A0A3Q0KJB0_SCHMA Loading...

Phenylalanine--tRNA ligase beta subunit

AlphaFold DB , UniProt , Accession A0A3Q0KJB0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 612 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	68.6	Low	87.3	Confident	126 Å²	126	38.5 Å²	38.5	62%	0.621	23%	0.226	S	C	*	.				0	-167.5	0	-73	-153.5	-72.3	0	0	110.1	E66 I67 P68	M1-E66 VanDerWaalsContact N-CD 3.29Å; M1-E66 PolarHBondContact N-OE1 2.91Å; M1-E66 PolarHBondContact N-OE2 2.81Å; M1-I67 WeakPolarHBondContact CB-O 3.35Å; M1-P68 HydrophobicContact CE-CG 4.4Å
2	P	86	Confident	87.7	Confident	28 Å²	28	37.2 Å²	37.2	18%	0.182	22%	0.215	C	C	.	.			trans	-53.3	148.9	158.7	-27	37.1	0	0	0	110.7	I67 L75	P2-I67 WeakPolarHBondContact CD-O 3.38Å; P2-I67 PolarHBondContact O-N 3.3Å; P2-L75 HydrophobicContact CB-CD2 3.59Å
3	T	89.4	Confident	88	Confident	35 Å²	35	46.2 Å²	46.2	22%	0.215	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	142.7	179.5	54.4	0	0	0	0	111.6	K64 V65 E66 K144	T3-K64 HydrophobicContact CG2-CG 4.18Å; T3-K64 WeakPolarHBondContact OG1-CE 3.49Å; T3-V65 CarbonylContact C-O 3.37Å; T3-V65 VanDerWaalsContact CA-O 3.24Å; T3-V65 WeakPolarHBondContact CA-O 3.38Å; T3-E66 HydrophobicContact CG2-CG 4.34Å; T3-K144 WeakPolarHBondContact O-CE 3.44Å; T3-K144 PolarHBondContact O-NZ 2.58Å
4	A	89.6	Confident	88.2	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.008	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	113.5	172.4	0	0	0	0	0	108.9	K64 V65 I67 L74	A4-K64 WeakPolarHBondContact O-CA 3.04Å; A4-V65 PolarHBondContact N-O 2.68Å; A4-V65 PolarHBondContact O-N 3.21Å; A4-I67 HydrophobicContact CB-CD1 4.32Å; A4-I67 HydrophobicContact CB-CG1 3.87Å; A4-L74 WeakPolarHBondContact CB-O 3.32Å
5	S	89.8	Confident	88.4	Confident	47 Å²	47	42.7 Å²	42.7	33%	0.329	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	122	176.6	-56.2	0	0	0	0	109.5	Y63	S5-Y63 WeakPolarHBondContact CA-O 3.45Å
6	I	90.5	Very high	88.4	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.021	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	131.5	-176.3	-49.2	171.6	0	0	0	108.7	V10 L11 V62 Y63 P77 L80	I6-V10 HydrophobicContact CG2-CB 4.26Å; I6-V10 HydrophobicContact CG2-CG1 4.12Å; I6-L11 HydrophobicContact CD1-CD1 4.21Å; I6-L11 HydrophobicContact CG2-CB 3.84Å; I6-L11 HydrophobicContact CG2-CD1 4.43Å; I6-V62 CarbonylContact O-C 3.14Å; I6-V62 WeakPolarHBondContact O-CA 3.13Å; I6-Y63 PolarHBondContact N-O 3.07Å; I6-Y63 PolarHBondContact O-N 2.92Å; I6-P77 HydrophobicContact CD1-CB 4.3Å; I6-P77 HydrophobicContact CG1-CB 4.27Å; I6-P77 HydrophobicContact CG1-CG 4.02Å; I6-P77 HydrophobicContact CG2-CB 3.92Å; I6-P77 HydrophobicContact CG2-CG 4.03Å; I6-L80 HydrophobicContact CD1-CB 4.18Å; I6-L80 HydrophobicContact CD1-CD2 3.43Å; I6-L80 VanDerWaalsContact CD1-CD2 3.43Å; I6-L80 HydrophobicContact CD1-CG 4.31Å
7	S	89.7	Confident	88.5	Confident	30 Å²	30	52.1 Å²	52.1	21%	0.21	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	145.7	174.7	77.6	0	0	0	0	110.8	S9 V10 L11 E60	S7-S9 VanDerWaalsContact C-N 3.29Å; S7-S9 PolarHBondContact O-N 3.14Å; S7-V10 PolarHBondContact O-N 3.16Å; S7-V10 VanDerWaalsContact O-N 3.17Å; S7-V10 VanDerWaalsContact OG-CG2 3.22Å; S7-V10 WeakPolarHBondContact OG-CG2 3.48Å; S7-L11 WeakPolarHBondContact O-CB 3.48Å; S7-L11 PolarHBondContact O-N 3.39Å; S7-E60 VanDerWaalsContact CB-OE1 3.31Å; S7-E60 WeakPolarHBondContact CB-OE1 3.35Å; S7-E60 PolarHBondContact OG-OE1 3Å
8	Q	90.3	Very high	88.5	Confident	61 Å²	61	58.2 Å²	58.2	29%	0.285	30%	0.297	S	S	.	.	H	α-helix	trans	-55.7	-43.8	-176.6	-174.9	180	-56.9	0	0	112.2	V10 L11 F12 P61 Y63	Q8-V10 VanDerWaalsContact C-N 3.34Å; Q8-V10 PolarHBondContact O-N 3.28Å; Q8-L11 PolarHBondContact O-N 3.23Å; Q8-F12 HydrophobicContact CG-CD1 4.37Å; Q8-F12 HydrophobicContact CG-CD2 3.6Å; Q8-F12 HydrophobicContact CG-CE1 4.09Å; Q8-F12 HydrophobicContact CG-CE2 3.29Å; Q8-F12 HydrophobicContact CG-CG 4.14Å; Q8-F12 HydrophobicContact CG-CZ 3.55Å; Q8-F12 WeakPolarHBondContact O-CB 3.45Å; Q8-F12 WeakPolarHBondContact O-CG 3.37Å; Q8-F12 PolarHBondContact O-N 3.2Å; Q8-P61 HydrophobicContact CB-CB 4.18Å; Q8-P61 WeakPolarHBondContact CB-O 3.44Å; Q8-P61 PolarHBondContact N-O 3.05Å; Q8-P61 VanDerWaalsContact OE1-CG 3.31Å; Q8-Y63 HydrophobicContact CB-CD2 4.22Å; Q8-Y63 HydrophobicContact CB-CE2 3.8Å; Q8-Y63 HydrophobicContact CG-CE2 3.75Å
9	S	87.7	Confident	88.5	Confident	66 Å²	66	55.7 Å²	55.7	46%	0.462	28%	0.284	S	S	.	.	H	α-helix	trans	-62.6	-42.4	-179.5	62.1	0	0	0	0	111.9	S7 H13 E60	S7-S9 VanDerWaalsContact C-N 3.29Å; S7-S9 PolarHBondContact O-N 3.14Å; S9-H13 WeakPolarHBondContact O-CB 3.39Å; S9-H13 PolarHBondContact O-N 3.44Å; S9-E60 WeakPolarHBondContact CB-OE1 3.27Å; S9-E60 PolarHBondContact N-OE1 2.78Å; S9-E60 PolarHBondContact OG-OE1 2.76Å
10	V	88.3	Confident	88.6	Confident	26 Å²	26	55.7 Å²	55.7	16%	0.158	29%	0.289	C	S	.	.	H	α-helix	trans	-66.6	-45.4	178.3	173.6	0	0	0	0	110.2	I6 S7 Q8 K14 P77 S133	I6-V10 HydrophobicContact CG2-CB 4.26Å; I6-V10 HydrophobicContact CG2-CG1 4.12Å; S7-V10 PolarHBondContact O-N 3.16Å; S7-V10 VanDerWaalsContact O-N 3.17Å; S7-V10 VanDerWaalsContact OG-CG2 3.22Å; S7-V10 WeakPolarHBondContact OG-CG2 3.48Å; Q8-V10 VanDerWaalsContact C-N 3.34Å; Q8-V10 PolarHBondContact O-N 3.28Å; V10-K14 HydrophobicContact CG1-CD 4.36Å; V10-K14 WeakPolarHBondContact O-CB 3.49Å; V10-K14 WeakPolarHBondContact O-CG 3.35Å; V10-K14 PolarHBondContact O-N 3.06Å; V10-P77 HydrophobicContact CG1-CB 4.05Å; V10-S133 WeakPolarHBondContact CG2-OG 3.4Å
11	L	90.6	Very high	88.5	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-60.8	-54.3	179.6	-176.9	63.3	0	0	0	111.2	I6 S7 Q8 H13 K14 L15 F24 Y63	I6-L11 HydrophobicContact CD1-CD1 4.21Å; I6-L11 HydrophobicContact CG2-CB 3.84Å; I6-L11 HydrophobicContact CG2-CD1 4.43Å; S7-L11 WeakPolarHBondContact O-CB 3.48Å; S7-L11 PolarHBondContact O-N 3.39Å; Q8-L11 PolarHBondContact O-N 3.23Å; L11-H13 PolarHBondContact O-N 3.3Å; L11-K14 PolarHBondContact O-N 3.03Å; L11-L15 HydrophobicContact CD1-CD1 3.8Å; L11-L15 HydrophobicContact CD1-CG 4.22Å; L11-L15 HydrophobicContact CG-CD1 3.94Å; L11-L15 WeakPolarHBondContact O-CB 3.14Å; L11-L15 WeakPolarHBondContact O-CG 3.44Å; L11-L15 PolarHBondContact O-N 2.77Å; L11-F24 HydrophobicContact CD1-CE2 4.14Å; L11-F24 HydrophobicContact CD1-CZ 4.15Å; L11-F24 HydrophobicContact CD2-CD2 4.29Å; L11-F24 HydrophobicContact CD2-CE1 4.01Å; L11-F24 HydrophobicContact CD2-CE2 3.8Å; L11-F24 HydrophobicContact CD2-CZ 3.64Å; L11-F24 HydrophobicContact CG-CE2 4.33Å; L11-F24 HydrophobicContact CG-CZ 4.44Å; L11-Y63 HydrophobicContact CD2-CD1 4.27Å; L11-Y63 HydrophobicContact CD2-CD2 4.06Å; L11-Y63 HydrophobicContact CD2-CG 3.86Å
12	F	91.9	Very high	89.6	Confident	22 Å²	22	59.5 Å²	59.5	10%	0.096	30%	0.304	C	S	.	.	H	α-helix	trans	-68.1	-35.8	-176.8	-67	-3.4	0	0	0	112.2	Q8 L15 Q16 K17 E18 Y19 Y63	Q8-F12 HydrophobicContact CG-CD1 4.37Å; Q8-F12 HydrophobicContact CG-CD2 3.6Å; Q8-F12 HydrophobicContact CG-CE1 4.09Å; Q8-F12 HydrophobicContact CG-CE2 3.29Å; Q8-F12 HydrophobicContact CG-CG 4.14Å; Q8-F12 HydrophobicContact CG-CZ 3.55Å; Q8-F12 WeakPolarHBondContact O-CB 3.45Å; Q8-F12 WeakPolarHBondContact O-CG 3.37Å; Q8-F12 PolarHBondContact O-N 3.2Å; F12-L15 PolarHBondContact O-N 3.28Å; F12-Q16 PolarHBondContact O-N 2.86Å; F12-K17 PolarHBondContact O-N 3.08Å; F12-E18 HydrophobicContact CD2-CB 4.08Å; F12-E18 HydrophobicContact CD2-CG 4.01Å; F12-E18 HydrophobicContact CE2-CB 4.34Å; F12-Y19 HydrophobicContact CD1-CD2 4.39Å; F12-Y19 HydrophobicContact CE1-CD2 4.43Å; F12-Y19 WeakPolarHBondContact CZ-O 3.49Å; F12-Y63 HydrophobicContact CE1-CE2 4.5Å; F12-Y63 HydrophobicContact CZ-CE2 4.37Å
13	H	91.5	Very high	90	Very high	155 Å²	155	61.8 Å²	61.8	72%	0.718	31%	0.312	S	S	*	.	H	α-helix	trans	-61.4	-45.2	172.6	177.3	-87	0	0	0	111.5	S9 L11 Q16	S9-H13 WeakPolarHBondContact O-CB 3.39Å; S9-H13 PolarHBondContact O-N 3.44Å; L11-H13 PolarHBondContact O-N 3.3Å; H13-Q16 PolarHBondContact O-N 3.22Å
14	K	90.6	Very high	90.2	Very high	40 Å²	40	60.1 Å²	60.1	17%	0.174	30%	0.302	C	S	.	.	H	α-helix	trans	-69.6	-36.2	178.3	-78.4	-175.1	167.1	-75.6	0	113	V10 L11 Q16 P77 S81 E275 Y276	V10-K14 HydrophobicContact CG1-CD 4.36Å; V10-K14 WeakPolarHBondContact O-CB 3.49Å; V10-K14 WeakPolarHBondContact O-CG 3.35Å; V10-K14 PolarHBondContact O-N 3.06Å; L11-K14 PolarHBondContact O-N 3.03Å; K14-Q16 VanDerWaalsContact C-N 3.29Å; K14-P77 HydrophobicContact CD-CB 4.34Å; K14-S81 WeakPolarHBondContact CB-OG 3.49Å; K14-E275 IonicContact NZ-OE1 2.68Å; K14-E275 IonicContact NZ-OE2 4Å; K14-E275 PolarHBondContact NZ-OE2 3.44Å; K14-E275 VanDerWaalsContact NZ-OE2 3.13Å; K14-Y276 VanDerWaalsContact CE-OH 3.31Å; K14-Y276 WeakPolarHBondContact CE-OH 3.19Å; K14-Y276 PolarHBondContact NZ-OH 3.08Å
15	L	91.2	Very high	90.4	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-80.1	-8.5	177.5	-64.7	178.7	0	0	0	113.9	L11 F12 K17 Y19 F24 L84 M85	L11-L15 HydrophobicContact CD1-CD1 3.8Å; L11-L15 HydrophobicContact CD1-CG 4.22Å; L11-L15 HydrophobicContact CG-CD1 3.94Å; L11-L15 WeakPolarHBondContact O-CB 3.14Å; L11-L15 WeakPolarHBondContact O-CG 3.44Å; L11-L15 PolarHBondContact O-N 2.77Å; F12-L15 PolarHBondContact O-N 3.28Å; L15-K17 PolarHBondContact O-N 2.76Å; L15-K17 VanDerWaalsContact O-N 3.08Å; L15-Y19 HydrophobicContact CB-CE2 3.84Å; L15-Y19 HydrophobicContact CD1-CD2 4.08Å; L15-Y19 HydrophobicContact CD1-CE2 3.73Å; L15-Y19 HydrophobicContact CG-CE2 4.42Å; L15-F24 HydrophobicContact CD1-CD2 4.27Å; L15-F24 HydrophobicContact CD1-CE2 3.91Å; L15-L84 HydrophobicContact CD2-CB 3.99Å; L15-L84 HydrophobicContact CD2-CD1 4.36Å; L15-M85 HydrophobicContact CB-SD 4.41Å; L15-M85 HydrophobicContact CD2-CG 3.88Å; L15-M85 HydrophobicContact CD2-SD 4.1Å; L15-M85 VanDerWaalsContact O-SD 3.32Å
16	Q	89.3	Confident	90.5	Very high	161 Å²	161	69 Å²	69	75%	0.752	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	21.6	-179.7	-54	176.8	-1	0	0	114	F12 H13 K14 M85	F12-Q16 PolarHBondContact O-N 2.86Å; H13-Q16 PolarHBondContact O-N 3.22Å; K14-Q16 VanDerWaalsContact C-N 3.29Å; Q16-M85 HydrophobicContact CG-CE 4.32Å
17	K	89.2	Confident	90.7	Very high	84 Å²	84	69.4 Å²	69.4	37%	0.365	34%	0.34	S	S	.	.	S	Bend	trans	-149.9	140.9	178.7	173	179.4	175.7	-157.8	0	108.3	F12 L15 Y19 E23	F12-K17 PolarHBondContact O-N 3.08Å; L15-K17 PolarHBondContact O-N 2.76Å; L15-K17 VanDerWaalsContact O-N 3.08Å; K17-Y19 HydrophobicContact CB-CD2 4.26Å; K17-Y19 HydrophobicContact CB-CE2 3.62Å; K17-Y19 HydrophobicContact CD-CD1 4.48Å; K17-Y19 HydrophobicContact CD-CD2 4.48Å; K17-Y19 HydrophobicContact CD-CE1 4Å; K17-Y19 HydrophobicContact CD-CE2 3.97Å; K17-Y19 HydrophobicContact CG-CD2 4.09Å; K17-Y19 HydrophobicContact CG-CE2 3.76Å; K17-Y19 VanDerWaalsContact O-CD2 3.3Å; K17-Y19 WeakPolarHBondContact O-CD2 3.37Å; K17-E23 IonicContact NZ-OE1 2.76Å; K17-E23 PolarHBondContact NZ-OE1 3.39Å
