	175.9	-79.2	-159.6	-5.5	0	0	111.5	A424 I427 L431 V477 R478 N485 N486 P487 L489	A424-Q481 PolarHBondContact O-NE2 2.74Å; A424-Q481 VanDerWaalsContact O-NE2 3.12Å; I427-Q481 VanDerWaalsContact CG2-OE1 3.23Å; L431-Q481 HydrophobicContact CD1-CB 4.1Å; V477-Q481 HydrophobicContact CG1-CG 4.48Å; V477-Q481 PolarHBondContact O-N 2.89Å; R478-Q481 PolarHBondContact O-N 3.37Å; Q481-N485 WeakPolarHBondContact O-CA 3.49Å; Q481-N485 PolarHBondContact O-N 2.96Å; Q481-N486 WeakPolarHBondContact CG-O 3.18Å; Q481-N486 PolarHBondContact O-N 3.19Å; Q481-P487 PolarHBondContact NE2-O 3.34Å; Q481-L489 HydrophobicContact CG-CB 3.85Å; Q481-L489 HydrophobicContact CG-CD1 4.49Å; Q481-L489 PolarHBondContact NE2-O 3.34Å
482	V	91.4	Very high	89.9	Confident	90 Å²	90	60.1 Å²	60.1	55%	0.545	31%	0.306	S	S	.	.	H	α-helix	trans	-69.1	-43.3	177.4	175.5	0	0	0	0	111.9	L431 R478 R480	L431-V482 HydrophobicContact CD1-CG2 3.76Å; L431-V482 HydrophobicContact CD2-CG2 3.82Å; L431-V482 HydrophobicContact CG-CG2 4.45Å; R478-V482 WeakPolarHBondContact O-CG2 3.41Å; R478-V482 PolarHBondContact O-N 2.9Å; R478-V482 VanDerWaalsContact O-N 3.16Å; R480-V482 VanDerWaalsContact C-N 3.26Å; R480-V482 PolarHBondContact O-N 3.07Å
483	K	91	Very high	89.6	Confident	176 Å²	176	54.5 Å²	54.5	77%	0.765	28%	0.28	S	S	*	.	H	α-helix	trans	-68.3	-45.9	-176.8	-177.4	-176.1	174	-172	0	112.7	A479 R480	A479-K483 VanDerWaalsContact O-CB 3.29Å; A479-K483 WeakPolarHBondContact O-CB 3.47Å; A479-K483 PolarHBondContact O-N 3.09Å; R480-K483 PolarHBondContact O-N 3.41Å
484	D	86.9	Confident	89.4	Confident	93 Å²	93	57.3 Å²	57.3	50%	0.497	29%	0.294	S	S	.	.	H	α-helix	trans	-92.3	-6.2	-173.9	-58.2	-26.8	0	0	0	111.7	R480 N486	R480-D484 WeakPolarHBondContact O-CB 3.43Å; R480-D484 PolarHBondContact O-N 2.89Å; D484-N486 HydrophobicContact CB-CB 4.33Å; D484-N486 PolarHBondContact O-N 3.39Å; D484-N486 VanDerWaalsContact O-N 3.15Å
485	N	85.4	Confident	89.1	Confident	143 Å²	143	61.3 Å²	61.3	77%	0.765	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	35.3	-174.1	-162.6	39.1	0	0	0	112.7	Q481	Q481-N485 WeakPolarHBondContact O-CA 3.49Å; Q481-N485 PolarHBondContact O-N 2.96Å
486	N	85.9	Confident	88.6	Confident	41 Å²	41	62.7 Å²	62.7	22%	0.219	31%	0.311	C	S	.	.			trans	-109.3	109.3	-177.8	-176.5	-2.3	0	0	0	109.6	Q481 D484 F488 L489	Q481-N486 WeakPolarHBondContact CG-O 3.18Å; Q481-N486 PolarHBondContact O-N 3.19Å; D484-N486 HydrophobicContact CB-CB 4.33Å; D484-N486 PolarHBondContact O-N 3.39Å; D484-N486 VanDerWaalsContact O-N 3.15Å; N486-F488 PolarHBondContact O-N 2.89Å; N486-F488 VanDerWaalsContact OD1-CB 3.32Å; N486-F488 WeakPolarHBondContact OD1-CB 3.27Å; N486-F488 WeakPolarHBondContact OD1-CD2 3.48Å; N486-F488 WeakPolarHBondContact OD1-CG 3.25Å; N486-F488 PolarHBondContact OD1-N 3.22Å; N486-L489 HydrophobicContact CB-CD1 4.38Å; N486-L489 HydrophobicContact CB-CG 4.25Å
487	P	85.6	Confident	88.2	Confident	34 Å²	34	65 Å²	65	22%	0.221	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-6.1	-178.7	31.4	-34.4	0	0	0	113.5	M151 A428 Q481 L489	M151-P487 HydrophobicContact CE-CB 3.81Å; M151-P487 HydrophobicContact CG-CB 4.03Å; M151-P487 HydrophobicContact CG-CG 4.13Å; M151-P487 HydrophobicContact SD-CB 3.67Å; M151-P487 HydrophobicContact SD-CG 4.42Å; A428-P487 HydrophobicContact CB-CB 4.01Å; Q481-P487 PolarHBondContact NE2-O 3.34Å; P487-L489 VanDerWaalsContact C-N 3.33Å
488	F	89.4	Confident	87.9	Confident	39 Å²	39	67 Å²	67	17%	0.171	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	0.5	-175.2	-46.5	-41.2	0	0	0	113.5	E153 Y420 N486 G490 M501	E153-F488 WeakPolarHBondContact OE1-CZ 3.47Å; Y420-F488 HydrophobicContact CD2-CB 4.26Å; Y420-F488 AromaticContact CD2-CD1 3.19Å; Y420-F488 HydrophobicContact CD2-CD1 3.19Å; Y420-F488 AromaticContact CD2-CE1 3.5Å; Y420-F488 HydrophobicContact CD2-CE1 3.5Å; Y420-F488 AromaticContact CD2-CG 3.76Å; Y420-F488 HydrophobicContact CD2-CG 3.76Å; Y420-F488 HydrophobicContact CD2-CZ 4.31Å; Y420-F488 AromaticContact CE2-CD1 3.75Å; Y420-F488 HydrophobicContact CE2-CD1 3.75Å; Y420-F488 HydrophobicContact CE2-CD2 4.46Å; Y420-F488 AromaticContact CE2-CE1 3.71Å; Y420-F488 HydrophobicContact CE2-CE1 3.71Å; Y420-F488 HydrophobicContact CE2-CE2 4.45Å; Y420-F488 HydrophobicContact CE2-CG 4.12Å; Y420-F488 HydrophobicContact CE2-CZ 4.08Å; Y420-F488 HydrophobicContact CG-CB 4.49Å; Y420-F488 HydrophobicContact CG-CD1 4.09Å; Y420-F488 HydrophobicContact CG-CG 4.46Å; N486-F488 PolarHBondContact O-N 2.89Å; N486-F488 VanDerWaalsContact OD1-CB 3.32Å; N486-F488 WeakPolarHBondContact OD1-CB 3.27Å; N486-F488 WeakPolarHBondContact OD1-CD2 3.48Å; N486-F488 WeakPolarHBondContact OD1-CG 3.25Å; N486-F488 PolarHBondContact OD1-N 3.22Å; F488-G490 PolarHBondContact O-N 3.09Å; F488-M501 VanDerWaalsContact O-CB 3.31Å; F488-M501 WeakPolarHBondContact O-CB 3.38Å; F488-M501 WeakPolarHBondContact O-CG 3.26Å; F488-M501 PolarHBondContact O-N 3.35Å