18	E	89.6	Confident	90.9	Very high	161 Å²	161	68 Å²	68	75%	0.752	33%	0.33	S	S	*	.			trans	-82.1	129.3	166.1	-63.8	-177.2	176.3	0	0	108.8	F12	F12-E18 HydrophobicContact CD2-CB 4.08Å; F12-E18 HydrophobicContact CD2-CG 4.01Å; F12-E18 HydrophobicContact CE2-CB 4.34Å
19	Y	87.4	Confident	91	Very high	12 Å²	12	71.5 Å²	71.5	5%	0.047	35%	0.345	C	S	.	.			trans	-110.6	139	178.9	-69.8	-102.2	0	0	0	109.3	F12 L15 K17 E23 F24 L27 E88 K90	F12-Y19 HydrophobicContact CD1-CD2 4.39Å; F12-Y19 HydrophobicContact CE1-CD2 4.43Å; F12-Y19 WeakPolarHBondContact CZ-O 3.49Å; L15-Y19 HydrophobicContact CB-CE2 3.84Å; L15-Y19 HydrophobicContact CD1-CD2 4.08Å; L15-Y19 HydrophobicContact CD1-CE2 3.73Å; L15-Y19 HydrophobicContact CG-CE2 4.42Å; K17-Y19 HydrophobicContact CB-CD2 4.26Å; K17-Y19 HydrophobicContact CB-CE2 3.62Å; K17-Y19 HydrophobicContact CD-CD1 4.48Å; K17-Y19 HydrophobicContact CD-CD2 4.48Å; K17-Y19 HydrophobicContact CD-CE1 4Å; K17-Y19 HydrophobicContact CD-CE2 3.97Å; K17-Y19 HydrophobicContact CG-CD2 4.09Å; K17-Y19 HydrophobicContact CG-CE2 3.76Å; K17-Y19 VanDerWaalsContact O-CD2 3.3Å; K17-Y19 WeakPolarHBondContact O-CD2 3.37Å; Y19-E23 HydrophobicContact CD1-CB 3.96Å; Y19-F24 HydrophobicContact CG-CB 4.49Å; Y19-L27 HydrophobicContact CE1-CD2 3.86Å; Y19-E88 PolarHBondContact OH-OE1 3.41Å; Y19-E88 PolarHBondContact OH-OE2 3.41Å; Y19-K90 PolarHBondContact OH-NZ 3.26Å
20	S	90.8	Very high	91.2	Very high	54 Å²	54	70.7 Å²	70.7	38%	0.378	34%	0.339	S	S	.	.			trans	-65	161.2	156.4	62.7	0	0	0	0	110.2	E22 E23 F24	S20-E22 VanDerWaalsContact C-N 3.3Å; S20-E22 PolarHBondContact O-N 3.39Å; S20-E23 WeakPolarHBondContact CB-OE2 3.42Å; S20-E23 PolarHBondContact N-OE2 3.12Å; S20-E23 PolarHBondContact O-N 3.25Å; S20-E23 WeakPolarHBondContact OG-CB 3.4Å; S20-E23 WeakPolarHBondContact OG-CG 3.46Å; S20-E23 PolarHBondContact OG-N 3.27Å; S20-E23 PolarHBondContact OG-OE2 2.71Å; S20-F24 PolarHBondContact O-N 3.16Å
21	Q	87.3	Confident	91.5	Very high	106 Å²	106	69.9 Å²	69.9	50%	0.495	33%	0.333	S	S	.	.	H	α-helix	trans	-58.4	-43.9	177.3	-178.6	176.9	-17.2	0	0	111.5	F24 E25 L35 V38	Q21-F24 PolarHBondContact O-N 2.8Å; Q21-E25 WeakPolarHBondContact O-CB 3.41Å; Q21-E25 PolarHBondContact O-N 3.19Å; Q21-L35 HydrophobicContact CG-CD2 4.06Å; Q21-V38 HydrophobicContact CG-CG2 4.07Å
22	E	91.4	Very high	91.5	Very high	157 Å²	157	72.2 Å²	72.2	73%	0.734	36%	0.357	S	S	*	.	H	α-helix	trans	-62.5	-45.6	178.3	-65.8	175	-175.4	0	0	111.7	S20 F24 E25 E26	S20-E22 VanDerWaalsContact C-N 3.3Å; S20-E22 PolarHBondContact O-N 3.39Å; E22-F24 VanDerWaalsContact C-N 3.3Å; E22-F24 PolarHBondContact O-N 2.85Å; E22-E25 PolarHBondContact O-N 3.07Å; E22-E26 WeakPolarHBondContact O-CB 3.42Å; E22-E26 PolarHBondContact O-N 2.51Å
23	E	93.2	Very high	91.6	Very high	76 Å²	76	71.7 Å²	71.7	36%	0.355	36%	0.355	S	S	.	.	H	α-helix	trans	-63.1	-36.2	176.9	-74.7	172.4	111.8	0	0	112.4	K17 Y19 S20 L27	K17-E23 IonicContact NZ-OE1 2.76Å; K17-E23 PolarHBondContact NZ-OE1 3.39Å; Y19-E23 HydrophobicContact CD1-CB 3.96Å; S20-E23 WeakPolarHBondContact CB-OE2 3.42Å; S20-E23 PolarHBondContact N-OE2 3.12Å; S20-E23 PolarHBondContact O-N 3.25Å; S20-E23 WeakPolarHBondContact OG-CB 3.4Å; S20-E23 WeakPolarHBondContact OG-CG 3.46Å; S20-E23 PolarHBondContact OG-N 3.27Å; S20-E23 PolarHBondContact OG-OE2 2.71Å; E23-L27 WeakPolarHBondContact O-CB 3.37Å; E23-L27 PolarHBondContact O-N 3.09Å; E23-L27 VanDerWaalsContact O-N 3.1Å
24	F	93.6	Very high	91.6	Very high	0 Å²	0	70.3 Å²	70.3	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-74.1	-38.3	178.2	-173.1	-108.4	0	0	0	111.8	L11 L15 Y19 S20 Q21 E22 L27 C28 L35 Y63 V65 L84	L11-F24 HydrophobicContact CD1-CE2 4.14Å; L11-F24 HydrophobicContact CD1-CZ 4.15Å; L11-F24 HydrophobicContact CD2-CD2 4.29Å; L11-F24 HydrophobicContact CD2-CE1 4.01Å; L11-F24 HydrophobicContact CD2-CE2 3.8Å; L11-F24 HydrophobicContact CD2-CZ 3.64Å; L11-F24 HydrophobicContact CG-CE2 4.33Å; L11-F24 HydrophobicContact CG-CZ 4.44Å; L15-F24 HydrophobicContact CD1-CD2 4.27Å; L15-F24 HydrophobicContact CD1-CE2 3.91Å; Y19-F24 HydrophobicContact CG-CB 4.49Å; S20-F24 PolarHBondContact O-N 3.16Å; Q21-F24 PolarHBondContact O-N 2.8Å; E22-F24 VanDerWaalsContact C-N 3.3Å; E22-F24 PolarHBondContact O-N 2.85Å; F24-L27 HydrophobicContact CD2-CD2 4.4Å; F24-L27 PolarHBondContact O-N 2.98Å; F24-C28 VanDerWaalsContact CE1-SG 3.55Å; F24-C28 WeakPolarHBondContact O-CB 3.45Å; F24-C28 PolarHBondContact O-N 3.44Å; F24-L35 HydrophobicContact CD1-CD1 4.2Å; F24-L35 HydrophobicContact CD1-CD2 4.19Å; F24-L35 HydrophobicContact CE1-CD1 4.12Å; F24-Y63 HydrophobicContact CB-CE1 4.45Å; F24-Y63 AromaticContact CD1-CD1 3.52Å; F24-Y63 HydrophobicContact CD1-CD1 3.52Å; F24-Y63 AromaticContact CD1-CE1 3.89Å; F24-Y63 HydrophobicContact CD1-CE1 3.89Å; F24-Y63 AromaticContact CE1-CD1 3.81Å; F24-Y63 HydrophobicContact CE1-CD1 3.81Å; F24-Y63 HydrophobicContact CE1-CG 4.42Å; F24-Y63 HydrophobicContact CG-CD1 4.36Å; F24-Y63 HydrophobicContact CG-CE1 4.36Å; F24-V65 HydrophobicContact CE1-CG2 3.97Å; F24-V65 HydrophobicContact CZ-CG2 4.26Å; F24-L84 HydrophobicContact CE2-CD1 3.9Å; F24-L84 HydrophobicContact CZ-CD1 4.3Å
25	E	93.6	Very high	91.7	Very high	98 Å²	98	69.1 Å²	69.1	46%	0.458	35%	0.345	S	S	.	.	H	α-helix	trans	-61	-44.6	173.6	-173.7	174.8	178	0	0	111.1	Q21 E22 L27 C28 F29 L35	Q21-E25 WeakPolarHBondContact O-CB 3.41Å; Q21-E25 PolarHBondContact O-N 3.19Å; E22-E25 PolarHBondContact O-N 3.07Å; E25-L27 VanDerWaalsContact C-N 3.35Å; E25-L27 PolarHBondContact O-N 3.32Å; E25-C28 PolarHBondContact O-N 2.94Å; E25-F29 VanDerWaalsContact O-CB 3.31Å; E25-F29 WeakPolarHBondContact O-CB 3.32Å; E25-F29 PolarHBondContact O-N 2.67Å; E25-L35 HydrophobicContact CB-CD2 4.22Å; E25-L35 HydrophobicContact CG-CB 4.44Å
26	E	93.1	Very high	91.7	Very high	135 Å²	135	72.4 Å²	72.4	63%	0.631	36%	0.362	S	S	*	.	H	α-helix	trans	-63	-39.2	175.3	-172.8	177.6	-171.2	0	0	112.3	E22 F29 S30	E22-E26 WeakPolarHBondContact O-CB 3.42Å; E22-E26 PolarHBondContact O-N 2.51Å; E26-F29 PolarHBondContact O-N 3.29Å; E26-S30 VanDerWaalsContact O-CB 3.3Å; E26-S30 WeakPolarHBondContact O-CB 3.06Å; E26-S30 PolarHBondContact O-N 2.87Å; E26-S30 PolarHBondContact O-OG 3.2Å
27	L	93.8	Very high	91.7	Very high	13 Å²	13	67 Å²	67	7%	0.068	34%	0.337	C	S	.	.	H	α-helix	trans	-64.6	-45.6	174.6	175.7	61.2	0	0	0	111.7	Y19 E23 F24 E25 S30 Y31 L84 F87 E88	Y19-L27 HydrophobicContact CE1-CD2 3.86Å; E23-L27 WeakPolarHBondContact O-CB 3.37Å; E23-L27 PolarHBondContact O-N 3.09Å; E23-L27 VanDerWaalsContact O-N 3.1Å; F24-L27 HydrophobicContact CD2-CD2 4.4Å; F24-L27 PolarHBondContact O-N 2.98Å; E25-L27 VanDerWaalsContact C-N 3.35Å; E25-L27 PolarHBondContact O-N 3.32Å; L27-S30 PolarHBondContact O-N 2.82Å; L27-Y31 PolarHBondContact O-N 3.32Å; L27-Y31 VanDerWaalsContact O-N 3.14Å; L27-L84 HydrophobicContact CD1-CD2 4.48Å; L27-L84 HydrophobicContact CD2-CB 4.45Å; L27-L84 HydrophobicContact CD2-CD1 4.24Å; L27-L84 HydrophobicContact CG-CD2 4.18Å; L27-F87 HydrophobicContact CD1-CD1 4.35Å; L27-E88 HydrophobicContact CD1-CG 3.74Å
28	C	93.9	Very high	91.6	Very high	0 Å²	0	65 Å²	65	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-59.1	-50.7	174.5	-81.2	0	0	0	0	110.6	F24 E25 S30 Y31 G32 L33	F24-C28 VanDerWaalsContact CE1-SG 3.55Å; F24-C28 WeakPolarHBondContact O-CB 3.45Å; F24-C28 PolarHBondContact O-N 3.44Å; E25-C28 PolarHBondContact O-N 2.94Å; C28-S30 VanDerWaalsContact C-N 3.31Å; C28-S30 PolarHBondContact O-N 2.85Å; C28-Y31 CarbonylContact O-C 3.58Å; C28-Y31 WeakPolarHBondContact O-CA 3.43Å; C28-Y31 PolarHBondContact O-N 2.93Å; C28-G32 PolarHBondContact O-N 3.18Å; C28-G32 VanDerWaalsContact O-N 3.1Å; C28-L33 CarbonylContact C-O 3.37Å; C28-L33 HydrophobicContact CB-CB 4.09Å; C28-L33 WeakPolarHBondContact O-CA 3.34Å; C28-L33 PolarHBondContact O-N 2.79Å; C28-L33 VanDerWaalsContact O-O 3.1Å
29	F	92.7	Very high	91.5	Very high	136 Å²	136	57.6 Å²	57.6	60%	0.596	30%	0.297	S	S	*	.	H	α-helix	trans	-58.9	-43.1	-179.6	-175.3	-99	0	0	0	111.7	E25 E26 Y31 G32 L33 D391	E25-F29 VanDerWaalsContact O-CB 3.31Å; E25-F29 WeakPolarHBondContact O-CB 3.32Å; E25-F29 PolarHBondContact O-N 2.67Å; E26-F29 PolarHBondContact O-N 3.29Å; F29-Y31 VanDerWaalsContact C-N 3.28Å; F29-Y31 PolarHBondContact O-N 2.98Å; F29-G32 PolarHBondContact O-N 3.15Å; F29-L33 WeakPolarHBondContact CA-O 3.36Å; F29-L33 PolarHBondContact N-O 3.45Å; F29-D391 WeakPolarHBondContact CE1-OD2 3.27Å
30	S	92.3	Very high	91.4	Very high	49 Å²	49	58.1 Å²	58.1	34%	0.343	30%	0.302	S	S	.	.	H	α-helix	trans	-61.5	-33.5	175.7	-61.5	0	0	0	0	113	E26 L27 C28 G32 F87	E26-S30 VanDerWaalsContact O-CB 3.3Å; E26-S30 WeakPolarHBondContact O-CB 3.06Å; E26-S30 PolarHBondContact O-N 2.87Å; E26-S30 PolarHBondContact O-OG 3.2Å; L27-S30 PolarHBondContact O-N 2.82Å; C28-S30 VanDerWaalsContact C-N 3.31Å; C28-S30 PolarHBondContact O-N 2.85Å; S30-G32 VanDerWaalsContact C-N 3.29Å; S30-F87 WeakPolarHBondContact O-CZ 3.08Å
31	Y	93.7	Very high	90.5	Very high	9 Å²	9	59.8 Å²	59.8	4%	0.035	30%	0.304	C	S	.	.	H	α-helix	trans	-80.2	-8.4	173.7	-165.4	-84.6	0	0	0	112.7	L27 C28 F29 L33 R71 L74 A83 L84 F87 M333 I386	L27-Y31 PolarHBondContact O-N 3.32Å; L27-Y31 VanDerWaalsContact O-N 3.14Å; C28-Y31 CarbonylContact O-C 3.58Å; C28-Y31 WeakPolarHBondContact O-CA 3.43Å; C28-Y31 PolarHBondContact O-N 2.93Å; F29-Y31 VanDerWaalsContact C-N 3.28Å; F29-Y31 PolarHBondContact O-N 2.98Å; Y31-L33 HydrophobicContact CD1-CD1 3.79Å; Y31-L33 HydrophobicContact CD1-CD2 4.4Å; Y31-L33 HydrophobicContact CD1-CG 3.78Å; Y31-L33 HydrophobicContact CE1-CD1 4.42Å; Y31-L33 HydrophobicContact CG-CD1 4.48Å; Y31-R71 PolarHBondContact OH-NH1 3.19Å; Y31-R71 PolarHBondContact OH-NH2 2.9Å; Y31-R71 VanDerWaalsContact OH-NH2 3.09Å; Y31-L74 HydrophobicContact CE1-CD1 4.03Å; Y31-A83 HydrophobicContact CE2-CB 4.21Å; Y31-L84 HydrophobicContact CD2-CD2 4.04Å; Y31-L84 HydrophobicContact CG-CD2 3.98Å; Y31-F87 HydrophobicContact CD2-CB 3.58Å; Y31-F87 HydrophobicContact CD2-CD1 4.17Å; Y31-F87 AromaticContact CD2-CD2 3.5Å; Y31-F87 HydrophobicContact CD2-CD2 3.5Å; Y31-F87 VanDerWaalsContact CD2-CD2 3.5Å; Y31-F87 HydrophobicContact CD2-CE2 4.12Å; Y31-F87 AromaticContact CD2-CG 3.51Å; Y31-F87 HydrophobicContact CD2-CG 3.51Å; Y31-F87 HydrophobicContact CE2-CB 3.81Å; Y31-F87 AromaticContact CE2-CD2 3.96Å; Y31-F87 HydrophobicContact CE2-CD2 3.96Å; Y31-F87 HydrophobicContact CE2-CG 4.11Å; Y31-F87 HydrophobicContact CG-CD2 4.46Å; Y31-M333 HydrophobicContact CE2-CE 4.37Å; Y31-M333 HydrophobicContact CE2-SD 4.29Å; Y31-I386 WeakPolarHBondContact O-CG2 3.23Å
32	G	90.6	Very high	89.9	Confident	49 Å²	49	58.8 Å²	58.8	51%	0.505	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	82	28.5	-172.8	0	0	0	0	0	114	C28 F29 S30	C28-G32 PolarHBondContact O-N 3.18Å; C28-G32 VanDerWaalsContact O-N 3.1Å; F29-G32 PolarHBondContact O-N 3.15Å; S30-G32 VanDerWaalsContact C-N 3.29Å
33	L	94	Very high	89.2	Confident	10 Å²	10	55.8 Å²	55.8	5%	0.052	28%	0.284	C	S	.	.			trans	-113.4	159.9	172.5	-57	175.2	0	0	0	110.5	C28 F29 Y31 V65 I67 P68 L74 L80	C28-L33 CarbonylContact C-O 3.37Å; C28-L33 HydrophobicContact CB-CB 4.09Å; C28-L33 WeakPolarHBondContact O-CA 3.34Å; C28-L33 PolarHBondContact O-N 2.79Å; C28-L33 VanDerWaalsContact O-O 3.1Å; F29-L33 WeakPolarHBondContact CA-O 3.36Å; F29-L33 PolarHBondContact N-O 3.45Å; Y31-L33 HydrophobicContact CD1-CD1 3.79Å; Y31-L33 HydrophobicContact CD1-CD2 4.4Å; Y31-L33 HydrophobicContact CD1-CG 3.78Å; Y31-L33 HydrophobicContact CE1-CD1 4.42Å; Y31-L33 HydrophobicContact CG-CD1 4.48Å; L33-V65 HydrophobicContact CB-CG1 3.9Å; L33-V65 HydrophobicContact CD1-CG1 4.11Å; L33-I67 HydrophobicContact CD1-CD1 4.22Å; L33-I67 HydrophobicContact CD2-CD1 4.07Å; L33-P68 HydrophobicContact CD2-CG 4.29Å; L33-L74 HydrophobicContact CD1-CD1 4.42Å; L33-L74 HydrophobicContact CD2-CD1 4.12Å; L33-L80 HydrophobicContact CD1-CD1 3.47Å; L33-L80 VanDerWaalsContact CD1-CD1 3.47Å
34	E	92.7	Very high	88.1	Confident	127 Å²	127	54 Å²	54	59%	0.593	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.1	132.6	177.2	-173.7	176.2	-179.9	0	0	110	D36 V65 E66	E34-D36 PolarHBondContact O-N 3.18Å; E34-V65 WeakPolarHBondContact O-CA 3.48Å; E34-E66 HydrophobicContact CB-CB 4.27Å; E34-E66 PolarHBondContact O-N 2.82Å
35	L	93	Very high	86.7	Confident	15 Å²	15	55.2 Å²	55.2	8%	0.079	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	100.9	170	178.9	64.6	0	0	0	108.3	Q21 F24 E25 V38 Y63 V65	Q21-L35 HydrophobicContact CG-CD2 4.06Å; F24-L35 HydrophobicContact CD1-CD1 4.2Å; F24-L35 HydrophobicContact CD1-CD2 4.19Å; F24-L35 HydrophobicContact CE1-CD1 4.12Å; E25-L35 HydrophobicContact CB-CD2 4.22Å; E25-L35 HydrophobicContact CG-CB 4.44Å; L35-V38 HydrophobicContact CD1-CG2 4.27Å; L35-V38 HydrophobicContact CD2-CG2 3.91Å; L35-V38 HydrophobicContact CG-CG2 4.38Å; L35-Y63 HydrophobicContact CD1-CD1 3.87Å; L35-Y63 HydrophobicContact CD2-CD1 4.32Å; L35-V65 HydrophobicContact CD1-CG2 4.29Å
36	D	90.2	Very high	85.5	Confident	68 Å²	68	52.5 Å²	52.5	36%	0.364	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	-55.9	-177	178.3	29.1	0	0	0	111.4	E34 K64 E66	E34-D36 PolarHBondContact O-N 3.18Å; D36-K64 WeakPolarHBondContact CB-O 3.48Å; D36-K64 PolarHBondContact N-O 2.76Å; D36-K64 WeakPolarHBondContact OD2-CE 3.45Å; D36-K64 IonicContact OD2-NZ 3.43Å; D36-K64 PolarHBondContact OD2-NZ 2.92Å; D36-E66 HydrophobicContact CB-CG 3.88Å
37	E	88.8	Confident	84.1	Confident	48 Å²	48	54.1 Å²	54.1	22%	0.224	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	152.9	175.5	56.7	179.2	174.3	0	0	112	T39 R47 K64	E37-T39 HydrophobicContact CB-CG2 4.12Å; E37-T39 HydrophobicContact CG-CG2 3.69Å; E37-T39 VanDerWaalsContact OE2-CG2 3.23Å; E37-T39 WeakPolarHBondContact OE2-CG2 3.25Å; E37-R47 IonicContact OE1-NH1 2.87Å; E37-R47 IonicContact OE2-CZ 3.63Å; E37-R47 IonicContact OE2-NH1 3.22Å; E37-R47 PolarHBondContact OE2-NH1 2.9Å; E37-R47 IonicContact OE2-NH2 2.91Å; E37-K64 HydrophobicContact CG-CB 4.25Å; E37-K64 HydrophobicContact CG-CD 4.01Å; E37-K64 WeakPolarHBondContact O-CB 3.48Å; E37-K64 PolarHBondContact O-N 2.89Å; E37-K64 IonicContact OE1-NZ 3.78Å
38	V	88.2	Confident	82.7	Confident	42 Å²	42	60.6 Å²	60.6	26%	0.255	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	114.4	163.3	-175	0	0	0	0	107.1	Q21 L35 P61 Y63	Q21-V38 HydrophobicContact CG-CG2 4.07Å; L35-V38 HydrophobicContact CD1-CG2 4.27Å; L35-V38 HydrophobicContact CD2-CG2 3.91Å; L35-V38 HydrophobicContact CG-CG2 4.38Å; V38-P61 HydrophobicContact CG1-CB 4.05Å; V38-Y63 HydrophobicContact CG1-CD2 4.5Å; V38-Y63 HydrophobicContact CG1-CE2 4.28Å; V38-Y63 HydrophobicContact CG2-CD1 3.77Å; V38-Y63 HydrophobicContact CG2-CE1 3.77Å; V38-Y63 HydrophobicContact CG2-CG 4.37Å
39	T	86.9	Confident	81.2	Confident	5 Å²	5	67 Å²	67	3%	0.031	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	178.9	-178.7	55.8	0	0	0	0	110.1	E37 P61 V62	E37-T39 HydrophobicContact CB-CG2 4.12Å; E37-T39 HydrophobicContact CG-CG2 3.69Å; E37-T39 VanDerWaalsContact OE2-CG2 3.23Å; E37-T39 WeakPolarHBondContact OE2-CG2 3.25Å; T39-P61 CarbonylContact O-C 3.59Å; T39-P61 WeakPolarHBondContact O-CA 3.48Å; T39-V62 PolarHBondContact N-O 2.96Å; T39-V62 PolarHBondContact O-N 3.36Å
40	T	85.4	Confident	79.8	Confident	23 Å²	23	62.1 Å²	62.1	14%	0.141	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	155	167.8	57.9	0	0	0	0	110.8	K42 E43 L44 N59	T40-K42 PolarHBondContact O-N 3.43Å; T40-E43 PolarHBondContact N-OE2 3.21Å; T40-E43 PolarHBondContact O-N 2.88Å; T40-E43 WeakPolarHBondContact OG1-CB 3.4Å; T40-E43 VanDerWaalsContact OG1-CD 3.23Å; T40-E43 WeakPolarHBondContact OG1-CG 3.24Å; T40-E43 PolarHBondContact OG1-N 3.15Å; T40-E43 PolarHBondContact OG1-OE2 3.08Å; T40-E43 VanDerWaalsContact OG1-OE2 3.04Å; T40-L44 PolarHBondContact O-N 3.13Å; T40-N59 WeakPolarHBondContact CG2-O 3.34Å
41	E	72.9	Confident	78.2	Confident	90 Å²	90	68.1 Å²	68.1	42%	0.421	34%	0.34	S	S	.	.	H	α-helix	trans	-54.2	-39.8	174.5	-170.5	-169.8	-171.5	0	0	111.2	L44 V45 C57 S58	E41-L44 PolarHBondContact O-N 3.46Å; E41-V45 WeakPolarHBondContact O-CG2 3.06Å; E41-V45 PolarHBondContact O-N 2.94Å; E41-C57 HydrophobicContact CG-CB 4.23Å; E41-S58 WeakPolarHBondContact OE2-CB 3.34Å; E41-S58 PolarHBondContact OE2-N 3.15Å
42	K	74.5	Confident	76.3	Confident	85 Å²	85	77 Å²	77	37%	0.37	38%	0.381	S	S	.	.	H	α-helix	trans	-62.1	-41.9	175.2	-167.3	178.7	-177.4	176.9	0	113.2	T40 T46 C57 S58 N59	T40-K42 PolarHBondContact O-N 3.43Å; K42-T46 VanDerWaalsContact O-CB 3.24Å; K42-T46 WeakPolarHBondContact O-CB 3.41Å; K42-T46 PolarHBondContact O-N 3.45Å; K42-T46 PolarHBondContact O-OG1 3.11Å; K42-C57 HydrophobicContact CB-CB 3.95Å; K42-C57 HydrophobicContact CG-CB 4.32Å; K42-S58 PolarHBondContact N-O 2.91Å; K42-S58 VanDerWaalsContact N-O 3.09Å; K42-N59 WeakPolarHBondContact CD-OD1 3.31Å
43	E	75.8	Confident	74.8	Confident	93 Å²	93	81.5 Å²	81.5	44%	0.435	39%	0.387	S	S	.	.	H	α-helix	trans	-68.4	-41.9	176.6	-76.5	166.8	160.4	0	0	111.9	T40 T46 R47	T40-E43 PolarHBondContact N-OE2 3.21Å; T40-E43 PolarHBondContact O-N 2.88Å; T40-E43 WeakPolarHBondContact OG1-CB 3.4Å; T40-E43 VanDerWaalsContact OG1-CD 3.23Å; T40-E43 WeakPolarHBondContact OG1-CG 3.24Å; T40-E43 PolarHBondContact OG1-N 3.15Å; T40-E43 PolarHBondContact OG1-OE2 3.08Å; T40-E43 VanDerWaalsContact OG1-OE2 3.04Å; E43-T46 PolarHBondContact O-N 2.82Å; E43-R47 WeakPolarHBondContact O-CB 3.3Å; E43-R47 WeakPolarHBondContact O-CG 3.49Å; E43-R47 PolarHBondContact O-N 3.2Å
44	L	69.4	Low	72.9	Confident	40 Å²	40	81.6 Å²	81.6	21%	0.209	39%	0.389	C	S	.	.	H	α-helix	trans	-57.3	-52.3	175.4	-75.8	163.1	0	0	0	110.9	T40 E41 T46 R47 E48 V62	T40-L44 PolarHBondContact O-N 3.13Å; E41-L44 PolarHBondContact O-N 3.46Å; L44-T46 VanDerWaalsContact C-N 3.29Å; L44-T46 PolarHBondContact O-N 2.6Å; L44-R47 PolarHBondContact O-N 2.91Å; L44-E48 WeakPolarHBondContact O-CG 3.35Å; L44-E48 PolarHBondContact O-N 3.08Å; L44-V62 HydrophobicContact CD1-CG1 4.46Å
45	V	65.2	Low	71	Confident	24 Å²	24	79.1 Å²	79.1	15%	0.145	40%	0.397	C	S	.	.	H	α-helix	trans	-64	-36.1	177.9	174.9	0	0	0	0	111.6	E41 K49 G50 K53	E41-V45 WeakPolarHBondContact O-CG2 3.06Å; E41-V45 PolarHBondContact O-N 2.94Å; V45-K49 HydrophobicContact CG1-CB 4.35Å; V45-K49 WeakPolarHBondContact O-CA 3.31Å; V45-K49 WeakPolarHBondContact O-CB 3.3Å; V45-K49 PolarHBondContact O-N 2.67Å; V45-G50 PolarHBondContact O-N 2.99Å; V45-K53 HydrophobicContact CG1-CB 4.31Å
46	T	68.4	Low	69.5	Low	42 Å²	42	82.3 Å²	82.3	26%	0.258	43%	0.434	S	S	.	.	H	α-helix	trans	-66.2	-40	176.8	-60.3	0	0	0	0	111.9	K42 E43 L44 G50 K51 S54	K42-T46 VanDerWaalsContact O-CB 3.24Å; K42-T46 WeakPolarHBondContact O-CB 3.41Å; K42-T46 PolarHBondContact O-N 3.45Å; K42-T46 PolarHBondContact O-OG1 3.11Å; E43-T46 PolarHBondContact O-N 2.82Å; L44-T46 VanDerWaalsContact C-N 3.29Å; L44-T46 PolarHBondContact O-N 2.6Å; T46-G50 VanDerWaalsContact O-CA 3.3Å; T46-G50 WeakPolarHBondContact O-CA 3.26Å; T46-G50 PolarHBondContact O-N 2.66Å; T46-K51 HydrophobicContact CG2-CB 4.45Å; T46-K51 HydrophobicContact CG2-CG 3.57Å; T46-S54 WeakPolarHBondContact OG1-CB 3.37Å; T46-S54 PolarHBondContact OG1-OG 2.83Å; T46-S54 VanDerWaalsContact OG1-OG 3.09Å
47	R	64.5	Low	68.3	Low	169 Å²	169	80.4 Å²	80.4	64%	0.638	43%	0.425	S	S	*	.	H	α-helix	trans	-68.7	-43.8	176.8	-73.8	178.3	-178.8	-177.2	3.8	111.8	E37 E43 L44	E37-R47 IonicContact OE1-NH1 2.87Å; E37-R47 IonicContact OE2-CZ 3.63Å; E37-R47 IonicContact OE2-NH1 3.22Å; E37-R47 PolarHBondContact OE2-NH1 2.9Å; E37-R47 IonicContact OE2-NH2 2.91Å; E43-R47 WeakPolarHBondContact O-CB 3.3Å; E43-R47 WeakPolarHBondContact O-CG 3.49Å; E43-R47 PolarHBondContact O-N 3.2Å; L44-R47 PolarHBondContact O-N 2.91Å
48	E	64	Low	67.6	Low	149 Å²	149	80.3 Å²	80.3	70%	0.696	43%	0.43	S	S	*	.	H	α-helix	trans	-83.3	-39.8	-174.7	-68.7	-171.9	162.8	0	0	114.3	L44	L44-E48 WeakPolarHBondContact O-CG 3.35Å; L44-E48 PolarHBondContact O-N 3.08Å
49	K	61.6	Low	67.2	Low	134 Å²	134	83.6 Å²	83.6	58%	0.583	45%	0.446	S	S	*	.	H	α-helix	trans	-121.7	-1.9	-167.3	-63.3	-179.1	-175.8	169.3	0	113.9	V45 K53	V45-K49 HydrophobicContact CG1-CB 4.35Å; V45-K49 WeakPolarHBondContact O-CA 3.31Å; V45-K49 WeakPolarHBondContact O-CB 3.3Å; V45-K49 PolarHBondContact O-N 2.67Å; K49-K53 HydrophobicContact CB-CB 4.32Å; K49-K53 HydrophobicContact CB-CD 4.05Å
50	G	63.1	Low	67.1	Low	33 Å²	33	86.1 Å²	86.1	34%	0.34	46%	0.458	S	S	.	.			trans	86.4	162.2	179.8	0	0	0	0	0	114.3	V45 T46 E52 K53	V45-G50 PolarHBondContact O-N 2.99Å; T46-G50 VanDerWaalsContact O-CA 3.3Å; T46-G50 WeakPolarHBondContact O-CA 3.26Å; T46-G50 PolarHBondContact O-N 2.66Å; G50-E52 VanDerWaalsContact C-N 3.29Å; G50-E52 PolarHBondContact O-N 2.94Å; G50-K53 PolarHBondContact O-N 3.18Å