489	L	90.9	Very high	87.6	Confident	15 Å²	15	64.5 Å²	64.5	8%	0.079	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-80	115.7	179	-57.9	177.9	0	0	0	110.3	A424 V477 R480 Q481 N486 P487 N499 D500	A424-L489 WeakPolarHBondContact CA-O 3.48Å; A424-L489 WeakPolarHBondContact CB-O 3.48Å; V477-L489 HydrophobicContact CG1-CB 4.29Å; V477-L489 VanDerWaalsContact CG1-O 3.27Å; V477-L489 WeakPolarHBondContact CG1-O 3.5Å; R480-L489 HydrophobicContact CB-CD1 3.66Å; Q481-L489 HydrophobicContact CG-CB 3.85Å; Q481-L489 HydrophobicContact CG-CD1 4.49Å; Q481-L489 PolarHBondContact NE2-O 3.34Å; N486-L489 HydrophobicContact CB-CD1 4.38Å; N486-L489 HydrophobicContact CB-CG 4.25Å; P487-L489 VanDerWaalsContact C-N 3.33Å; L489-N499 CarbonylContact C-O 3.49Å; L489-N499 WeakPolarHBondContact CA-O 3.47Å; L489-N499 HydrophobicContact CD2-CB 4.41Å; L489-D500 HydrophobicContact CD2-CB 4.16Å
490	G	91.2	Very high	87.6	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.315	C	S	.	.			trans	-123.5	-163.4	179.3	0	0	0	0	0	113	F488 N499	F488-G490 PolarHBondContact O-N 3.09Å; G490-N499 PolarHBondContact N-O 3.3Å; G490-N499 WeakPolarHBondContact O-CB 3.35Å; G490-N499 PolarHBondContact O-ND2 2.99Å
491	I	91.3	Very high	87.6	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.01	30%	0.297	C	S	.	.			trans	-91.7	126	-179.5	-65.1	174.4	0	0	0	109.8	G422 P459 L462 A463 L468 T473 C493	G422-I491 PolarHBondContact O-N 2.98Å; P459-I491 VanDerWaalsContact CA-CD1 3.45Å; P459-I491 HydrophobicContact CB-CD1 3.31Å; P459-I491 HydrophobicContact CB-CG1 4.3Å; P459-I491 WeakPolarHBondContact O-CD1 3.34Å; L462-I491 HydrophobicContact CB-CD1 4.48Å; A463-I491 HydrophobicContact CB-CD1 4.12Å; A463-I491 HydrophobicContact CB-CG2 4.23Å; L468-I491 HydrophobicContact CD1-CG2 4.16Å; T473-I491 HydrophobicContact CG2-CG1 4.25Å; T473-I491 HydrophobicContact CG2-CG2 4.25Å; I491-C493 PolarHBondContact O-N 3.18Å
492	D	89	Confident	87.5	Confident	13 Å²	13	61.4 Å²	61.4	7%	0.07	31%	0.312	C	S	.	.			trans	-77.7	85.1	176.8	-174.5	10.8	0	0	0	110.9	L494 H495 K496 N497 T498 Q504	D492-L494 VanDerWaalsContact C-N 3.26Å; D492-L494 PolarHBondContact O-N 3.3Å; D492-L494 PolarHBondContact OD1-N 2.96Å; D492-H495 PolarHBondContact OD1-N 3.43Å; D492-H495 VanDerWaalsContact OD1-N 3.09Å; D492-K496 VanDerWaalsContact CG-N 3.32Å; D492-K496 PolarHBondContact OD1-N 2.83Å; D492-K496 PolarHBondContact OD2-N 3.47Å; D492-N497 WeakPolarHBondContact OD2-CA 3.5Å; D492-N497 PolarHBondContact OD2-N 3.4Å; D492-T498 PolarHBondContact OD2-N 3.43Å; D492-Q504 PolarHBondContact OD1-NE2 3.16Å
493	C	86.2	Confident	87.3	Confident	8 Å²	8	63.1 Å²	63.1	5%	0.054	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-22	179.1	-58.5	0	0	0	0	112.5	P54 N55 S466 I491	P54-C493 HydrophobicContact CG-CB 3.54Å; N55-C493 PolarHBondContact ND2-O 3.18Å; S466-C493 WeakPolarHBondContact OG-CA 3.34Å; S466-C493 WeakPolarHBondContact OG-CB 3.43Å; I491-C493 PolarHBondContact O-N 3.18Å
494	L	85.1	Confident	87.1	Confident	80 Å²	80	55.4 Å²	55.4	42%	0.419	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	4.2	-174.4	-63.4	176.2	0	0	0	113.2	P54 D492 K496	P54-L494 HydrophobicContact CB-CD2 4.33Å; P54-L494 HydrophobicContact CG-CD2 4.43Å; D492-L494 VanDerWaalsContact C-N 3.26Å; D492-L494 PolarHBondContact O-N 3.3Å; D492-L494 PolarHBondContact OD1-N 2.96Å; L494-K496 VanDerWaalsContact C-N 3.27Å; L494-K496 HydrophobicContact CB-CD 4.26Å; L494-K496 HydrophobicContact CB-CG 4.03Å; L494-K496 HydrophobicContact CD1-CD 4.46Å; L494-K496 PolarHBondContact O-N 3.37Å
495	H	85.3	Confident	87.1	Confident	106 Å²	106	55.3 Å²	55.3	49%	0.491	28%	0.277	S	S	.	.			trans	54.4	39.7	-178.3	-57.3	-81.4	0	0	0	113.2	S466 D492 N497	S466-H495 PolarHBondContact O-NE2 2.77Å; D492-H495 PolarHBondContact OD1-N 3.43Å; D492-H495 VanDerWaalsContact OD1-N 3.09Å; H495-N497 PolarHBondContact O-N 2.83Å
496	K	80.3	Confident	87.4	Confident	110 Å²	110	49.8 Å²	49.8	48%	0.478	25%	0.249	S	C	.	.			trans	-80.9	2.9	177.3	-68.9	-180	179.1	173.8	0	113.7	D492 L494 T498 Q504	D492-K496 VanDerWaalsContact CG-N 3.32Å; D492-K496 PolarHBondContact OD1-N 2.83Å; D492-K496 PolarHBondContact OD2-N 3.47Å; L494-K496 VanDerWaalsContact C-N 3.27Å; L494-K496 HydrophobicContact CB-CD 4.26Å; L494-K496 HydrophobicContact CB-CG 4.03Å; L494-K496 HydrophobicContact CD1-CD 4.46Å; L494-K496 PolarHBondContact O-N 3.37Å; K496-T498 PolarHBondContact O-N 3.31Å; K496-Q504 HydrophobicContact CD-CG 4.45Å