51	K	59	Low	67.2	Low	176 Å²	176	86.9 Å²	86.9	77%	0.765	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-59.2	-31.3	-173.2	-76.8	-177.4	177	179.7	0	114.7	T46 K53 S54	T46-K51 HydrophobicContact CG2-CB 4.45Å; T46-K51 HydrophobicContact CG2-CG 3.57Å; K51-K53 VanDerWaalsContact C-N 3.27Å; K51-K53 PolarHBondContact O-N 2.94Å; K51-S54 PolarHBondContact O-N 2.77Å; K51-S54 PolarHBondContact O-OG 2.85Å; K51-S54 VanDerWaalsContact O-OG 3.08Å
52	E	54.9	Low	68	Low	194 Å²	194	83.5 Å²	83.5	91%	0.907	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-68	-27	-175.6	-66.4	-177	168.4	0	0	113	G50	G50-E52 VanDerWaalsContact C-N 3.29Å; G50-E52 PolarHBondContact O-N 2.94Å
53	K	58	Low	68.9	Low	145 Å²	145	80 Å²	80	63%	0.63	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-92.8	-4.6	-178	-72.7	-176	175.7	179.5	0	114.3	V45 K49 G50 K51 G55	V45-K53 HydrophobicContact CG1-CB 4.31Å; K49-K53 HydrophobicContact CB-CB 4.32Å; K49-K53 HydrophobicContact CB-CD 4.05Å; G50-K53 PolarHBondContact O-N 3.18Å; K51-K53 VanDerWaalsContact C-N 3.27Å; K51-K53 PolarHBondContact O-N 2.94Å; K53-G55 VanDerWaalsContact C-N 3.29Å
54	S	54.8	Low	69.7	Low	11 Å²	11	77.5 Å²	77.5	8%	0.077	42%	0.421	C	S	.	.			trans	-86.2	0.3	179.8	68.8	0	0	0	0	113.9	T46 K51 G56 C57	T46-S54 WeakPolarHBondContact OG1-CB 3.37Å; T46-S54 PolarHBondContact OG1-OG 2.83Å; T46-S54 VanDerWaalsContact OG1-OG 3.09Å; K51-S54 PolarHBondContact O-N 2.77Å; K51-S54 PolarHBondContact O-OG 2.85Å; K51-S54 VanDerWaalsContact O-OG 3.08Å; S54-G56 PolarHBondContact O-N 3Å; S54-C57 PolarHBondContact O-N 2.86Å
55	G	53.3	Low	70.9	Confident	75 Å²	75	75.6 Å²	75.6	77%	0.773	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	98.8	172.2	0	0	0	0	0	111.2	K53	K53-G55 VanDerWaalsContact C-N 3.29Å
56	G	61.7	Low	72.3	Confident	82 Å²	82	76.4 Å²	76.4	85%	0.845	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	122	-10.5	179.2	0	0	0	0	0	114.5	S54	S54-G56 PolarHBondContact O-N 3Å
57	C	64.1	Low	73.5	Confident	28 Å²	28	74.4 Å²	74.4	19%	0.189	40%	0.401	C	S	.	.			trans	-73.4	147.3	177	-60.9	0	0	0	0	111.7	E41 K42 S54	E41-C57 HydrophobicContact CG-CB 4.23Å; K42-C57 HydrophobicContact CB-CB 3.95Å; K42-C57 HydrophobicContact CG-CB 4.32Å; S54-C57 PolarHBondContact O-N 2.86Å
58	S	74.2	Confident	74.8	Confident	47 Å²	47	68 Å²	68	33%	0.329	38%	0.381	S	S	.	.			trans	-66	145.6	177.2	-170.7	0	0	0	0	111.7	E41 K42 E60	E41-S58 WeakPolarHBondContact OE2-CB 3.34Å; E41-S58 PolarHBondContact OE2-N 3.15Å; K42-S58 PolarHBondContact N-O 2.91Å; K42-S58 VanDerWaalsContact N-O 3.09Å; S58-E60 VanDerWaalsContact C-N 3.25Å; S58-E60 WeakPolarHBondContact OG-CB 3.46Å; S58-E60 PolarHBondContact OG-N 3.35Å
59	N	79.4	Confident	75.9	Confident	111 Å²	111	63.6 Å²	63.6	59%	0.594	37%	0.37	S	S	*	.			trans	-90.1	8.4	166.8	-75.5	-16.5	0	0	0	111.6	T40 K42	T40-N59 WeakPolarHBondContact CG2-O 3.34Å; K42-N59 WeakPolarHBondContact CD-OD1 3.31Å
60	E	84.1	Confident	77.3	Confident	57 Å²	57	60.7 Å²	60.7	27%	0.266	36%	0.361	S	S	.	.			trans	-64.8	134.3	176.7	-170.2	-177.1	167.6	0	0	110.4	S7 S9 S58	S7-E60 VanDerWaalsContact CB-OE1 3.31Å; S7-E60 WeakPolarHBondContact CB-OE1 3.35Å; S7-E60 PolarHBondContact OG-OE1 3Å; S9-E60 WeakPolarHBondContact CB-OE1 3.27Å; S9-E60 PolarHBondContact N-OE1 2.78Å; S9-E60 PolarHBondContact OG-OE1 2.76Å; S58-E60 VanDerWaalsContact C-N 3.25Å; S58-E60 WeakPolarHBondContact OG-CB 3.46Å; S58-E60 PolarHBondContact OG-N 3.35Å
61	P	88.7	Confident	78.8	Confident	40 Å²	40	59.9 Å²	59.9	26%	0.26	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	139.3	174.6	-23.4	35.6	0	0	0	111.8	Q8 V38 T39 Y63	Q8-P61 HydrophobicContact CB-CB 4.18Å; Q8-P61 WeakPolarHBondContact CB-O 3.44Å; Q8-P61 PolarHBondContact N-O 3.05Å; Q8-P61 VanDerWaalsContact OE1-CG 3.31Å; V38-P61 HydrophobicContact CG1-CB 4.05Å; T39-P61 CarbonylContact O-C 3.59Å; T39-P61 WeakPolarHBondContact O-CA 3.48Å; P61-Y63 HydrophobicContact CB-CE2 4.4Å
62	V	90.1	Very high	80.4	Confident	18 Å²	18	53.9 Å²	53.9	11%	0.109	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	118.3	178.4	-180	0	0	0	0	107	I6 T39 L44	I6-V62 CarbonylContact O-C 3.14Å; I6-V62 WeakPolarHBondContact O-CA 3.13Å; T39-V62 PolarHBondContact N-O 2.96Å; T39-V62 PolarHBondContact O-N 3.36Å; L44-V62 HydrophobicContact CD1-CG1 4.46Å
63	Y	92.9	Very high	82.3	Confident	11 Å²	11	45.1 Å²	45.1	4%	0.043	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	122.6	176.6	-72.4	-106	0	0	0	108.2	S5 I6 Q8 L11 F12 F24 L35 V38 P61	S5-Y63 WeakPolarHBondContact CA-O 3.45Å; I6-Y63 PolarHBondContact N-O 3.07Å; I6-Y63 PolarHBondContact O-N 2.92Å; Q8-Y63 HydrophobicContact CB-CD2 4.22Å; Q8-Y63 HydrophobicContact CB-CE2 3.8Å; Q8-Y63 HydrophobicContact CG-CE2 3.75Å; L11-Y63 HydrophobicContact CD2-CD1 4.27Å; L11-Y63 HydrophobicContact CD2-CD2 4.06Å; L11-Y63 HydrophobicContact CD2-CG 3.86Å; F12-Y63 HydrophobicContact CE1-CE2 4.5Å; F12-Y63 HydrophobicContact CZ-CE2 4.37Å; F24-Y63 HydrophobicContact CB-CE1 4.45Å; F24-Y63 AromaticContact CD1-CD1 3.52Å; F24-Y63 HydrophobicContact CD1-CD1 3.52Å; F24-Y63 AromaticContact CD1-CE1 3.89Å; F24-Y63 HydrophobicContact CD1-CE1 3.89Å; F24-Y63 AromaticContact CE1-CD1 3.81Å; F24-Y63 HydrophobicContact CE1-CD1 3.81Å; F24-Y63 HydrophobicContact CE1-CG 4.42Å; F24-Y63 HydrophobicContact CG-CD1 4.36Å; F24-Y63 HydrophobicContact CG-CE1 4.36Å; L35-Y63 HydrophobicContact CD1-CD1 3.87Å; L35-Y63 HydrophobicContact CD2-CD1 4.32Å; V38-Y63 HydrophobicContact CG1-CD2 4.5Å; V38-Y63 HydrophobicContact CG1-CE2 4.28Å; V38-Y63 HydrophobicContact CG2-CD1 3.77Å; V38-Y63 HydrophobicContact CG2-CE1 3.77Å; V38-Y63 HydrophobicContact CG2-CG 4.37Å; P61-Y63 HydrophobicContact CB-CE2 4.4Å
64	K	92.8	Very high	84.2	Confident	42 Å²	42	38.2 Å²	38.2	18%	0.183	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	111	178.7	-171.9	177.3	171.5	-135.7	0	109	T3 A4 D36 E37	T3-K64 HydrophobicContact CG2-CG 4.18Å; T3-K64 WeakPolarHBondContact OG1-CE 3.49Å; A4-K64 WeakPolarHBondContact O-CA 3.04Å; D36-K64 WeakPolarHBondContact CB-O 3.48Å; D36-K64 PolarHBondContact N-O 2.76Å; D36-K64 WeakPolarHBondContact OD2-CE 3.45Å; D36-K64 IonicContact OD2-NZ 3.43Å; D36-K64 PolarHBondContact OD2-NZ 2.92Å; E37-K64 HydrophobicContact CG-CB 4.25Å; E37-K64 HydrophobicContact CG-CD 4.01Å; E37-K64 WeakPolarHBondContact O-CB 3.48Å; E37-K64 PolarHBondContact O-N 2.89Å; E37-K64 IonicContact OE1-NZ 3.78Å
65	V	94.8	Very high	86.1	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	130.6	-176.7	-173.2	0	0	0	0	109.2	T3 A4 F24 L33 E34 L35 I67 L80	T3-V65 CarbonylContact C-O 3.37Å; T3-V65 VanDerWaalsContact CA-O 3.24Å; T3-V65 WeakPolarHBondContact CA-O 3.38Å; A4-V65 PolarHBondContact N-O 2.68Å; A4-V65 PolarHBondContact O-N 3.21Å; F24-V65 HydrophobicContact CE1-CG2 3.97Å; F24-V65 HydrophobicContact CZ-CG2 4.26Å; L33-V65 HydrophobicContact CB-CG1 3.9Å; L33-V65 HydrophobicContact CD1-CG1 4.11Å; E34-V65 WeakPolarHBondContact O-CA 3.48Å; L35-V65 HydrophobicContact CD1-CG2 4.29Å; V65-I67 HydrophobicContact CB-CD1 4.26Å; V65-I67 HydrophobicContact CG1-CD1 3.87Å; V65-L80 HydrophobicContact CB-CD2 4.21Å; V65-L80 HydrophobicContact CG1-CD2 4.48Å; V65-L80 HydrophobicContact CG2-CD2 3.98Å
66	E	94.2	Very high	88.1	Confident	41 Å²	41	34.3 Å²	34.3	19%	0.192	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	125.1	170.8	-73.3	-119.3	138.8	0	0	110.1	M1 T3 E34 D36	M1-E66 VanDerWaalsContact N-CD 3.29Å; M1-E66 PolarHBondContact N-OE1 2.91Å; M1-E66 PolarHBondContact N-OE2 2.81Å; T3-E66 HydrophobicContact CG2-CG 4.34Å; E34-E66 HydrophobicContact CB-CB 4.27Å; E34-E66 PolarHBondContact O-N 2.82Å; D36-E66 HydrophobicContact CB-CG 3.88Å
67	I	93.8	Very high	89.7	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.174	C	C	.	.			trans	-114.8	133.6	-176	-58.3	-53.9	0	0	0	110.3	M1 P2 A4 L33 V65 R71 L74 L75 L80	M1-I67 WeakPolarHBondContact CB-O 3.35Å; P2-I67 WeakPolarHBondContact CD-O 3.38Å; P2-I67 PolarHBondContact O-N 3.3Å; A4-I67 HydrophobicContact CB-CD1 4.32Å; A4-I67 HydrophobicContact CB-CG1 3.87Å; L33-I67 HydrophobicContact CD1-CD1 4.22Å; L33-I67 HydrophobicContact CD2-CD1 4.07Å; V65-I67 HydrophobicContact CB-CD1 4.26Å; V65-I67 HydrophobicContact CG1-CD1 3.87Å; I67-R71 HydrophobicContact CG2-CB 4.37Å; I67-R71 WeakPolarHBondContact CG2-O 3.14Å; I67-L74 HydrophobicContact CD1-CB 3.87Å; I67-L74 HydrophobicContact CG1-CB 4.3Å; I67-L74 HydrophobicContact CG2-CB 3.66Å; I67-L74 HydrophobicContact CG2-CD1 4.4Å; I67-L75 HydrophobicContact CB-CD2 4.07Å; I67-L75 HydrophobicContact CG1-CD2 4.38Å; I67-L75 HydrophobicContact CG2-CD2 4.04Å; I67-L75 HydrophobicContact CG2-CG 4.48Å; I67-L80 HydrophobicContact CD1-CD1 4.25Å
68	P	90.9	Very high	91.2	Very high	33 Å²	33	29.9 Å²	29.9	21%	0.214	17%	0.166	C	C	.	.			trans	-53.6	138.3	171.5	-27.5	35.4	0	0	0	112.8	M1 L33 N70 R71	M1-P68 HydrophobicContact CE-CG 4.4Å; L33-P68 HydrophobicContact CD2-CG 4.29Å; P68-N70 WeakPolarHBondContact CB-OD1 3.4Å; P68-N70 PolarHBondContact O-N 2.96Å; P68-R71 HydrophobicContact CB-CB 4.41Å; P68-R71 HydrophobicContact CB-CG 4.4Å; P68-R71 PolarHBondContact O-N 3.21Å
69	A	87.7	Confident	92.2	Very high	58 Å²	58	27.7 Å²	27.7	48%	0.479	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-12.9	-173.4	0	0	0	0	0	114.9	Y72	A69-Y72 WeakPolarHBondContact O-CE1 3.19Å; A69-Y72 PolarHBondContact O-OH 2.91Å
70	N	90.4	Very high	93	Very high	72 Å²	72	22.4 Å²	22.4	39%	0.385	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-13.8	176.8	59	-22.7	0	0	0	113.5	P68 Y72 D373	P68-N70 WeakPolarHBondContact CB-OD1 3.4Å; P68-N70 PolarHBondContact O-N 2.96Å; N70-Y72 PolarHBondContact O-N 3.29Å; N70-D373 HydrophobicContact CB-CB 3.9Å
71	R	94.1	Very high	93.5	Very high	16 Å²	16	19.9 Å²	19.9	6%	0.06	11%	0.111	C	C	.	.			trans	-101.1	72.6	-177.6	-72.8	-65.4	-57.7	-83.4	-1.7	112.5	Y31 I67 P68 D73 L74 D373	Y31-R71 PolarHBondContact OH-NH1 3.19Å; Y31-R71 PolarHBondContact OH-NH2 2.9Å; Y31-R71 VanDerWaalsContact OH-NH2 3.09Å; I67-R71 HydrophobicContact CG2-CB 4.37Å; I67-R71 WeakPolarHBondContact CG2-O 3.14Å; P68-R71 HydrophobicContact CB-CB 4.41Å; P68-R71 HydrophobicContact CB-CG 4.4Å; P68-R71 PolarHBondContact O-N 3.21Å; R71-D73 IonicContact CZ-OD1 3.29Å; R71-D73 IonicContact CZ-OD2 2.7Å; R71-D73 IonicContact NE-OD1 3.1Å; R71-D73 PolarHBondContact NE-OD1 3.05Å; R71-D73 IonicContact NE-OD2 3.55Å; R71-D73 PolarHBondContact NE-OD2 3.09Å; R71-D73 IonicContact NH2-OD1 2.91Å; R71-D73 IonicContact NH2-OD2 3.6Å; R71-D73 PolarHBondContact NH2-OD2 2.75Å; R71-D73 PolarHBondContact O-N 2.74Å; R71-L74 HydrophobicContact CB-CD1 3.79Å; R71-L74 HydrophobicContact CB-CG 4.05Å; R71-L74 HydrophobicContact CG-CD1 4.27Å; R71-L74 PolarHBondContact O-N 2.83Å; R71-D373 VanDerWaalsContact CD-OD2 3.25Å; R71-D373 WeakPolarHBondContact CD-OD2 3.17Å
72	Y	93.8	Very high	93.9	Very high	50 Å²	50	19.1 Å²	19.1	20%	0.196	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-64.9	-27.5	-177.3	-52.9	-57.6	0	0	0	113.8	A69 N70 L74 L75 L145 L149 V264	A69-Y72 WeakPolarHBondContact O-CE1 3.19Å; A69-Y72 PolarHBondContact O-OH 2.91Å; N70-Y72 PolarHBondContact O-N 3.29Å; Y72-L74 PolarHBondContact O-N 2.85Å; Y72-L75 HydrophobicContact CD1-CD1 4.13Å; Y72-L75 WeakPolarHBondContact O-CB 3.39Å; Y72-L75 PolarHBondContact O-N 3.22Å; Y72-L145 HydrophobicContact CD1-CD2 4.34Å; Y72-L145 HydrophobicContact CG-CD2 4.3Å; Y72-L149 HydrophobicContact CD1-CB 4.47Å; Y72-L149 HydrophobicContact CD2-CD2 3.96Å; Y72-L149 HydrophobicContact CE1-CB 4.05Å; Y72-L149 HydrophobicContact CE2-CD1 4.02Å; Y72-L149 HydrophobicContact CE2-CD2 3.83Å; Y72-L149 HydrophobicContact CE2-CG 4.39Å; Y72-L149 HydrophobicContact CG-CD2 4.38Å; Y72-V264 HydrophobicContact CD2-CG1 4.1Å; Y72-V264 HydrophobicContact CE2-CG1 4.33Å
73	D	95.1	Very high	94.2	Very high	10 Å²	10	18.7 Å²	18.7	5%	0.053	10%	0.102	C	C	.	.	G	3₁₀ helix	trans	-59.3	-34	175.6	60.2	-49.1	0	0	0	112	R71 L75 G79 M272	R71-D73 IonicContact CZ-OD1 3.29Å; R71-D73 IonicContact CZ-OD2 2.7Å; R71-D73 IonicContact NE-OD1 3.1Å; R71-D73 PolarHBondContact NE-OD1 3.05Å; R71-D73 IonicContact NE-OD2 3.55Å; R71-D73 PolarHBondContact NE-OD2 3.09Å; R71-D73 IonicContact NH2-OD1 2.91Å; R71-D73 IonicContact NH2-OD2 3.6Å; R71-D73 PolarHBondContact NH2-OD2 2.75Å; R71-D73 PolarHBondContact O-N 2.74Å; D73-L75 VanDerWaalsContact C-N 3.28Å; D73-L75 PolarHBondContact O-N 3.29Å; D73-G79 VanDerWaalsContact O-CA 3.31Å; D73-G79 WeakPolarHBondContact O-CA 3.49Å; D73-M272 HydrophobicContact CB-CE 3.66Å; D73-M272 HydrophobicContact CB-SD 4.3Å
74	L	96.5	Very high	94.3	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.005	10%	0.1	C	C	.	.	G	3₁₀ helix	trans	-80.4	-3.2	-177.9	-55.9	-179.6	0	0	0	114.1	A4 Y31 L33 I67 R71 Y72 C76 L80 A83	A4-L74 WeakPolarHBondContact CB-O 3.32Å; Y31-L74 HydrophobicContact CE1-CD1 4.03Å; L33-L74 HydrophobicContact CD1-CD1 4.42Å; L33-L74 HydrophobicContact CD2-CD1 4.12Å; I67-L74 HydrophobicContact CD1-CB 3.87Å; I67-L74 HydrophobicContact CG1-CB 4.3Å; I67-L74 HydrophobicContact CG2-CB 3.66Å; I67-L74 HydrophobicContact CG2-CD1 4.4Å; R71-L74 HydrophobicContact CB-CD1 3.79Å; R71-L74 HydrophobicContact CB-CG 4.05Å; R71-L74 HydrophobicContact CG-CD1 4.27Å; R71-L74 PolarHBondContact O-N 2.83Å; Y72-L74 PolarHBondContact O-N 2.85Å; L74-C76 PolarHBondContact O-N 2.81Å; L74-L80 HydrophobicContact CB-CD1 4.42Å; L74-L80 HydrophobicContact CD2-CD1 4.21Å; L74-A83 HydrophobicContact CD2-CB 3.44Å; L74-A83 VanDerWaalsContact CD2-CB 3.44Å
75	L	95	Very high	94.5	Very high	3 Å²	3	16.4 Å²	16.4	2%	0.016	9%	0.092	C	C	.	.	G	3₁₀ helix	trans	-74.6	-4.6	-176.1	-69	175.5	0	0	0	114.6	P2 I67 Y72 D73 L141 K144	P2-L75 HydrophobicContact CB-CD2 3.59Å; I67-L75 HydrophobicContact CB-CD2 4.07Å; I67-L75 HydrophobicContact CG1-CD2 4.38Å; I67-L75 HydrophobicContact CG2-CD2 4.04Å; I67-L75 HydrophobicContact CG2-CG 4.48Å; Y72-L75 HydrophobicContact CD1-CD1 4.13Å; Y72-L75 WeakPolarHBondContact O-CB 3.39Å; Y72-L75 PolarHBondContact O-N 3.22Å; D73-L75 VanDerWaalsContact C-N 3.28Å; D73-L75 PolarHBondContact O-N 3.29Å; L75-L141 HydrophobicContact CB-CD1 3.74Å; L75-K144 HydrophobicContact CB-CD 4.37Å; L75-K144 PolarHBondContact O-NZ 2.82Å
76	C	95.3	Very high	94.6	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.095	C	C	.	.	S	Bend	trans	-129.6	155.6	-178.6	65.5	0	0	0	0	112	L74 E78 G79 L80 L141 M272	L74-C76 PolarHBondContact O-N 2.81Å; C76-E78 PolarHBondContact O-N 2.89Å; C76-G79 PolarHBondContact O-N 3.18Å; C76-G79 PolarHBondContact SG-N 2.97Å; C76-G79 VanDerWaalsContact SG-N 3.39Å; C76-L80 WeakPolarHBondContact O-CB 3.16Å; C76-L80 PolarHBondContact O-N 3.32Å; C76-L141 HydrophobicContact CB-CB 4.23Å; C76-L141 HydrophobicContact CB-CD1 4.2Å; C76-L141 HydrophobicContact CB-CD2 4.02Å; C76-L141 HydrophobicContact CB-CG 4.38Å; C76-M272 WeakPolarHBondContact SG-CG 3.42Å; C76-M272 VanDerWaalsContact SG-SD 3.65Å
77	P	95	Very high	94.6	Very high	13 Å²	13	15.4 Å²	15.4	8%	0.084	9%	0.088	C	C	.	.	H	α-helix	trans	-52	-40.2	174.9	-22.3	26.3	0	0	0	114.3	I6 V10 K14 S81 S137	I6-P77 HydrophobicContact CD1-CB 4.3Å; I6-P77 HydrophobicContact CG1-CB 4.27Å; I6-P77 HydrophobicContact CG1-CG 4.02Å; I6-P77 HydrophobicContact CG2-CB 3.92Å; I6-P77 HydrophobicContact CG2-CG 4.03Å; V10-P77 HydrophobicContact CG1-CB 4.05Å; K14-P77 HydrophobicContact CD-CB 4.34Å; P77-S81 VanDerWaalsContact O-CB 3.22Å; P77-S81 WeakPolarHBondContact O-CB 3.44Å; P77-S81 PolarHBondContact O-N 3.48Å; P77-S81 PolarHBondContact O-OG 3.27Å; P77-S137 WeakPolarHBondContact CD-OG 3.46Å
78	E	96.1	Very high	94.6	Very high	4 Å²	4	18.7 Å²	18.7	2%	0.019	10%	0.103	C	C	.	.	H	α-helix	trans	-56.7	-57.8	179.1	-74	72.3	-161.7	0	0	111.6	C76 R82 S137 M272 E275 Y276	C76-E78 PolarHBondContact O-N 2.89Å; E78-R82 WeakPolarHBondContact O-CB 3.46Å; E78-R82 PolarHBondContact O-N 3.42Å; E78-R82 VanDerWaalsContact O-N 3.17Å; E78-S137 PolarHBondContact OE2-OG 2.89Å; E78-M272 HydrophobicContact CB-CB 4.37Å; E78-E275 VanDerWaalsContact CB-OE1 3.26Å; E78-E275 WeakPolarHBondContact CB-OE1 3.07Å; E78-E275 WeakPolarHBondContact CG-OE1 2.79Å; E78-Y276 HydrophobicContact CG-CE2 3.71Å; E78-Y276 VanDerWaalsContact CG-OH 3.26Å; E78-Y276 WeakPolarHBondContact CG-OH 3.21Å; E78-Y276 WeakPolarHBondContact OE1-CE2 3.24Å; E78-Y276 PolarHBondContact OE1-OH 2.86Å
79	G	95.9	Very high	94.7	Very high	2 Å²	2	20.8 Å²	20.8	2%	0.021	12%	0.118	C	C	.	.	H	α-helix	trans	-72.8	-41.7	-176.6	0	0	0	0	0	113.1	D73 C76 R82 A83 M272	D73-G79 VanDerWaalsContact O-CA 3.31Å; D73-G79 WeakPolarHBondContact O-CA 3.49Å; C76-G79 PolarHBondContact O-N 3.18Å; C76-G79 PolarHBondContact SG-N 2.97Å; C76-G79 VanDerWaalsContact SG-N 3.39Å; G79-R82 PolarHBondContact O-N 2.87Å; G79-A83 VanDerWaalsContact O-CB 3.29Å; G79-A83 WeakPolarHBondContact O-CB 3.44Å; G79-A83 PolarHBondContact O-N 3.45Å; G79-M272 WeakPolarHBondContact CA-SD 3.21Å
80	L	96.1	Very high	94.9	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.8	-51.8	178.7	-177	63	0	0	0	111.4	I6 L33 V65 I67 L74 C76 R82 A83 L84	I6-L80 HydrophobicContact CD1-CB 4.18Å; I6-L80 HydrophobicContact CD1-CD2 3.43Å; I6-L80 VanDerWaalsContact CD1-CD2 3.43Å; I6-L80 HydrophobicContact CD1-CG 4.31Å; L33-L80 HydrophobicContact CD1-CD1 3.47Å; L33-L80 VanDerWaalsContact CD1-CD1 3.47Å; V65-L80 HydrophobicContact CB-CD2 4.21Å; V65-L80 HydrophobicContact CG1-CD2 4.48Å; V65-L80 HydrophobicContact CG2-CD2 3.98Å; I67-L80 HydrophobicContact CD1-CD1 4.25Å; L74-L80 HydrophobicContact CB-CD1 4.42Å; L74-L80 HydrophobicContact CD2-CD1 4.21Å; C76-L80 WeakPolarHBondContact O-CB 3.16Å; C76-L80 PolarHBondContact O-N 3.32Å; L80-R82 VanDerWaalsContact C-N 3.29Å; L80-R82 PolarHBondContact O-N 2.88Å; L80-A83 PolarHBondContact O-N 2.92Å; L80-L84 HydrophobicContact CD1-CD1 4.35Å; L80-L84 HydrophobicContact CD1-CG 4.36Å; L80-L84 HydrophobicContact CG-CD1 4.22Å; L80-L84 WeakPolarHBondContact O-CG 3.31Å; L80-L84 PolarHBondContact O-N 2.99Å
81	S	95.4	Very high	95.1	Very high	3 Å²	3	22.1 Å²	22.1	2%	0.021	11%	0.113	C	C	.	.	H	α-helix	trans	-63.4	-39.6	-177.9	-47.1	0	0	0	0	111.1	K14 P77 L84 M85	K14-S81 WeakPolarHBondContact CB-OG 3.49Å; P77-S81 VanDerWaalsContact O-CB 3.22Å; P77-S81 WeakPolarHBondContact O-CB 3.44Å; P77-S81 PolarHBondContact O-N 3.48Å; P77-S81 PolarHBondContact O-OG 3.27Å; S81-L84 PolarHBondContact O-N 3.09Å; S81-M85 WeakPolarHBondContact O-CB 3.22Å; S81-M85 WeakPolarHBondContact O-CG 3.46Å; S81-M85 PolarHBondContact O-N 3.36Å
82	R	95.6	Very high	95	Very high	24 Å²	24	30.4 Å²	30.4	9%	0.091	15%	0.149	C	C	.	.	H	α-helix	trans	-64.1	-44.1	177	-177.3	167.1	62.5	-113.8	0.1	111.7	E78 G79 L80 M85 I86 I91 M272 E275	E78-R82 WeakPolarHBondContact O-CB 3.46Å; E78-R82 PolarHBondContact O-N 3.42Å; E78-R82 VanDerWaalsContact O-N 3.17Å; G79-R82 PolarHBondContact O-N 2.87Å; L80-R82 VanDerWaalsContact C-N 3.29Å; L80-R82 PolarHBondContact O-N 2.88Å; R82-M85 PolarHBondContact O-N 2.95Å; R82-I86 HydrophobicContact CG-CD1 3.9Å; R82-I86 VanDerWaalsContact O-CG1 3.25Å; R82-I86 WeakPolarHBondContact O-CG1 3.4Å; R82-I86 PolarHBondContact O-N 2.82Å; R82-I91 HydrophobicContact CG-CD1 4.04Å; R82-M272 PolarHBondContact NH2-SD 3.36Å; R82-E275 IonicContact NH1-OE1 3.76Å; R82-E275 PolarHBondContact NH1-OE1 2.98Å
83	A	96.2	Very high	94.9	Very high	9 Å²	9	29.6 Å²	29.6	7%	0.074	15%	0.15	C	C	.	.	H	α-helix	trans	-60.2	-45.5	177.2	0	0	0	0	0	111.9	Y31 L74 G79 L80 I86 F87	Y31-A83 HydrophobicContact CE2-CB 4.21Å; L74-A83 HydrophobicContact CD2-CB 3.44Å; L74-A83 VanDerWaalsContact CD2-CB 3.44Å; G79-A83 VanDerWaalsContact O-CB 3.29Å; G79-A83 WeakPolarHBondContact O-CB 3.44Å; G79-A83 PolarHBondContact O-N 3.45Å; L80-A83 PolarHBondContact O-N 2.92Å; A83-I86 PolarHBondContact O-N 2.8Å; A83-F87 WeakPolarHBondContact O-CB 3.48Å; A83-F87 PolarHBondContact O-N 3.39Å
84	L	96.2	Very high	94.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64.4	-41	176.9	-65.7	178.5	0	0	0	112.4	L15 F24 L27 Y31 L80 S81 I86 F87 E88	L15-L84 HydrophobicContact CD2-CB 3.99Å; L15-L84 HydrophobicContact CD2-CD1 4.36Å; F24-L84 HydrophobicContact CE2-CD1 3.9Å; F24-L84 HydrophobicContact CZ-CD1 4.3Å; L27-L84 HydrophobicContact CD1-CD2 4.48Å; L27-L84 HydrophobicContact CD2-CB 4.45Å; L27-L84 HydrophobicContact CD2-CD1 4.24Å; L27-L84 HydrophobicContact CG-CD2 4.18Å; Y31-L84 HydrophobicContact CD2-CD2 4.04Å; Y31-L84 HydrophobicContact CG-CD2 3.98Å; L80-L84 HydrophobicContact CD1-CD1 4.35Å; L80-L84 HydrophobicContact CD1-CG 4.36Å; L80-L84 HydrophobicContact CG-CD1 4.22Å; L80-L84 WeakPolarHBondContact O-CG 3.31Å; L80-L84 PolarHBondContact O-N 2.99Å; S81-L84 PolarHBondContact O-N 3.09Å; L84-I86 VanDerWaalsContact C-N 3.34Å; L84-I86 PolarHBondContact O-N 3.17Å; L84-F87 WeakPolarHBondContact O-CB 3.43Å; L84-F87 PolarHBondContact O-N 2.62Å; L84-E88 PolarHBondContact O-N 3.1Å