497	N	82.6	Confident	87.6	Confident	156 Å²	156	48 Å²	48	83%	0.834	24%	0.239	S	C	*	.	S	Bend	trans	60.5	24.4	-177.3	-62.2	-47.7	0	0	0	114.4	D492 H495	D492-N497 WeakPolarHBondContact OD2-CA 3.5Å; D492-N497 PolarHBondContact OD2-N 3.4Å; H495-N497 PolarHBondContact O-N 2.83Å
498	T	83.7	Confident	87.8	Confident	47 Å²	47	48.6 Å²	48.6	29%	0.288	24%	0.239	S	C	.	.			trans	-138.1	128.4	-178.5	-61	0	0	0	0	109.6	D492 K496 D500 Q503 Q504	D492-T498 PolarHBondContact OD2-N 3.43Å; K496-T498 PolarHBondContact O-N 3.31Å; T498-D500 HydrophobicContact CG2-CB 3.97Å; T498-Q503 HydrophobicContact CG2-CB 4.34Å; T498-Q504 PolarHBondContact O-NE2 3.43Å
499	N	85.7	Confident	87.9	Confident	29 Å²	29	47.1 Å²	47.1	16%	0.155	23%	0.233	C	C	.	.			trans	-89.2	-7.9	178.3	-66.9	93.8	0	0	0	113.6	V477 R480 L489 G490 M501	V477-N499 WeakPolarHBondContact CG2-ND2 3.31Å; R480-N499 PolarHBondContact NH1-OD1 3.49Å; L489-N499 CarbonylContact C-O 3.49Å; L489-N499 WeakPolarHBondContact CA-O 3.47Å; L489-N499 HydrophobicContact CD2-CB 4.41Å; G490-N499 PolarHBondContact N-O 3.3Å; G490-N499 WeakPolarHBondContact O-CB 3.35Å; G490-N499 PolarHBondContact O-ND2 2.99Å; N499-M501 WeakPolarHBondContact O-CE 3.3Å; N499-M501 PolarHBondContact O-N 3.44Å
500	D	90.1	Very high	88	Confident	23 Å²	23	46.5 Å²	46.5	12%	0.123	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-76.7	108.6	-178.5	-172	-9.2	0	0	0	111.5	L489 T498 K502 Q503 Q504	L489-D500 HydrophobicContact CD2-CB 4.16Å; T498-D500 HydrophobicContact CG2-CB 3.97Å; D500-K502 PolarHBondContact O-N 3.01Å; D500-K502 VanDerWaalsContact OD1-CB 3.26Å; D500-K502 WeakPolarHBondContact OD1-CB 3.42Å; D500-K502 PolarHBondContact OD1-N 2.91Å; D500-Q503 HydrophobicContact CB-CB 4.22Å; D500-Q503 HydrophobicContact CB-CG 4.06Å; D500-Q503 PolarHBondContact O-N 3.01Å; D500-Q503 WeakPolarHBondContact OD2-CG 3.47Å; D500-Q503 PolarHBondContact OD2-NE2 3.18Å; D500-Q504 WeakPolarHBondContact O-CG 3.43Å; D500-Q504 PolarHBondContact O-N 3Å
501	M	90.8	Very high	88.1	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-67.6	-23	-177.8	-64.7	-61.4	100.8	0	0	112.5	Y420 G421 A424 F488 N499 Q504 H505 V506	Y420-M501 HydrophobicContact CD1-CB 4.46Å; Y420-M501 HydrophobicContact CG-CB 4.5Å; G421-M501 WeakPolarHBondContact O-CG 3.49Å; A424-M501 HydrophobicContact CB-CG 3.95Å; F488-M501 VanDerWaalsContact O-CB 3.31Å; F488-M501 WeakPolarHBondContact O-CB 3.38Å; F488-M501 WeakPolarHBondContact O-CG 3.26Å; F488-M501 PolarHBondContact O-N 3.35Å; N499-M501 WeakPolarHBondContact O-CE 3.3Å; N499-M501 PolarHBondContact O-N 3.44Å; M501-Q504 HydrophobicContact CE-CG 4.13Å; M501-Q504 PolarHBondContact O-N 3.31Å; M501-H505 PolarHBondContact O-N 3.44Å; M501-V506 HydrophobicContact CB-CB 4.3Å; M501-V506 PolarHBondContact O-N 3.48Å; M501-V506 HydrophobicContact SD-CB 3.95Å; M501-V506 HydrophobicContact SD-CG1 4.29Å; M501-V506 HydrophobicContact SD-CG2 4.02Å
502	K	89	Confident	88.1	Confident	83 Å²	83	49.5 Å²	49.5	36%	0.361	25%	0.247	S	C	.	.	H	α-helix	trans	-67.8	-42.8	173	-175.9	165.4	-168.2	157.9	0	111.6	E153 Y420 D500 Q504 H505	E153-K502 IonicContact OE1-NZ 2.92Å; E153-K502 PolarHBondContact OE1-NZ 3.15Å; E153-K502 IonicContact OE2-NZ 3.01Å; E153-K502 PolarHBondContact OE2-NZ 2.86Å; Y420-K502 HydrophobicContact CD1-CB 4.1Å; Y420-K502 VanDerWaalsContact CE1-CA 3.47Å; Y420-K502 HydrophobicContact CE1-CB 3.65Å; Y420-K502 HydrophobicContact CE1-CD 4.43Å; Y420-K502 HydrophobicContact CE1-CG 3.81Å; Y420-K502 HydrophobicContact CE2-CB 4.31Å; Y420-K502 HydrophobicContact CE2-CD 4.2Å; Y420-K502 HydrophobicContact CE2-CG 4.42Å; Y420-K502 VanDerWaalsContact OH-CD 3.28Å; Y420-K502 WeakPolarHBondContact OH-CD 3.44Å; Y420-K502 WeakPolarHBondContact OH-CE 3.36Å; Y420-K502 WeakPolarHBondContact OH-CG 3.47Å; D500-K502 PolarHBondContact O-N 3.01Å; D500-K502 VanDerWaalsContact OD1-CB 3.26Å; D500-K502 WeakPolarHBondContact OD1-CB 3.42Å; D500-K502 PolarHBondContact OD1-N 2.91Å; K502-Q504 VanDerWaalsContact C-N 3.34Å; K502-H505 PolarHBondContact O-N 2.96Å
503	Q	88.1	Confident	88.3	Confident	126 Å²	126	49.6 Å²	49.6	59%	0.589	25%	0.247	S	C	*	.	H	α-helix	trans	-71.5	-31.6	175.6	-64.8	176.8	33	0	0	112	T498 D500 H505	T498-Q503 HydrophobicContact CG2-CB 4.34Å; D500-Q503 HydrophobicContact CB-CB 4.22Å; D500-Q503 HydrophobicContact CB-CG 4.06Å; D500-Q503 PolarHBondContact O-N 3.01Å; D500-Q503 WeakPolarHBondContact OD2-CG 3.47Å; D500-Q503 PolarHBondContact OD2-NE2 3.18Å; Q503-H505 VanDerWaalsContact C-N 3.26Å; Q503-H505 PolarHBondContact O-CD2 2.85Å; Q503-H505 PolarHBondContact O-N 2.85Å