85	M	96.3	Very high	94.9	Very high	5 Å²	5	35 Å²	35	3%	0.025	18%	0.183	C	C	.	.	H	α-helix	trans	-66.4	-34.9	177.6	-70.4	-70.5	-75.6	0	0	112.8	L15 Q16 S81 R82 S89 K90 I91	L15-M85 HydrophobicContact CB-SD 4.41Å; L15-M85 HydrophobicContact CD2-CG 3.88Å; L15-M85 HydrophobicContact CD2-SD 4.1Å; L15-M85 VanDerWaalsContact O-SD 3.32Å; Q16-M85 HydrophobicContact CG-CE 4.32Å; S81-M85 WeakPolarHBondContact O-CB 3.22Å; S81-M85 WeakPolarHBondContact O-CG 3.46Å; S81-M85 PolarHBondContact O-N 3.36Å; R82-M85 PolarHBondContact O-N 2.95Å; M85-S89 PolarHBondContact O-N 2.77Å; M85-K90 HydrophobicContact CE-CB 3.75Å; M85-K90 HydrophobicContact CE-CD 3.68Å; M85-K90 HydrophobicContact CE-CG 4.39Å; M85-K90 WeakPolarHBondContact O-CB 3.37Å; M85-K90 PolarHBondContact O-N 2.66Å; M85-K90 HydrophobicContact SD-CB 4.23Å; M85-K90 HydrophobicContact SD-CD 3.45Å; M85-K90 WeakPolarHBondContact SD-CD 3.44Å; M85-K90 HydrophobicContact SD-CG 4.49Å; M85-I91 HydrophobicContact CB-CD1 3.62Å; M85-I91 HydrophobicContact CB-CG1 3.74Å; M85-I91 HydrophobicContact CE-CG2 4.24Å; M85-I91 PolarHBondContact O-N 2.82Å
86	I	96.1	Very high	95	Very high	13 Å²	13	35.2 Å²	35.2	7%	0.067	18%	0.184	C	C	.	.	H	α-helix	trans	-68.2	-42.4	172.7	-67.9	164.8	0	0	0	110	R82 A83 L84 E88 S89 I91 P93 N331	R82-I86 HydrophobicContact CG-CD1 3.9Å; R82-I86 VanDerWaalsContact O-CG1 3.25Å; R82-I86 WeakPolarHBondContact O-CG1 3.4Å; R82-I86 PolarHBondContact O-N 2.82Å; A83-I86 PolarHBondContact O-N 2.8Å; L84-I86 VanDerWaalsContact C-N 3.34Å; L84-I86 PolarHBondContact O-N 3.17Å; I86-E88 PolarHBondContact O-N 2.91Å; I86-S89 VanDerWaalsContact O-CA 3.31Å; I86-S89 WeakPolarHBondContact O-CA 3.34Å; I86-S89 PolarHBondContact O-N 3.01Å; I86-I91 HydrophobicContact CG1-CD1 4.08Å; I86-I91 HydrophobicContact CG1-CG1 3.69Å; I86-P93 HydrophobicContact CD1-CB 4.29Å; I86-P93 HydrophobicContact CD1-CG 4.47Å; I86-P93 HydrophobicContact CG2-CG 4Å; I86-N331 WeakPolarHBondContact CG2-O 3.45Å
87	F	95.8	Very high	95	Very high	7 Å²	7	38.3 Å²	38.3	3%	0.031	20%	0.203	C	C	.	.	H	α-helix	trans	-62.1	-41.3	179.6	-177.9	-99	0	0	0	113.5	L27 S30 Y31 A83 L84 S89 R332 M333	L27-F87 HydrophobicContact CD1-CD1 4.35Å; S30-F87 WeakPolarHBondContact O-CZ 3.08Å; Y31-F87 HydrophobicContact CD2-CB 3.58Å; Y31-F87 HydrophobicContact CD2-CD1 4.17Å; Y31-F87 AromaticContact CD2-CD2 3.5Å; Y31-F87 HydrophobicContact CD2-CD2 3.5Å; Y31-F87 VanDerWaalsContact CD2-CD2 3.5Å; Y31-F87 HydrophobicContact CD2-CE2 4.12Å; Y31-F87 AromaticContact CD2-CG 3.51Å; Y31-F87 HydrophobicContact CD2-CG 3.51Å; Y31-F87 HydrophobicContact CE2-CB 3.81Å; Y31-F87 AromaticContact CE2-CD2 3.96Å; Y31-F87 HydrophobicContact CE2-CD2 3.96Å; Y31-F87 HydrophobicContact CE2-CG 4.11Å; Y31-F87 HydrophobicContact CG-CD2 4.46Å; A83-F87 WeakPolarHBondContact O-CB 3.48Å; A83-F87 PolarHBondContact O-N 3.39Å; L84-F87 WeakPolarHBondContact O-CB 3.43Å; L84-F87 PolarHBondContact O-N 2.62Å; F87-S89 PolarHBondContact O-N 2.87Å; F87-R332 WeakPolarHBondContact CA-O 3.46Å; F87-R332 HydrophobicContact CD2-CB 4.41Å; F87-R332 VanDerWaalsContact CE1-NH2 3.26Å; F87-R332 PolarHBondContact N-O 2.99Å; F87-R332 PolarHBondContact O-NE 2.91Å; F87-M333 HydrophobicContact CD2-SD 3.93Å; F87-M333 HydrophobicContact CE2-SD 4.16Å
88	E	93.6	Very high	95.1	Very high	69 Å²	69	40 Å²	40	32%	0.322	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	4.4	171.2	-69.1	-171.7	122	0	0	113	Y19 L27 L84 I86 K90	Y19-E88 PolarHBondContact OH-OE1 3.41Å; Y19-E88 PolarHBondContact OH-OE2 3.41Å; L27-E88 HydrophobicContact CD1-CG 3.74Å; L84-E88 PolarHBondContact O-N 3.1Å; I86-E88 PolarHBondContact O-N 2.91Å; E88-K90 HydrophobicContact CB-CD 4.14Å; E88-K90 HydrophobicContact CB-CG 4.05Å; E88-K90 PolarHBondContact O-N 3.06Å; E88-K90 VanDerWaalsContact O-N 3.15Å; E88-K90 IonicContact OE1-NZ 3.42Å; E88-K90 WeakPolarHBondContact OE2-CE 3.48Å; E88-K90 IonicContact OE2-NZ 2.76Å; E88-K90 PolarHBondContact OE2-NZ 2.89Å
89	S	92.4	Very high	95	Very high	77 Å²	77	44 Å²	44	54%	0.538	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	23.8	-178.2	-54	0	0	0	0	114.2	M85 I86 F87	M85-S89 PolarHBondContact O-N 2.77Å; I86-S89 VanDerWaalsContact O-CA 3.31Å; I86-S89 WeakPolarHBondContact O-CA 3.34Å; I86-S89 PolarHBondContact O-N 3.01Å; F87-S89 PolarHBondContact O-N 2.87Å
90	K	93	Very high	94.8	Very high	93 Å²	93	51.1 Å²	51.1	40%	0.404	26%	0.261	S	S	.	.	S	Bend	trans	-78.1	-32.5	178.9	-70.3	174.5	173.9	168.2	0	112.3	Y19 M85 E88	Y19-K90 PolarHBondContact OH-NZ 3.26Å; M85-K90 HydrophobicContact CE-CB 3.75Å; M85-K90 HydrophobicContact CE-CD 3.68Å; M85-K90 HydrophobicContact CE-CG 4.39Å; M85-K90 WeakPolarHBondContact O-CB 3.37Å; M85-K90 PolarHBondContact O-N 2.66Å; M85-K90 HydrophobicContact SD-CB 4.23Å; M85-K90 HydrophobicContact SD-CD 3.45Å; M85-K90 WeakPolarHBondContact SD-CD 3.44Å; M85-K90 HydrophobicContact SD-CG 4.49Å; E88-K90 HydrophobicContact CB-CD 4.14Å; E88-K90 HydrophobicContact CB-CG 4.05Å; E88-K90 PolarHBondContact O-N 3.06Å; E88-K90 VanDerWaalsContact O-N 3.15Å; E88-K90 IonicContact OE1-NZ 3.42Å; E88-K90 WeakPolarHBondContact OE2-CE 3.48Å; E88-K90 IonicContact OE2-NZ 2.76Å; E88-K90 PolarHBondContact OE2-NZ 2.89Å
91	I	94	Very high	94.5	Very high	66 Å²	66	53 Å²	53	34%	0.338	27%	0.273	S	S	.	.	S	Bend	trans	-129.7	157	175	68	-179.9	0	0	0	110.3	R82 M85 I86	R82-I91 HydrophobicContact CG-CD1 4.04Å; M85-I91 HydrophobicContact CB-CD1 3.62Å; M85-I91 HydrophobicContact CB-CG1 3.74Å; M85-I91 HydrophobicContact CE-CG2 4.24Å; M85-I91 PolarHBondContact O-N 2.82Å; I86-I91 HydrophobicContact CG1-CD1 4.08Å; I86-I91 HydrophobicContact CG1-CG1 3.69Å
92	K	92	Very high	94	Very high	190 Å²	190	62.3 Å²	62.3	83%	0.826	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-84	152.4	170.5	-66	-174	179.6	-175.4	0	110.4
93	P	92.2	Very high	93.7	Very high	33 Å²	33	68.2 Å²	68.2	21%	0.214	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-56.3	131.5	171.5	-21.9	33.4	0	0	0	110.3	I86	I86-P93 HydrophobicContact CD1-CB 4.29Å; I86-P93 HydrophobicContact CD1-CG 4.47Å; I86-P93 HydrophobicContact CG2-CG 4Å
94	P	94.6	Very high	93.6	Very high	21 Å²	21	69.5 Å²	69.5	14%	0.136	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-68.4	151.9	176	30.9	-36.8	0	0	0	110.9	F96 F281 Y303	P94-F96 HydrophobicContact CG-CE1 4.47Å; P94-F96 HydrophobicContact CG-CE2 3.87Å; P94-F96 HydrophobicContact CG-CZ 3.74Å; P94-F281 HydrophobicContact CB-CB 4.39Å; P94-F281 HydrophobicContact CB-CD1 3.54Å; P94-F281 HydrophobicContact CB-CD2 3.71Å; P94-F281 HydrophobicContact CB-CE1 3.58Å; P94-F281 HydrophobicContact CB-CE2 3.77Å; P94-F281 HydrophobicContact CB-CG 3.59Å; P94-F281 HydrophobicContact CB-CZ 3.7Å; P94-F281 HydrophobicContact CG-CD1 3.99Å; P94-F281 HydrophobicContact CG-CE1 3.83Å; P94-F281 HydrophobicContact CG-CZ 4.25Å; P94-Y303 PolarHBondContact O-OH 3.01Å
95	V	95.5	Very high	93.7	Very high	102 Å²	102	70 Å²	70	62%	0.618	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-98.6	116.2	171.1	-178.3	0	0	0	0	108.1	V97 Y303	V95-V97 HydrophobicContact CG1-CG2 4.17Å; V95-Y303 WeakPolarHBondContact CA-OH 3.43Å
96	F	97.3	Very high	93.7	Very high	9 Å²	9	72.6 Å²	72.6	4%	0.039	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-84.2	132.1	177.4	-63.8	-77.3	0	0	0	110.3	P94 T271 F281 L301 Y303 P369 T370	P94-F96 HydrophobicContact CG-CE1 4.47Å; P94-F96 HydrophobicContact CG-CE2 3.87Å; P94-F96 HydrophobicContact CG-CZ 3.74Å; F96-T271 HydrophobicContact CD1-CG2 3.77Å; F96-T271 HydrophobicContact CD2-CG2 4.13Å; F96-T271 HydrophobicContact CE1-CG2 3.86Å; F96-T271 VanDerWaalsContact CE1-O 3.22Å; F96-T271 WeakPolarHBondContact CE1-O 3.15Å; F96-T271 HydrophobicContact CE2-CG2 4.23Å; F96-T271 HydrophobicContact CG-CG2 3.9Å; F96-T271 HydrophobicContact CZ-CG2 4.1Å; F96-F281 WeakPolarHBondContact CA-O 3.29Å; F96-F281 HydrophobicContact CD1-CB 4.01Å; F96-F281 HydrophobicContact CD1-CD1 4.2Å; F96-F281 HydrophobicContact CE1-CB 4.29Å; F96-F281 AromaticContact CE1-CD1 3.61Å; F96-F281 HydrophobicContact CE1-CD1 3.61Å; F96-F281 HydrophobicContact CE1-CE1 4.47Å; F96-F281 HydrophobicContact CE1-CG 4.4Å; F96-F281 HydrophobicContact CZ-CD1 4.2Å; F96-L301 HydrophobicContact CB-CD1 4.33Å; F96-Y303 HydrophobicContact CB-CE2 4.33Å; F96-Y303 WeakPolarHBondContact CD2-OH 3.37Å; F96-Y303 PolarHBondContact N-OH 3.29Å; F96-P369 HydrophobicContact CB-CG 3.97Å; F96-P369 HydrophobicContact CD2-CG 3.92Å; F96-P369 HydrophobicContact CG-CG 4.19Å; F96-T370 HydrophobicContact CD2-CG2 4.41Å; F96-T370 HydrophobicContact CE2-CG2 3.55Å; F96-T370 HydrophobicContact CZ-CG2 3.77Å
97	V	96.4	Very high	93.8	Very high	64 Å²	64	72 Å²	72	39%	0.388	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	133.3	-175.7	-176	0	0	0	0	110.5	V95 F281 T282 A283	V95-V97 HydrophobicContact CG1-CG2 4.17Å; V97-F281 PolarHBondContact N-O 3.47Å; V97-T282 WeakPolarHBondContact O-CA 3.13Å; V97-A283 PolarHBondContact O-N 2.79Å
98	T	96.1	Very high	94	Very high	50 Å²	50	73.9 Å²	73.9	31%	0.307	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	133.2	169.9	-160.5	0	0	0	0	109.8	A283 S285 P299 S300	T98-A283 CarbonylContact C-O 3.49Å; T98-A283 WeakPolarHBondContact CA-O 3.43Å; T98-S285 PolarHBondContact OG1-OG 2.97Å; T98-P299 PolarHBondContact OG1-O 2.95Å; T98-S300 WeakPolarHBondContact CG2-O 3.5Å
99	K	94.7	Very high	94.2	Very high	87 Å²	87	70.8 Å²	70.8	38%	0.378	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	136.2	178.9	-75.4	-167.6	-178	-175.3	0	111.7	P101 E279 T282 A283 S285	K99-P101 WeakPolarHBondContact O-CD 3.44Å; K99-E279 WeakPolarHBondContact CE-OE1 2.99Å; K99-E279 IonicContact NZ-OE1 3.87Å; K99-E279 PolarHBondContact NZ-OE1 3.42Å; K99-E279 IonicContact NZ-OE2 3.76Å; K99-E279 PolarHBondContact NZ-OE2 2.92Å; K99-T282 HydrophobicContact CB-CG2 4.36Å; K99-T282 HydrophobicContact CD-CG2 3.65Å; K99-T282 HydrophobicContact CG-CG2 3.71Å; K99-A283 PolarHBondContact N-O 2.68Å; K99-S285 PolarHBondContact O-N 3.23Å; K99-S285 PolarHBondContact O-OG 3.34Å
100	K	92	Very high	94.4	Very high	151 Å²	151	69.9 Å²	69.9	66%	0.657	35%	0.35	S	S	*	.			trans	-98.2	105	171.1	179.8	175.7	175.7	172.5	0	110.4	L104	K100-L104 HydrophobicContact CG-CD1 4.33Å
101	P	89.1	Confident	94.4	Very high	39 Å²	39	69.6 Å²	69.6	25%	0.253	36%	0.357	S	S	.	.			trans	-69.4	163.6	172.6	31	-36.8	0	0	0	111.1	K99 L104 E284	K99-P101 WeakPolarHBondContact O-CD 3.44Å; P101-L104 HydrophobicContact CG-CD1 4.37Å; P101-E284 HydrophobicContact CG-CG 3.9Å
102	Q	85.4	Confident	94.4	Very high	199 Å²	199	67.5 Å²	67.5	93%	0.93	35%	0.349	S	S	*	.	S	Bend	trans	-61.6	-45	174.4	-70	-179	-7.1	0	0	111.5	L104	Q102-L104 PolarHBondContact O-N 3.23Å
103	N	88.9	Confident	94.4	Very high	148 Å²	148	58.4 Å²	58.4	79%	0.791	31%	0.309	S	S	*	.	S	Bend	trans	-94.3	83.7	174.6	-68.7	-16.1	0	0	0	109.2