504	Q	86.6	Confident	88.7	Confident	15 Å²	15	51 Å²	51	7%	0.07	25%	0.252	C	S	.	.	H	α-helix	trans	-77.1	-10.6	175.1	-66	-143.8	18.5	0	0	114.2	D492 K496 T498 D500 M501 K502 V506	D492-Q504 PolarHBondContact OD1-NE2 3.16Å; K496-Q504 HydrophobicContact CD-CG 4.45Å; T498-Q504 PolarHBondContact O-NE2 3.43Å; D500-Q504 WeakPolarHBondContact O-CG 3.43Å; D500-Q504 PolarHBondContact O-N 3Å; M501-Q504 HydrophobicContact CE-CG 4.13Å; M501-Q504 PolarHBondContact O-N 3.31Å; K502-Q504 VanDerWaalsContact C-N 3.34Å; Q504-V506 VanDerWaalsContact C-N 3.3Å; Q504-V506 HydrophobicContact CB-CG2 3.9Å; Q504-V506 PolarHBondContact O-N 2.77Å
505	H	87.6	Confident	89.1	Confident	90 Å²	90	49.7 Å²	49.7	42%	0.417	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	34.8	-173	-57.7	-83.7	0	0	0	113.9	Q167 T171 M501 K502 Q503 I507	Q167-H505 PolarHBondContact OE1-ND1 3.24Å; T171-H505 PolarHBondContact OG1-O 3.38Å; M501-H505 PolarHBondContact O-N 3.44Å; K502-H505 PolarHBondContact O-N 2.96Å; Q503-H505 VanDerWaalsContact C-N 3.26Å; Q503-H505 PolarHBondContact O-CD2 2.85Å; Q503-H505 PolarHBondContact O-N 2.85Å; H505-I507 PolarHBondContact O-N 2.82Å
506	V	90.3	Very high	89.6	Confident	28 Å²	28	45.1 Å²	45.1	17%	0.17	22%	0.223	C	C	.	.			trans	-87.9	95.9	175.3	-179.4	0	0	0	0	108.5	T171 G421 M501 Q504	T171-V506 HydrophobicContact CG2-CG1 4.01Å; G421-V506 PolarHBondContact N-O 3Å; G421-V506 VanDerWaalsContact N-O 3.17Å; M501-V506 HydrophobicContact CB-CB 4.3Å; M501-V506 PolarHBondContact O-N 3.48Å; M501-V506 HydrophobicContact SD-CB 3.95Å; M501-V506 HydrophobicContact SD-CG1 4.29Å; M501-V506 HydrophobicContact SD-CG2 4.02Å; Q504-V506 VanDerWaalsContact C-N 3.3Å; Q504-V506 HydrophobicContact CB-CG2 3.9Å; Q504-V506 PolarHBondContact O-N 2.77Å
507	I	90.4	Very high	90.3	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	134.8	-170.2	-58.3	152.1	0	0	0	109.4	F155 Q167 T168 T171 V418 Y420 H505	F155-I507 HydrophobicContact CE2-CD1 3.89Å; F155-I507 HydrophobicContact CE2-CG1 4.37Å; F155-I507 HydrophobicContact CE2-CG2 4.18Å; Q167-I507 HydrophobicContact CB-CD1 4.1Å; T168-I507 HydrophobicContact CG2-CB 4.36Å; T168-I507 HydrophobicContact CG2-CG2 4.04Å; T171-I507 PolarHBondContact OG1-N 2.65Å; V418-I507 HydrophobicContact CB-CG2 3.67Å; V418-I507 HydrophobicContact CG1-CG2 3.78Å; V418-I507 HydrophobicContact CG2-CG2 4.15Å; Y420-I507 HydrophobicContact CD1-CG1 4.34Å; Y420-I507 HydrophobicContact CE1-CG1 4.16Å; H505-I507 PolarHBondContact O-N 2.82Å
508	E	90.7	Very high	90.9	Very high	48 Å²	48	37.3 Å²	37.3	22%	0.224	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	158.4	174	-70.9	171.4	135.4	0	0	110	V418 V419 G421 K513	V418-E508 WeakPolarHBondContact CA-O 3.5Å; V419-E508 HydrophobicContact CG2-CB 4.43Å; V419-E508 PolarHBondContact N-O 3.46Å; V419-E508 PolarHBondContact O-N 2.93Å; V419-E508 VanDerWaalsContact O-O 3.09Å; G421-E508 WeakPolarHBondContact CA-OE2 3.15Å; E508-K513 WeakPolarHBondContact OE1-CE 3.43Å; E508-K513 IonicContact OE1-NZ 2.64Å; E508-K513 PolarHBondContact OE1-NZ 3.49Å; E508-K513 WeakPolarHBondContact OE2-CE 3.44Å; E508-K513 IonicContact OE2-NZ 3.39Å; E508-K513 PolarHBondContact OE2-NZ 3.05Å; E508-K513 VanDerWaalsContact OE2-NZ 3.14Å
509	T	91.9	Very high	91.4	Very high	8 Å²	8	36.4 Å²	36.4	5%	0.049	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	138.4	178.4	61	0	0	0	0	110.7	V408 N411 L412 I511 G512 K513	V408-T509 HydrophobicContact CG1-CG2 3.91Å; N411-T509 HydrophobicContact CB-CG2 3.99Å; L412-T509 HydrophobicContact CD2-CG2 3.73Å; L412-T509 HydrophobicContact CG-CG2 3.83Å; T509-I511 VanDerWaalsContact C-N 3.29Å; T509-I511 PolarHBondContact O-N 2.71Å; T509-G512 PolarHBondContact O-N 3.09Å; T509-G512 PolarHBondContact OG1-N 2.88Å; T509-K513 PolarHBondContact O-N 3.38Å
510	L	93.1	Very high	91.9	Very high	1 Å²	1	35 Å²	35	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-60.1	-43.3	176.8	175.4	65.8	0	0	0	111.2	L148 A152 R417 V419 G512 K513 K514	L148-L510 HydrophobicContact CB-CD1 3.7Å; A152-L510 HydrophobicContact CB-CD1 4.18Å; A152-L510 HydrophobicContact CB-CD2 3.8Å; A152-L510 HydrophobicContact CB-CG 4.42Å; R417-L510 HydrophobicContact CB-CB 4.01Å; R417-L510 HydrophobicContact CB-CD2 3.73Å; R417-L510 HydrophobicContact CG-CD2 4.48Å; R417-L510 VanDerWaalsContact CZ-CD2 3.5Å; R417-L510 WeakPolarHBondContact O-CB 3.44Å; R417-L510 PolarHBondContact O-N 3.21Å; R417-L510 VanDerWaalsContact O-N 3.1Å; V419-L510 HydrophobicContact CG1-CB 4.32Å; V419-L510 HydrophobicContact CG1-CD1 3.65Å; L510-G512 VanDerWaalsContact C-N 3.29Å; L510-G512 PolarHBondContact O-N 2.98Å; L510-K513 PolarHBondContact O-N 3.44Å; L510-K514 HydrophobicContact CD1-CD 4.39Å; L510-K514 HydrophobicContact CD1-CG 4.2Å; L510-K514 HydrophobicContact CG-CD 4.25Å; L510-K514 HydrophobicContact CG-CG 4.41Å; L510-K514 WeakPolarHBondContact O-CG 3.46Å; L510-K514 PolarHBondContact O-N 2.76Å
511	I	92.3	Very high	92.2	Very high	57 Å²	57	34 Å²	34	29%	0.292	16%	0.162	S	C	.	.	H	α-helix	trans	-59.6	-41.3	179.7	-166.8	170.6	0	0	0	111.4	I102 N411 T509 K514 Q515	I102-I511 HydrophobicContact CD1-CG1 4.1Å; I102-I511 HydrophobicContact CD1-CG2 4.27Å; N411-I511 HydrophobicContact CB-CG2 3.73Å; T509-I511 VanDerWaalsContact C-N 3.29Å; T509-I511 PolarHBondContact O-N 2.71Å; I511-K514 PolarHBondContact O-N 3.41Å; I511-Q515 WeakPolarHBondContact O-CB 3.15Å; I511-Q515 PolarHBondContact O-N 3.13Å
512	G	91.9	Very high	92.4	Very high	8 Å²	8	36.8 Å²	36.8	8%	0.082	18%	0.175	C	C	.	.	H	α-helix	trans	-61.4	-47.2	177.3	0	0	0	0	0	112.6	T509 L510 Q515 Q516	T509-G512 PolarHBondContact O-N 3.09Å; T509-G512 PolarHBondContact OG1-N 2.88Å; L510-G512 VanDerWaalsContact C-N 3.29Å; L510-G512 PolarHBondContact O-N 2.98Å; G512-Q515 PolarHBondContact O-N 3.13Å; G512-Q516 WeakPolarHBondContact O-CB 3.38Å; G512-Q516 PolarHBondContact O-N 3.44Å
513	K	92.8	Very high	92.6	Very high	15 Å²	15	33.7 Å²	33.7	7%	0.065	16%	0.163	C	C	.	.	H	α-helix	trans	-66.1	-41	178.6	-78	-66.9	178.5	-169.1	0	113.8	L148 V419 E426 E508 T509 L510 Q515 Q516 I517	L148-K513 HydrophobicContact CD1-CB 4.01Å; V419-K513 HydrophobicContact CG2-CB 4.27Å; V419-K513 HydrophobicContact CG2-CG 3.82Å; E426-K513 WeakPolarHBondContact OE1-CE 3.42Å; E426-K513 IonicContact OE1-NZ 2.85Å; E426-K513 PolarHBondContact OE1-NZ 3.41Å; E508-K513 WeakPolarHBondContact OE1-CE 3.43Å; E508-K513 IonicContact OE1-NZ 2.64Å; E508-K513 PolarHBondContact OE1-NZ 3.49Å; E508-K513 WeakPolarHBondContact OE2-CE 3.44Å; E508-K513 IonicContact OE2-NZ 3.39Å; E508-K513 PolarHBondContact OE2-NZ 3.05Å; E508-K513 VanDerWaalsContact OE2-NZ 3.14Å; T509-K513 PolarHBondContact O-N 3.38Å; L510-K513 PolarHBondContact O-N 3.44Å; K513-Q515 VanDerWaalsContact C-N 3.34Å; K513-Q516 PolarHBondContact O-N 3.06Å; K513-I517 PolarHBondContact O-N 2.97Å; K513-I517 VanDerWaalsContact O-N 3.14Å
514	K	94.2	Very high	92.9	Very high	38 Å²	38	27.8 Å²	27.8	17%	0.165	14%	0.136	C	C	.	.	H	α-helix	trans	-61.3	-46	175.3	-73.2	-173.3	177.5	-168.7	0	111.6	I145 L148 D149 L510 I511 Q516 I517 F518	I145-K514 HydrophobicContact CG2-CD 3.89Å; I145-K514 HydrophobicContact CG2-CG 4.03Å; L148-K514 HydrophobicContact CD1-CG 4.31Å; D149-K514 VanDerWaalsContact CG-CE 3.49Å; D149-K514 VanDerWaalsContact OD1-CE 3.28Å; D149-K514 WeakPolarHBondContact OD1-CE 3.47Å; D149-K514 IonicContact OD1-NZ 3.73Å; D149-K514 PolarHBondContact OD1-NZ 3.15Å; D149-K514 WeakPolarHBondContact OD2-CE 3.11Å; D149-K514 IonicContact OD2-NZ 3.54Å; D149-K514 PolarHBondContact OD2-NZ 3.24Å; L510-K514 HydrophobicContact CD1-CD 4.39Å; L510-K514 HydrophobicContact CD1-CG 4.2Å; L510-K514 HydrophobicContact CG-CD 4.25Å; L510-K514 HydrophobicContact CG-CG 4.41Å; L510-K514 WeakPolarHBondContact O-CG 3.46Å; L510-K514 PolarHBondContact O-N 2.76Å; I511-K514 PolarHBondContact O-N 3.41Å; K514-Q516 VanDerWaalsContact C-N 3.33Å; K514-Q516 PolarHBondContact O-N 3.13Å; K514-I517 PolarHBondContact O-N 3.31Å; K514-F518 VanDerWaalsContact O-CB 3.29Å; K514-F518 WeakPolarHBondContact O-CB 3.33Å; K514-F518 PolarHBondContact O-N 2.77Å
515	Q	94.4	Very high	93.3	Very high	52 Å²	52	30.4 Å²	30.4	24%	0.243	15%	0.147	C	C	.	.	H	α-helix	trans	-63.5	-41.7	-179.7	-167.5	64	13.7	0	0	111	I102 I511 G512 K513 I517 F518 L519	I102-Q515 HydrophobicContact CD1-CB 4.1Å; I102-Q515 HydrophobicContact CD1-CG 4.34Å; I102-Q515 HydrophobicContact CG1-CB 3.92Å; I102-Q515 HydrophobicContact CG1-CG 3.96Å; I511-Q515 WeakPolarHBondContact O-CB 3.15Å; I511-Q515 PolarHBondContact O-N 3.13Å; G512-Q515 PolarHBondContact O-N 3.13Å; K513-Q515 VanDerWaalsContact C-N 3.34Å; Q515-I517 PolarHBondContact O-N 3.27Å; Q515-F518 PolarHBondContact O-N 2.86Å; Q515-L519 HydrophobicContact CG-CD1 3.78Å; Q515-L519 HydrophobicContact CG-CG 4.04Å; Q515-L519 WeakPolarHBondContact O-CB 3.44Å; Q515-L519 WeakPolarHBondContact O-CG 3.49Å; Q515-L519 PolarHBondContact O-N 2.69Å
516	Q	94.6	Very high	93.6	Very high	10 Å²	10	31.2 Å²	31.2	5%	0.047	15%	0.152	C	C	.	.	H	α-helix	trans	-57.7	-49.5	176.1	178.7	170.6	66.5	0	0	112.5	G105 G108 V109 G512 K513 K514 A520	G105-Q516 PolarHBondContact O-NE2 3.26Å; G105-Q516 VanDerWaalsContact O-NE2 3.1Å; G108-Q516 VanDerWaalsContact CA-NE2 3.27Å; V109-Q516 HydrophobicContact CB-CG 3.95Å; V109-Q516 HydrophobicContact CG2-CG 4.34Å; V109-Q516 VanDerWaalsContact N-NE2 3.13Å; G512-Q516 WeakPolarHBondContact O-CB 3.38Å; G512-Q516 PolarHBondContact O-N 3.44Å; K513-Q516 PolarHBondContact O-N 3.06Å; K514-Q516 VanDerWaalsContact C-N 3.33Å; K514-Q516 PolarHBondContact O-N 3.13Å; Q516-A520 VanDerWaalsContact O-CB 3.26Å; Q516-A520 WeakPolarHBondContact O-CB 3.48Å; Q516-A520 PolarHBondContact O-N 2.98Å; Q516-A520 VanDerWaalsContact O-N 3.11Å