104	L	93.9	Very high	94.4	Very high	36 Å²	36	60.4 Å²	60.4	19%	0.188	32%	0.316	C	S	.	.			trans	-71.3	126.9	-178.8	-171.2	61.5	0	0	0	111.1	K100 P101 Q102 S285 E287 L297	K100-L104 HydrophobicContact CG-CD1 4.33Å; P101-L104 HydrophobicContact CG-CD1 4.37Å; Q102-L104 PolarHBondContact O-N 3.23Å; L104-S285 WeakPolarHBondContact CD1-O 3.15Å; L104-E287 HydrophobicContact CD2-CB 3.66Å; L104-E287 HydrophobicContact CD2-CG 4.39Å; L104-E287 HydrophobicContact CG-CB 4.03Å; L104-L297 HydrophobicContact CD2-CD2 3.83Å
105	I	97.6	Very high	94	Very high	11 Å²	11	63.5 Å²	63.5	6%	0.056	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	133	173.6	-67.7	178	0	0	0	108.8	V124 L163 P168 F170 V286 E287	I105-V124 HydrophobicContact CD1-CG2 4.2Å; I105-L163 HydrophobicContact CD1-CD1 4.05Å; I105-L163 HydrophobicContact CD1-CD2 3.82Å; I105-P168 HydrophobicContact CD1-CG 4.07Å; I105-P168 HydrophobicContact CG1-CB 4.25Å; I105-P168 HydrophobicContact CG1-CG 4.04Å; I105-P168 HydrophobicContact CG2-CB 4.17Å; I105-P168 HydrophobicContact CG2-CG 4.34Å; I105-F170 HydrophobicContact CG2-CD2 3.78Å; I105-F170 HydrophobicContact CG2-CE2 3.62Å; I105-V286 HydrophobicContact CB-CG2 4.49Å; I105-V286 HydrophobicContact CG2-CG1 4.17Å; I105-V286 HydrophobicContact CG2-CG2 4.35Å; I105-E287 PolarHBondContact O-N 2.89Å
106	Q	98	Very high	93.8	Very high	60 Å²	60	59.6 Å²	59.6	28%	0.28	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	139.2	178.6	-64.4	-177.3	-25.6	0	0	111.1	H108 P169 F170 E287 I289	Q106-H108 PolarHBondContact OE1-NE2 3.43Å; Q106-P169 HydrophobicContact CB-CB 4.12Å; Q106-P169 WeakPolarHBondContact O-CA 3.11Å; Q106-P169 WeakPolarHBondContact O-CB 3.46Å; Q106-F170 PolarHBondContact O-N 2.83Å; Q106-E287 CarbonylContact C-O 3.55Å; Q106-E287 VanDerWaalsContact CA-O 3.32Å; Q106-E287 WeakPolarHBondContact CA-O 3.23Å; Q106-E287 HydrophobicContact CG-CB 4.3Å; Q106-E287 PolarHBondContact NE2-OE2 3.36Å; Q106-I289 HydrophobicContact CB-CD1 4.28Å; Q106-I289 HydrophobicContact CG-CD1 4.16Å
107	L	98.4	Very high	93.6	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	111.7	170.9	175.2	63.3	0	0	0	109.2	V120 A122 F170 I222 V286 E287 V288 I289	L107-V120 HydrophobicContact CD2-CB 4.35Å; L107-V120 HydrophobicContact CD2-CG1 3.76Å; L107-V120 HydrophobicContact CD2-CG2 3.63Å; L107-V120 HydrophobicContact CG-CG1 4.33Å; L107-A122 HydrophobicContact CD2-CB 4.04Å; L107-F170 CarbonylContact C-O 3.44Å; L107-F170 WeakPolarHBondContact CA-O 3.42Å; L107-F170 HydrophobicContact CB-CB 4.44Å; L107-F170 HydrophobicContact CD1-CB 3.47Å; L107-F170 VanDerWaalsContact CD1-CB 3.47Å; L107-I222 HydrophobicContact CD1-CG2 4.3Å; L107-V286 HydrophobicContact CB-CG1 4.11Å; L107-E287 PolarHBondContact N-O 3.17Å; L107-V288 HydrophobicContact CB-CG2 4.35Å; L107-V288 HydrophobicContact CD2-CG2 4.28Å; L107-V288 WeakPolarHBondContact O-CA 3.39Å; L107-I289 PolarHBondContact O-N 3.46Å
108	H	98.3	Very high	93.5	Very high	47 Å²	47	57.4 Å²	57.4	22%	0.218	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	120.9	-175.9	-65.2	-101.1	0	0	0	110.8	Q106 F170 F171 Y172 I289	Q106-H108 PolarHBondContact OE1-NE2 3.43Å; H108-F170 PolarHBondContact N-O 3.03Å; H108-F171 HydrophobicContact CB-CD1 3.7Å; H108-F171 HydrophobicContact CB-CE1 4.01Å; H108-F171 CarbonylContact O-C 3.58Å; H108-F171 WeakPolarHBondContact O-CA 3.41Å; H108-Y172 PolarHBondContact O-N 3.18Å; H108-I289 VanDerWaalsContact CE1-CD1 3.49Å; H108-I289 WeakPolarHBondContact CE1-CD1 3.36Å
109	V	97.6	Very high	93.5	Very high	3 Å²	3	58.1 Å²	58.1	2%	0.018	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	119.1	178.1	-174.3	0	0	0	0	109.8	V120 Y172 V288 I289 H291	V109-V120 HydrophobicContact CG2-CG1 3.44Å; V109-V120 VanDerWaalsContact CG2-CG1 3.44Å; V109-Y172 HydrophobicContact CG1-CD1 4.01Å; V109-V288 HydrophobicContact CG2-CG1 3.73Å; V109-I289 PolarHBondContact N-O 3.05Å; V109-H291 WeakPolarHBondContact O-CA 3.34Å; V109-H291 WeakPolarHBondContact O-CB 3.27Å; V109-H291 PolarHBondContact O-N 3.41Å
110	L	96.7	Very high	93.7	Very high	59 Å²	59	54 Å²	54	31%	0.309	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-90.1	150.4	-179.5	-61.3	-171.9	0	0	0	112.3	S112 T113 Y172 D173	L110-S112 PolarHBondContact O-N 3.46Å; L110-T113 PolarHBondContact O-N 3.12Å; L110-T113 PolarHBondContact O-OG1 3.44Å; L110-Y172 PolarHBondContact N-O 2.91Å; L110-D173 HydrophobicContact CB-CB 4.4Å; L110-D173 HydrophobicContact CD1-CB 3.87Å; L110-D173 HydrophobicContact CG-CB 4.44Å
111	P	94.6	Very high	94	Very high	86 Å²	86	46.8 Å²	46.8	56%	0.558	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-58.4	-25.1	-175.1	-21.7	27	0	0	0	115.2	T113 Q114 H291	P111-T113 PolarHBondContact O-N 3.5Å; P111-Q114 WeakPolarHBondContact O-CB 3.47Å; P111-Q114 VanDerWaalsContact O-CG 3.31Å; P111-Q114 WeakPolarHBondContact O-CG 3.12Å; P111-Q114 PolarHBondContact O-N 3.4Å; P111-H291 HydrophobicContact CB-CB 4.4Å; P111-H291 HydrophobicContact CG-CB 3.94Å
112	S	93.3	Very high	94.4	Very high	22 Å²	22	44.9 Å²	44.9	15%	0.154	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-60.5	-29.2	-179	55.3	0	0	0	0	113.2	L110 Q114 S115 D173 A174	L110-S112 PolarHBondContact O-N 3.46Å; S112-Q114 VanDerWaalsContact C-N 3.28Å; S112-Q114 PolarHBondContact O-N 3.18Å; S112-S115 PolarHBondContact O-OG 3.42Å; S112-D173 WeakPolarHBondContact CB-OD1 3.35Å; S112-D173 PolarHBondContact OG-OD1 2.77Å; S112-A174 WeakPolarHBondContact CB-O 3Å; S112-A174 PolarHBondContact OG-N 3.32Å
113	T	92.1	Very high	95	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-70.4	-23.1	-178	61.8	0	0	0	0	113	L110 P111 S115 I116 R117 Y172	L110-T113 PolarHBondContact O-N 3.12Å; L110-T113 PolarHBondContact O-OG1 3.44Å; P111-T113 PolarHBondContact O-N 3.5Å; T113-S115 PolarHBondContact O-N 2.84Å; T113-S115 VanDerWaalsContact O-N 3.15Å; T113-I116 PolarHBondContact O-N 2.93Å; T113-R117 CarbonylContact O-C 3.09Å; T113-R117 PolarHBondContact O-N 2.83Å; T113-Y172 HydrophobicContact CG2-CD1 3.78Å; T113-Y172 HydrophobicContact CG2-CD2 4.16Å; T113-Y172 HydrophobicContact CG2-CE1 3.75Å; T113-Y172 HydrophobicContact CG2-CE2 4.17Å; T113-Y172 HydrophobicContact CG2-CG 3.97Å; T113-Y172 WeakPolarHBondContact CG2-O 3.35Å
114	Q	91.8	Very high	95.5	Very high	75 Å²	75	28.4 Å²	28.4	35%	0.35	16%	0.156	S	C	.	.	G	3₁₀ helix	trans	-58.9	-32.3	-174.2	-64.1	-59.6	-56.1	0	0	113.5	P111 S112 I116 P118 H291	P111-Q114 WeakPolarHBondContact O-CB 3.47Å; P111-Q114 VanDerWaalsContact O-CG 3.31Å; P111-Q114 WeakPolarHBondContact O-CG 3.12Å; P111-Q114 PolarHBondContact O-N 3.4Å; S112-Q114 VanDerWaalsContact C-N 3.28Å; S112-Q114 PolarHBondContact O-N 3.18Å; Q114-I116 PolarHBondContact O-N 2.89Å; Q114-P118 PolarHBondContact NE2-O 3.23Å; Q114-H291 VanDerWaalsContact CD-CE1 3.5Å; Q114-H291 PolarHBondContact NE2-ND1 2.99Å
115	S	87.3	Confident	95.7	Very high	85 Å²	85	26.7 Å²	26.7	59%	0.594	15%	0.147	S	C	*	.	G	3₁₀ helix	trans	-77.2	-6	-178.8	63.3	0	0	0	0	114.5	S112 T113	S112-S115 PolarHBondContact O-OG 3.42Å; T113-S115 PolarHBondContact O-N 2.84Å; T113-S115 VanDerWaalsContact O-N 3.15Å
116	I	89.9	Confident	95.7	Very high	20 Å²	20	30 Å²	30	10%	0.103	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.3	-63.8	-170.7	-47.4	175.9	0	0	0	111.2	T113 Q114 A174 I213 K216 K218 P220	T113-I116 PolarHBondContact O-N 2.93Å; Q114-I116 PolarHBondContact O-N 2.89Å; I116-A174 HydrophobicContact CD1-CB 4.01Å; I116-I213 HydrophobicContact CG2-CG2 3.96Å; I116-K216 HydrophobicContact CD1-CB 4.34Å; I116-K216 HydrophobicContact CG2-CG 4.32Å; I116-K218 HydrophobicContact CD1-CB 4.17Å; I116-K218 WeakPolarHBondContact CD1-O 3.5Å; I116-P220 HydrophobicContact CG2-CG 4.05Å
117	R	94	Very high	95.7	Very high	7 Å²	7	31.8 Å²	31.8	3%	0.026	17%	0.17	C	C	.	.			trans	-147.8	86.6	-176.6	-70.9	-178.3	94.3	103.4	-1	108.2	T113 F119 R153 S154 Y172 T255 G256 T257	T113-R117 CarbonylContact O-C 3.09Å; T113-R117 PolarHBondContact O-N 2.83Å; R117-F119 VanDerWaalsContact C-N 3.3Å; R117-F119 PolarHBondContact O-N 2.87Å; R117-R153 VanDerWaalsContact CZ-O 3.28Å; R117-R153 PolarHBondContact NH1-O 3.36Å; R117-R153 PolarHBondContact NH2-O 3.22Å; R117-S154 PolarHBondContact NH1-O 2.84Å; R117-S154 PolarHBondContact NH2-O 2.86Å; R117-Y172 VanDerWaalsContact CB-OH 3.26Å; R117-Y172 WeakPolarHBondContact CB-OH 3.38Å; R117-Y172 VanDerWaalsContact O-CE1 3.29Å; R117-Y172 WeakPolarHBondContact O-CE1 3.33Å; R117-Y172 PolarHBondContact O-OH 3.23Å; R117-T255 PolarHBondContact NH2-O 3.39Å; R117-G256 CarbonylContact C-O 3.57Å; R117-T257 HydrophobicContact CG-CG2 4.15Å
118	P	94.4	Very high	95.7	Very high	21 Å²	21	31.8 Å²	31.8	14%	0.136	17%	0.17	C	C	.	.			trans	-69.1	-21.5	-166.3	24.4	-34.6	0	0	0	114.9	Q114	Q114-P118 PolarHBondContact NE2-O 3.23Å
119	F	96.6	Very high	95.6	Very high	64 Å²	64	33.5 Å²	33.5	28%	0.281	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	142.8	-169.6	-53.5	-60.5	0	0	0	112	R117 T255 G256 T257 L259	R117-F119 VanDerWaalsContact C-N 3.3Å; R117-F119 PolarHBondContact O-N 2.87Å; F119-T255 CarbonylContact O-C 3.54Å; F119-T255 WeakPolarHBondContact O-CA 3.47Å; F119-G256 PolarHBondContact N-O 3.43Å; F119-G256 VanDerWaalsContact N-O 3.15Å; F119-G256 PolarHBondContact O-N 2.98Å; F119-T257 WeakPolarHBondContact CE2-O 3.36Å; F119-L259 HydrophobicContact CB-CB 4.36Å; F119-L259 HydrophobicContact CB-CD1 4.2Å; F119-L259 HydrophobicContact CD1-CB 4.09Å; F119-L259 HydrophobicContact CD1-CD1 4.4Å; F119-L259 HydrophobicContact CD2-CB 3.97Å; F119-L259 HydrophobicContact CE1-CB 4.4Å; F119-L259 HydrophobicContact CE2-CB 4.3Å; F119-L259 HydrophobicContact CG-CB 3.87Å; F119-L259 HydrophobicContact CG-CD1 4.38Å
120	V	97.8	Very high	95.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	140.4	166.3	63.2	0	0	0	0	109.1	L107 V109 Y172 I222 E253 A254 T255 V288	L107-V120 HydrophobicContact CD2-CB 4.35Å; L107-V120 HydrophobicContact CD2-CG1 3.76Å; L107-V120 HydrophobicContact CD2-CG2 3.63Å; L107-V120 HydrophobicContact CG-CG1 4.33Å; V109-V120 HydrophobicContact CG2-CG1 3.44Å; V109-V120 VanDerWaalsContact CG2-CG1 3.44Å; V120-Y172 HydrophobicContact CB-CD1 3.77Å; V120-Y172 HydrophobicContact CB-CE1 4.07Å; V120-Y172 HydrophobicContact CB-CG 4.39Å; V120-Y172 HydrophobicContact CG1-CD1 3.54Å; V120-Y172 HydrophobicContact CG1-CE1 4.27Å; V120-Y172 HydrophobicContact CG1-CG 4.13Å; V120-I222 HydrophobicContact CG2-CD1 4.31Å; V120-E253 HydrophobicContact CG2-CB 4.37Å; V120-A254 WeakPolarHBondContact CA-O 3.27Å; V120-T255 HydrophobicContact CB-CG2 4.06Å; V120-T255 HydrophobicContact CG2-CG2 3.69Å; V120-V288 HydrophobicContact CG1-CG1 4.25Å