517	I	95.3	Very high	93.7	Very high	9 Å²	9	29.9 Å²	29.9	5%	0.046	14%	0.144	C	C	.	.	H	α-helix	trans	-65.1	-43	178.4	-65.5	177.2	0	0	0	110.9	L112 A141 A144 L148 F451 L455 K513 K514 Q515 T521	L112-I517 HydrophobicContact CD2-CG1 4.21Å; A141-I517 HydrophobicContact CB-CG2 4.11Å; A144-I517 HydrophobicContact CB-CD1 4.22Å; L148-I517 HydrophobicContact CD1-CD1 3.77Å; F451-I517 HydrophobicContact CZ-CG2 3.93Å; L455-I517 HydrophobicContact CD2-CD1 4.48Å; K513-I517 PolarHBondContact O-N 2.97Å; K513-I517 VanDerWaalsContact O-N 3.14Å; K514-I517 PolarHBondContact O-N 3.31Å; Q515-I517 PolarHBondContact O-N 3.27Å; I517-T521 WeakPolarHBondContact O-CB 3.35Å; I517-T521 PolarHBondContact O-N 3.34Å; I517-T521 VanDerWaalsContact O-N 3.12Å; I517-T521 PolarHBondContact O-OG1 2.74Å
518	F	95.4	Very high	93.8	Very high	94 Å²	94	30.1 Å²	30.1	41%	0.412	15%	0.145	S	C	.	.	H	α-helix	trans	-64	-52.5	-178.6	-179.1	-102.9	0	0	0	111.9	I145 K514 Q515 T521 Q522	I145-F518 HydrophobicContact CD1-CB 4.4Å; K514-F518 VanDerWaalsContact O-CB 3.29Å; K514-F518 WeakPolarHBondContact O-CB 3.33Å; K514-F518 PolarHBondContact O-N 2.77Å; Q515-F518 PolarHBondContact O-N 2.86Å; F518-T521 PolarHBondContact O-N 2.94Å; F518-Q522 HydrophobicContact CD1-CG 4.3Å; F518-Q522 HydrophobicContact CE1-CG 3.89Å; F518-Q522 HydrophobicContact CE2-CG 4.12Å; F518-Q522 HydrophobicContact CZ-CG 3.8Å; F518-Q522 WeakPolarHBondContact O-CG 3.29Å; F518-Q522 PolarHBondContact O-N 3.34Å
519	L	95.5	Very high	93.8	Very high	27 Å²	27	36 Å²	36	14%	0.141	17%	0.17	C	C	.	.	H	α-helix	trans	-63.3	-43.8	-178.8	-71.7	-179.1	0	0	0	112	L94 Q98 V109 Q515 T521 Q522 V523	L94-L519 HydrophobicContact CD1-CB 3.6Å; L94-L519 HydrophobicContact CD1-CD1 4.47Å; Q98-L519 HydrophobicContact CB-CD1 4.3Å; V109-L519 HydrophobicContact CG2-CB 4.14Å; Q515-L519 HydrophobicContact CG-CD1 3.78Å; Q515-L519 HydrophobicContact CG-CG 4.04Å; Q515-L519 WeakPolarHBondContact O-CB 3.44Å; Q515-L519 WeakPolarHBondContact O-CG 3.49Å; Q515-L519 PolarHBondContact O-N 2.69Å; L519-T521 VanDerWaalsContact C-N 3.31Å; L519-T521 PolarHBondContact O-N 3.21Å; L519-Q522 PolarHBondContact O-N 3.34Å; L519-V523 PolarHBondContact O-N 2.67Å
520	A	95.8	Very high	93.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-58.1	-45.4	176.2	0	0	0	0	0	111.4	V109 L112 A113 L116 Q516 V523 V524	V109-A520 HydrophobicContact CG2-CB 4.1Å; L112-A520 HydrophobicContact CB-CB 4.22Å; L112-A520 HydrophobicContact CD2-CB 3.89Å; L112-A520 HydrophobicContact CG-CB 3.95Å; A113-A520 HydrophobicContact CB-CB 4.03Å; L116-A520 HydrophobicContact CD1-CB 4.35Å; Q516-A520 VanDerWaalsContact O-CB 3.26Å; Q516-A520 WeakPolarHBondContact O-CB 3.48Å; Q516-A520 PolarHBondContact O-N 2.98Å; Q516-A520 VanDerWaalsContact O-N 3.11Å; A520-V523 PolarHBondContact O-N 2.99Å; A520-V524 VanDerWaalsContact O-CG2 3.23Å; A520-V524 WeakPolarHBondContact O-CG2 3.46Å; A520-V524 PolarHBondContact O-N 2.96Å
521	T	95.6	Very high	93.4	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.012	21%	0.209	C	C	.	.	H	α-helix	trans	-64.3	-42.9	178.7	-53.5	0	0	0	0	111.9	A141 I517 F518 L519 V524 K525	A141-T521 HydrophobicContact CB-CG2 4Å; I517-T521 WeakPolarHBondContact O-CB 3.35Å; I517-T521 PolarHBondContact O-N 3.34Å; I517-T521 VanDerWaalsContact O-N 3.12Å; I517-T521 PolarHBondContact O-OG1 2.74Å; F518-T521 PolarHBondContact O-N 2.94Å; L519-T521 VanDerWaalsContact C-N 3.31Å; L519-T521 PolarHBondContact O-N 3.21Å; T521-V524 PolarHBondContact O-N 3.37Å; T521-K525 WeakPolarHBondContact O-CB 3.48Å; T521-K525 PolarHBondContact O-N 3.38Å
522	Q	94.5	Very high	93	Very high	59 Å²	59	42.7 Å²	42.7	28%	0.276	21%	0.206	S	C	.	.	H	α-helix	trans	-63.9	-41.7	178.4	-71	-48	-60.6	0	0	112.3	D138 F518 L519 K525 M526	D138-Q522 PolarHBondContact OD1-NE2 2.87Å; F518-Q522 HydrophobicContact CD1-CG 4.3Å; F518-Q522 HydrophobicContact CE1-CG 3.89Å; F518-Q522 HydrophobicContact CE2-CG 4.12Å; F518-Q522 HydrophobicContact CZ-CG 3.8Å; F518-Q522 WeakPolarHBondContact O-CG 3.29Å; F518-Q522 PolarHBondContact O-N 3.34Å; L519-Q522 PolarHBondContact O-N 3.34Å; Q522-K525 WeakPolarHBondContact O-CB 3.33Å; Q522-K525 PolarHBondContact O-N 3.32Å; Q522-M526 WeakPolarHBondContact O-CG 3.29Å; Q522-M526 PolarHBondContact O-N 2.65Å
523	V	94.6	Very high	92.6	Very high	19 Å²	19	43.6 Å²	43.6	12%	0.115	21%	0.208	C	C	.	.	H	α-helix	trans	-65.5	-45.1	176.8	170.7	0	0	0	0	110.9	M91 L94 L519 A520 K525 M526 V527	M91-V523 HydrophobicContact SD-CG1 4.21Å; L94-V523 HydrophobicContact CB-CG2 4.1Å; L94-V523 HydrophobicContact CD1-CG2 3.69Å; L94-V523 HydrophobicContact CD2-CB 4.09Å; L94-V523 HydrophobicContact CD2-CG1 4.2Å; L94-V523 HydrophobicContact CD2-CG2 3.98Å; L94-V523 HydrophobicContact CG-CG2 4.12Å; L519-V523 PolarHBondContact O-N 2.67Å; A520-V523 PolarHBondContact O-N 2.99Å; V523-K525 VanDerWaalsContact C-N 3.26Å; V523-K525 PolarHBondContact O-N 3.31Å; V523-M526 WeakPolarHBondContact O-CA 3.44Å; V523-M526 WeakPolarHBondContact O-CB 3.42Å; V523-M526 PolarHBondContact O-N 3.43Å; V523-V527 HydrophobicContact CG1-CG2 4.24Å; V523-V527 WeakPolarHBondContact O-CG2 3.37Å; V523-V527 PolarHBondContact O-N 2.98Å
524	V	94.4	Very high	92	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.006	24%	0.236	C	C	.	.	H	α-helix	trans	-57	-42.5	175.9	172.4	0	0	0	0	111.4	A113 L116 L117 Y137 A520 T521 M526 V527 L528	A113-V524 HydrophobicContact CB-CG2 4.34Å; L116-V524 HydrophobicContact CB-CG1 4.39Å; L116-V524 HydrophobicContact CB-CG2 3.63Å; L116-V524 HydrophobicContact CD1-CG2 4.1Å; L117-V524 HydrophobicContact CD1-CG2 4.49Å; L117-V524 HydrophobicContact CD2-CB 4.37Å; L117-V524 HydrophobicContact CD2-CG1 3.89Å; L117-V524 HydrophobicContact CD2-CG2 4.27Å; L117-V524 HydrophobicContact CG-CB 4.5Å; L117-V524 HydrophobicContact CG-CG1 4.3Å; L117-V524 HydrophobicContact CG-CG2 3.86Å; Y137-V524 HydrophobicContact CD2-CG1 3.87Å; Y137-V524 HydrophobicContact CE2-CG1 3.89Å; A520-V524 VanDerWaalsContact O-CG2 3.23Å; A520-V524 WeakPolarHBondContact O-CG2 3.46Å; A520-V524 PolarHBondContact O-N 2.96Å; T521-V524 PolarHBondContact O-N 3.37Å; V524-M526 VanDerWaalsContact C-N 3.34Å; V524-M526 PolarHBondContact O-N 3.32Å; V524-V527 PolarHBondContact O-N 2.9Å; V524-L528 HydrophobicContact CG1-CD1 3.78Å; V524-L528 HydrophobicContact CG1-CG 4.17Å; V524-L528 WeakPolarHBondContact O-CB 3.24Å; V524-L528 VanDerWaalsContact O-CG 3.31Å; V524-L528 WeakPolarHBondContact O-CG 3.29Å; V524-L528 PolarHBondContact O-N 3.45Å
525	K	94.1	Very high	91.1	Very high	71 Å²	71	53.5 Å²	53.5	31%	0.309	25%	0.251	S	S	.	.	H	α-helix	trans	-59.9	-41.7	174.1	170.5	168.5	-164.4	172.2	0	112.9	S134 D138 T521 Q522 V523 K529	S134-K525 WeakPolarHBondContact OG-CB 2.85Å; S134-K525 WeakPolarHBondContact OG-CD 3.44Å; S134-K525 WeakPolarHBondContact OG-CG 3.4Å; D138-K525 IonicContact OD2-NZ 3.91Å; D138-K525 PolarHBondContact OD2-NZ 2.84Å; T521-K525 WeakPolarHBondContact O-CB 3.48Å; T521-K525 PolarHBondContact O-N 3.38Å; Q522-K525 WeakPolarHBondContact O-CB 3.33Å; Q522-K525 PolarHBondContact O-N 3.32Å; V523-K525 VanDerWaalsContact C-N 3.26Å; V523-K525 PolarHBondContact O-N 3.31Å; K525-K529 WeakPolarHBondContact O-CB 3.32Å; K525-K529 PolarHBondContact O-N 2.75Å
526	M	93.2	Very high	89.7	Confident	106 Å²	106	58.8 Å²	58.8	52%	0.522	28%	0.275	S	S	.	.	H	α-helix	trans	-63.5	-46.3	175.2	-71.7	177.5	62.9	0	0	111.4	Q522 V523 V524 K529 I530	Q522-M526 WeakPolarHBondContact O-CG 3.29Å; Q522-M526 PolarHBondContact O-N 2.65Å; V523-M526 WeakPolarHBondContact O-CA 3.44Å; V523-M526 WeakPolarHBondContact O-CB 3.42Å; V523-M526 PolarHBondContact O-N 3.43Å; V524-M526 VanDerWaalsContact C-N 3.34Å; V524-M526 PolarHBondContact O-N 3.32Å; M526-K529 PolarHBondContact O-N 3.43Å; M526-I530 WeakPolarHBondContact O-CG1 3.36Å
527	V	93	Very high	87.8	Confident	1 Å²	1	60 Å²	60	1%	0.006	29%	0.291	C	S	.	.	H	α-helix	trans	-63	-46.7	179.8	179	0	0	0	0	111.5	H37 I87 L117 V523 V524 K529 I530	H37-V527 HydrophobicContact CB-CG1 3.85Å; I87-V527 HydrophobicContact CD1-CB 4.47Å; I87-V527 HydrophobicContact CD1-CG1 4.05Å; I87-V527 HydrophobicContact CD1-CG2 4.04Å; I87-V527 HydrophobicContact CG1-CG1 4.48Å; I87-V527 HydrophobicContact CG2-CG1 4.19Å; I87-V527 HydrophobicContact CG2-CG2 3.94Å; L117-V527 HydrophobicContact CD2-CB 4.07Å; L117-V527 HydrophobicContact CD2-CG1 3.91Å; V523-V527 HydrophobicContact CG1-CG2 4.24Å; V523-V527 WeakPolarHBondContact O-CG2 3.37Å; V523-V527 PolarHBondContact O-N 2.98Å; V524-V527 PolarHBondContact O-N 2.9Å; V527-K529 PolarHBondContact O-N 3.4Å; V527-K529 VanDerWaalsContact O-N 3.14Å; V527-I530 PolarHBondContact O-N 2.96Å; V527-I530 VanDerWaalsContact O-N 3.08Å
528	L	91.8	Very high	85.6	Confident	6 Å²	6	68.2 Å²	68.2	3%	0.031	33%	0.329	C	S	.	.	H	α-helix	trans	-65.6	-16	-179.6	-70.6	177.3	0	0	0	113.9	A120 L124 P130 I133 V524	A120-L528 HydrophobicContact CB-CD1 4.27Å; A120-L528 HydrophobicContact CB-CD2 4.11Å; L124-L528 HydrophobicContact CD1-CD2 4.41Å; P130-L528 HydrophobicContact CB-CB 4.28Å; P130-L528 WeakPolarHBondContact CB-O 2.99Å; I133-L528 HydrophobicContact CB-CD1 4.39Å; I133-L528 HydrophobicContact CG2-CD1 4.09Å; V524-L528 HydrophobicContact CG1-CD1 3.78Å; V524-L528 HydrophobicContact CG1-CG 4.17Å; V524-L528 WeakPolarHBondContact O-CB 3.24Å; V524-L528 VanDerWaalsContact O-CG 3.31Å; V524-L528 WeakPolarHBondContact O-CG 3.29Å; V524-L528 PolarHBondContact O-N 3.45Å
529	K	91.1	Very high	82.9	Confident	173 Å²	173	68.4 Å²	68.4	75%	0.752	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-12.1	176.9	-168.8	172.2	177.2	-177.8	0	113	K525 M526 V527	K525-K529 WeakPolarHBondContact O-CB 3.32Å; K525-K529 PolarHBondContact O-N 2.75Å; M526-K529 PolarHBondContact O-N 3.43Å; V527-K529 PolarHBondContact O-N 3.4Å; V527-K529 VanDerWaalsContact O-N 3.14Å
530	I	89.8	Confident	80.1	Confident	63 Å²	63	74.9 Å²	74.9	32%	0.323	37%	0.372	S	S	.	.			trans	-95	107.5	-178.2	-57.9	166.7	0	0	0	108.8	L34 H37 I87 M526 V527	L34-I530 WeakPolarHBondContact CD2-O 3.26Å; H37-I530 WeakPolarHBondContact NE2-CG2 3.47Å; I87-I530 HydrophobicContact CD1-CD1 4.05Å; M526-I530 WeakPolarHBondContact O-CG1 3.36Å; V527-I530 PolarHBondContact O-N 2.96Å; V527-I530 VanDerWaalsContact O-N 3.08Å
531	D	86.8	Confident	77.2	Confident	100 Å²	100	85.8 Å²	85.8	54%	0.535	43%	0.43	S	S	.	.			trans	-113.7	-9.1	-177	71.7	-27.3	0	0	0	114.5	T29 G30	T29-D531 CarbonylContact C-O 3.52Å; T29-D531 WeakPolarHBondContact CA-O 3.49Å; G30-D531 PolarHBondContact N-O 3.25Å
532	D	85.2	Confident	76.3	Confident	43 Å²	43	90 Å²	90	23%	0.23	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	115.2	-179.1	-168.5	12.6	0	0	0	110.3	R27 R534	R27-D532 WeakPolarHBondContact CG-OD1 3.34Å; R27-D532 IonicContact CZ-OD1 3.73Å; R27-D532 IonicContact CZ-OD2 2.76Å; R27-D532 IonicContact NE-OD1 2.75Å; R27-D532 PolarHBondContact NE-OD1 3.07Å; R27-D532 IonicContact NE-OD2 2.78Å; R27-D532 PolarHBondContact NE-OD2 3.41Å; R27-D532 IonicContact NH2-OD1 3.84Å; R27-D532 IonicContact NH2-OD2 2.81Å; R27-D532 PolarHBondContact NH2-OD2 2.97Å; D532-R534 IonicContact OD1-NE 3.33Å; D532-R534 IonicContact OD2-CZ 2.7Å; D532-R534 VanDerWaalsContact OD2-CZ 3.31Å; D532-R534 IonicContact OD2-NE 2.78Å; D532-R534 PolarHBondContact OD2-NE 3.02Å; D532-R534 IonicContact OD2-NH2 3.8Å; D532-R534 PolarHBondContact OD2-NH2 2.7Å
533	I	81.9	Confident	75.3	Confident	27 Å²	27	91.6 Å²	91.6	14%	0.138	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	125.7	174.7	-52.1	167	0	0	0	108	R27 L28 A33 H37	R27-I533 WeakPolarHBondContact CA-O 3.37Å; L28-I533 HydrophobicContact CB-CB 4.32Å; L28-I533 HydrophobicContact CB-CD1 4.22Å; L28-I533 HydrophobicContact CD1-CD1 4.19Å; L28-I533 PolarHBondContact N-O 3.39Å; L28-I533 VanDerWaalsContact N-O 3.14Å; L28-I533 PolarHBondContact O-N 2.71Å; A33-I533 HydrophobicContact CB-CD1 3.88Å; A33-I533 HydrophobicContact CB-CG1 4.01Å; H37-I533 WeakPolarHBondContact CE1-CD1 3.14Å; H37-I533 WeakPolarHBondContact CE1-CG1 3.3Å
534	R	81.9	Confident	74.3	Confident	172 Å²	172	95.7 Å²	95.7	65%	0.649	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.6	103.5	175.9	-63.4	-177.3	-173.5	179.1	3.4	109.7	R27 D532	R27-R534 HydrophobicContact CG-CG 4.31Å; D532-R534 IonicContact OD1-NE 3.33Å; D532-R534 IonicContact OD2-CZ 2.7Å; D532-R534 VanDerWaalsContact OD2-CZ 3.31Å; D532-R534 IonicContact OD2-NE 2.78Å; D532-R534 PolarHBondContact OD2-NE 3.02Å; D532-R534 IonicContact OD2-NH2 3.8Å; D532-R534 PolarHBondContact OD2-NH2 2.7Å
535	N	73.9	Confident	73.1	Confident	88 Å²	88	101.2 Å²	101.2	47%	0.471	51%	0.507	S	S	.	.			trans	-86.4	118.3	171.2	-69.3	-15.9	0	0	0	108.3	K25 T26 G537	K25-N535 WeakPolarHBondContact CA-O 3.16Å; T26-N535 PolarHBondContact O-N 3.49Å; T26-N535 VanDerWaalsContact O-N 3.13Å; N535-G537 PolarHBondContact O-N 2.95Å
536	Q	65.1	Low	71.8	Confident	163 Å²	163	103.1 Å²	103.1	76%	0.762	52%	0.52	S	S	*	.			trans	-79.9	104.8	159.9	-63	-176.2	19.1	0	0	104.5	E538	Q536-E538 PolarHBondContact O-N 3.43Å
537	G	54.7	Low	70.4	Confident	37 Å²	37	102.9 Å²	102.9	38%	0.381	52%	0.52	S	S	.	.			trans	-49.3	133.4	173.9	0	0	0	0	0	109.1	K24 N535 S539	K24-G537 WeakPolarHBondContact O-CA 3.45Å; K24-G537 PolarHBondContact O-N 3.23Å; N535-G537 PolarHBondContact O-N 2.95Å; G537-S539 PolarHBondContact O-N 3.15Å
538	E	48.7	Very low	68.7	Low	180 Å²	180	110.2 Å²	110.2	84%	0.841	56%	0.556	S	S	*	*			trans	-54	129.3	177.6	-71.1	-179.7	161.2	0	0	108.5	Q536 E540	Q536-E538 PolarHBondContact O-N 3.43Å; E538-E540 PolarHBondContact O-N 3.21Å; E538-E540 VanDerWaalsContact O-N 3.11Å
539	S	39.1	Very low	67	Low	98 Å²	98	118.2 Å²	118.2	69%	0.685	60%	0.597	S	S	*	*			trans	-61.4	112.3	165.4	38.7	0	0	0	0	106.5	G537 D541	G537-S539 PolarHBondContact O-N 3.15Å; S539-D541 PolarHBondContact O-N 3.09Å
540	E	37.4	Very low	64.9	Low	164 Å²	164	113.7 Å²	113.7	77%	0.766	58%	0.584	S	S	*	*			trans	-53.1	109.4	164.5	-69.7	164.3	137	0	0	107.2	K24 E538	K24-E540 IonicContact NZ-OE2 3.15Å; K24-E540 PolarHBondContact NZ-OE2 3.27Å; E538-E540 PolarHBondContact O-N 3.21Å; E538-E540 VanDerWaalsContact O-N 3.11Å
541	D	34.8	Very low	62.7	Low	229 Å²	229	118.3 Å²	118.3	100%	1.225	61%	0.608	S	S	*	*			trans	-84.1	0	159.3	-85.5	-23.1	0	0	0	109.5	S539	S539-D541 PolarHBondContact O-N 3.09Å

Retrieved 541 of 541 residues in 206 ms (Link to these results)

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