121	V	98.1	Very high	95.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	153.5	170.1	-59.2	0	0	0	0	108.2	E253 A254 L259 A262 I263 L266 Y298	V121-E253 CarbonylContact O-C 3.58Å; V121-E253 WeakPolarHBondContact O-CA 3.48Å; V121-A254 HydrophobicContact CG2-CB 3.82Å; V121-A254 PolarHBondContact N-O 3.46Å; V121-A254 PolarHBondContact O-N 3.48Å; V121-L259 HydrophobicContact CG1-CD1 3.76Å; V121-A262 HydrophobicContact CG2-CB 3.92Å; V121-A262 WeakPolarHBondContact CG2-O 3.22Å; V121-I263 HydrophobicContact CG1-CG1 4.03Å; V121-L266 HydrophobicContact CB-CD2 3.96Å; V121-L266 HydrophobicContact CG2-CB 3.92Å; V121-L266 HydrophobicContact CG2-CD2 3.76Å; V121-L266 HydrophobicContact CG2-CG 4.41Å; V121-Y298 HydrophobicContact CB-CD1 3.95Å; V121-Y298 HydrophobicContact CB-CD2 4.07Å; V121-Y298 HydrophobicContact CB-CE1 4.29Å; V121-Y298 HydrophobicContact CB-CE2 4.38Å; V121-Y298 HydrophobicContact CB-CG 3.83Å; V121-Y298 HydrophobicContact CG1-CD1 3.75Å; V121-Y298 HydrophobicContact CG1-CD2 3.97Å; V121-Y298 HydrophobicContact CG1-CE1 3.57Å; V121-Y298 HydrophobicContact CG1-CE2 3.77Å; V121-Y298 HydrophobicContact CG1-CG 3.95Å
122	A	98.4	Very high	95.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	159.8	-178.9	0	0	0	0	0	112.3	L107 F251 I252 E253 V286 Y298	L107-A122 HydrophobicContact CD2-CB 4.04Å; A122-F251 HydrophobicContact CB-CE2 3.67Å; A122-F251 HydrophobicContact CB-CZ 3.61Å; A122-I252 CarbonylContact C-O 3.53Å; A122-I252 WeakPolarHBondContact CA-O 3.31Å; A122-I252 WeakPolarHBondContact CB-O 3.48Å; A122-E253 HydrophobicContact CB-CB 4.16Å; A122-V286 HydrophobicContact CB-CB 4.17Å; A122-V286 HydrophobicContact CB-CG1 4.05Å; A122-V286 HydrophobicContact CB-CG2 4.3Å; A122-Y298 CarbonylContact O-C 3.59Å; A122-Y298 WeakPolarHBondContact O-CB 3.48Å
123	G	98.1	Very high	95.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	165.9	176.7	0	0	0	0	0	111.5	I252	G123-I252 PolarHBondContact N-O 3.34Å; G123-I252 PolarHBondContact O-N 3.25Å
124	V	98.5	Very high	95.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	133.8	-177.8	175.2	0	0	0	0	111.6	I105 R126 L163 V250 F251 E284 V286	I105-V124 HydrophobicContact CD1-CG2 4.2Å; V124-R126 HydrophobicContact CG1-CG 4.04Å; V124-L163 HydrophobicContact CG1-CD2 3.68Å; V124-L163 HydrophobicContact CG2-CD2 4.08Å; V124-V250 WeakPolarHBondContact CA-O 3.19Å; V124-F251 HydrophobicContact CG2-CB 4.42Å; V124-F251 HydrophobicContact CG2-CD2 3.83Å; V124-E284 HydrophobicContact CB-CB 3.89Å; V124-E284 HydrophobicContact CB-CG 4.08Å; V124-E284 HydrophobicContact CG1-CB 4.24Å; V124-E284 HydrophobicContact CG1-CG 4.48Å; V124-E284 PolarHBondContact N-O 2.97Å; V124-E284 PolarHBondContact O-N 2.89Å; V124-V286 HydrophobicContact CG2-CG2 3.85Å
125	L	98.3	Very high	95.5	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	122.9	167.3	-62.9	-178.2	0	0	0	108.8	I128 N249 V250 I252 I270 F273	L125-I128 HydrophobicContact CB-CD1 4.46Å; L125-I128 HydrophobicContact CD1-CD1 3.94Å; L125-N249 WeakPolarHBondContact O-CA 3.35Å; L125-V250 HydrophobicContact CB-CB 4.42Å; L125-V250 PolarHBondContact N-O 3.29Å; L125-V250 PolarHBondContact O-N 2.82Å; L125-I252 HydrophobicContact CD1-CD1 3.94Å; L125-I252 HydrophobicContact CG-CD1 4.26Å; L125-I270 HydrophobicContact CD2-CB 4.5Å; L125-I270 HydrophobicContact CD2-CG1 4.36Å; L125-I270 HydrophobicContact CD2-CG2 4.1Å; L125-F273 HydrophobicContact CD1-CB 3.75Å
126	R	97.8	Very high	95.8	Very high	81 Å²	81	39.1 Å²	39.1	31%	0.306	20%	0.201	S	C	.	.			trans	-104.6	141	-175.3	-72.9	-65.7	-170.1	-179.4	-6.6	112.5	V124 I128 N249 C277 G278 E284	V124-R126 HydrophobicContact CG1-CG 4.04Å; R126-I128 PolarHBondContact O-N 2.95Å; R126-N249 WeakPolarHBondContact CA-OD1 3.42Å; R126-N249 WeakPolarHBondContact CD-OD1 3.41Å; R126-C277 WeakPolarHBondContact O-CB 3.33Å; R126-G278 PolarHBondContact O-N 3.3Å; R126-E284 HydrophobicContact CG-CB 4.35Å; R126-E284 WeakPolarHBondContact CG-OE2 3.33Å; R126-E284 IonicContact CZ-OE1 2.79Å; R126-E284 IonicContact CZ-OE2 2.81Å; R126-E284 IonicContact NE-OE1 3.81Å; R126-E284 IonicContact NE-OE2 3.17Å; R126-E284 PolarHBondContact NE-OE2 2.8Å; R126-E284 IonicContact NH2-OE1 2.68Å; R126-E284 PolarHBondContact NH2-OE1 3.43Å; R126-E284 IonicContact NH2-OE2 3.33Å; R126-E284 PolarHBondContact NH2-OE2 3.4Å
127	N	97.6	Very high	96.1	Very high	97 Å²	97	38.6 Å²	38.6	52%	0.519	20%	0.199	S	C	.	.	S	Bend	trans	50.6	39.1	178.4	-57.8	-49.3	0	0	0	113.2	R248 N249 G278	N127-R248 CarbonylContact C-O 3.56Å; N127-R248 WeakPolarHBondContact CA-O 3.26Å; N127-R248 PolarHBondContact N-O 2.94Å; N127-N249 PolarHBondContact N-OD1 3.22Å; N127-N249 VanDerWaalsContact N-OD1 3.08Å; N127-G278 PolarHBondContact O-N 3.46Å; N127-G278 VanDerWaalsContact O-N 3.08Å
128	I	97.5	Very high	96.2	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	20%	0.199	C	C	.	.			trans	-70	138.2	-179.8	-164.5	169.9	0	0	0	111.2	L125 R126 L130 R248 V250 F273 Y276	L125-I128 HydrophobicContact CB-CD1 4.46Å; L125-I128 HydrophobicContact CD1-CD1 3.94Å; R126-I128 PolarHBondContact O-N 2.95Å; I128-L130 HydrophobicContact CD1-CD2 3.71Å; I128-L130 HydrophobicContact CD1-CG 4.17Å; I128-L130 HydrophobicContact CG1-CD2 3.94Å; I128-L130 HydrophobicContact CG1-CG 4.08Å; I128-L130 HydrophobicContact CG2-CD1 4.18Å; I128-L130 HydrophobicContact CG2-CG 4.11Å; I128-R248 WeakPolarHBondContact CG2-O 3.07Å; I128-R248 PolarHBondContact N-O 3.33Å; I128-R248 WeakPolarHBondContact O-CD 3.39Å; I128-V250 HydrophobicContact CG2-CG2 3.79Å; I128-F273 HydrophobicContact CD1-CB 4.24Å; I128-Y276 WeakPolarHBondContact CA-O 3.28Å
129	V	97.8	Very high	96.3	Very high	82 Å²	82	41 Å²	41	50%	0.497	21%	0.21	S	C	.	.			trans	-106.4	99.5	176.4	-176.6	0	0	0	0	110.2	K134 Y276	V129-K134 WeakPolarHBondContact O-CD 3.26Å; V129-Y276 PolarHBondContact N-O 2.79Å
130	L	94.7	Very high	96.2	Very high	10 Å²	10	41 Å²	41	5%	0.052	21%	0.213	C	C	.	.			trans	-102.7	120.7	179.7	-61.2	175.6	0	0	0	111.3	I128 K134 L135 T245	I128-L130 HydrophobicContact CD1-CD2 3.71Å; I128-L130 HydrophobicContact CD1-CG 4.17Å; I128-L130 HydrophobicContact CG1-CD2 3.94Å; I128-L130 HydrophobicContact CG1-CG 4.08Å; I128-L130 HydrophobicContact CG2-CD1 4.18Å; I128-L130 HydrophobicContact CG2-CG 4.11Å; L130-K134 HydrophobicContact CD2-CB 4.01Å; L130-L135 HydrophobicContact CD1-CD1 4.46Å; L130-T245 WeakPolarHBondContact O-CA 3.2Å; L130-T245 WeakPolarHBondContact O-CB 3.44Å
131	D	94	Very high	96.1	Very high	67 Å²	67	41 Å²	41	36%	0.358	21%	0.213	S	C	.	.			trans	-94.6	179.3	160.1	56.1	47.9	0	0	0	109.8	S133 K134 L135	D131-S133 VanDerWaalsContact C-N 3.29Å; D131-S133 PolarHBondContact O-N 3.02Å; D131-S133 WeakPolarHBondContact OD1-CB 3.13Å; D131-S133 PolarHBondContact OD1-N 3.43Å; D131-S133 VanDerWaalsContact OD1-N 3.09Å; D131-K134 PolarHBondContact O-N 3.4Å; D131-K134 WeakPolarHBondContact OD1-CG 3.43Å; D131-K134 PolarHBondContact OD1-N 3.36Å; D131-K134 WeakPolarHBondContact OD2-CD 3.34Å; D131-K134 VanDerWaalsContact OD2-CE 3.27Å; D131-K134 WeakPolarHBondContact OD2-CE 3.41Å; D131-K134 IonicContact OD2-NZ 2.58Å; D131-K134 PolarHBondContact OD2-NZ 3.36Å; D131-L135 WeakPolarHBondContact O-CB 3.42Å; D131-L135 PolarHBondContact O-N 2.98Å
132	E	92.9	Very high	96.1	Very high	147 Å²	147	42 Å²	42	69%	0.687	22%	0.218	S	C	*	.	H	α-helix	trans	-61.4	-37.3	-178.8	-66.8	-175.3	169.4	0	0	112.4	N136 T245	E132-N136 WeakPolarHBondContact O-CB 3.22Å; E132-N136 PolarHBondContact O-N 3.49Å; E132-N136 PolarHBondContact O-ND2 2.86Å; E132-T245 HydrophobicContact CG-CG2 4.05Å
133	S	91.2	Very high	95.8	Very high	56 Å²	56	45.1 Å²	45.1	39%	0.392	23%	0.232	S	C	.	.	H	α-helix	trans	-66.1	-48.3	179.4	-179.5	0	0	0	0	111.2	V10 D131 L135 N136 S137	V10-S133 WeakPolarHBondContact CG2-OG 3.4Å; D131-S133 VanDerWaalsContact C-N 3.29Å; D131-S133 PolarHBondContact O-N 3.02Å; D131-S133 WeakPolarHBondContact OD1-CB 3.13Å; D131-S133 PolarHBondContact OD1-N 3.43Å; D131-S133 VanDerWaalsContact OD1-N 3.09Å; S133-L135 PolarHBondContact O-N 2.84Å; S133-N136 PolarHBondContact O-N 3.14Å; S133-S137 PolarHBondContact O-N 2.88Å
134	K	94.7	Very high	95.7	Very high	43 Å²	43	46.6 Å²	46.6	19%	0.187	24%	0.239	C	C	.	.	H	α-helix	trans	-63.7	-40.8	177.7	-67	170.9	-174.5	136.2	0	112.2	V129 L130 D131 S137 F138 F273 Y276	V129-K134 WeakPolarHBondContact O-CD 3.26Å; L130-K134 HydrophobicContact CD2-CB 4.01Å; D131-K134 PolarHBondContact O-N 3.4Å; D131-K134 WeakPolarHBondContact OD1-CG 3.43Å; D131-K134 PolarHBondContact OD1-N 3.36Å; D131-K134 WeakPolarHBondContact OD2-CD 3.34Å; D131-K134 VanDerWaalsContact OD2-CE 3.27Å; D131-K134 WeakPolarHBondContact OD2-CE 3.41Å; D131-K134 IonicContact OD2-NZ 2.58Å; D131-K134 PolarHBondContact OD2-NZ 3.36Å; K134-S137 WeakPolarHBondContact O-CB 3.42Å; K134-S137 PolarHBondContact O-N 2.89Å; K134-F138 PolarHBondContact O-N 3.12Å; K134-F273 WeakPolarHBondContact O-CE1 3.18Å; K134-Y276 HydrophobicContact CB-CE2 4.17Å; K134-Y276 HydrophobicContact CD-CD1 3.97Å; K134-Y276 HydrophobicContact CD-CD2 3.94Å; K134-Y276 HydrophobicContact CD-CE1 3.87Å; K134-Y276 HydrophobicContact CD-CE2 3.82Å; K134-Y276 HydrophobicContact CD-CG 4Å; K134-Y276 HydrophobicContact CG-CD2 4.26Å; K134-Y276 HydrophobicContact CG-CE1 4.3Å; K134-Y276 HydrophobicContact CG-CE2 3.7Å
135	L	96.2	Very high	95.6	Very high	23 Å²	23	46.6 Å²	46.6	12%	0.12	24%	0.239	C	C	.	.	H	α-helix	trans	-64.6	-43.1	177.1	180	61.4	0	0	0	111.4	L130 D131 S133 S137 F138 I139 I243 T245	L130-L135 HydrophobicContact CD1-CD1 4.46Å; D131-L135 WeakPolarHBondContact O-CB 3.42Å; D131-L135 PolarHBondContact O-N 2.98Å; S133-L135 PolarHBondContact O-N 2.84Å; L135-S137 VanDerWaalsContact C-N 3.35Å; L135-F138 WeakPolarHBondContact O-CB 3.48Å; L135-F138 PolarHBondContact O-N 3.49Å; L135-I139 HydrophobicContact CD1-CD1 4.26Å; L135-I139 HydrophobicContact CG-CD1 4.19Å; L135-I139 WeakPolarHBondContact O-CG1 3.39Å; L135-I139 PolarHBondContact O-N 3.27Å; L135-I139 VanDerWaalsContact O-N 3.09Å; L135-I243 HydrophobicContact CD1-CD1 3.7Å; L135-I243 HydrophobicContact CD1-CG1 3.98Å; L135-T245 HydrophobicContact CD2-CG2 4.24Å
136	N	93.6	Very high	95.4	Very high	103 Å²	103	46.7 Å²	46.7	55%	0.551	24%	0.239	S	C	*	.	H	α-helix	trans	-64.2	-40.9	175.7	-71.2	-21.4	0	0	0	111.5	E132 S133 F138 I139 D140	E132-N136 WeakPolarHBondContact O-CB 3.22Å; E132-N136 PolarHBondContact O-N 3.49Å; E132-N136 PolarHBondContact O-ND2 2.86Å; S133-N136 PolarHBondContact O-N 3.14Å; N136-F138 VanDerWaalsContact C-N 3.32Å; N136-F138 PolarHBondContact O-N 3.17Å; N136-I139 PolarHBondContact O-N 2.84Å; N136-D140 VanDerWaalsContact O-CB 3.28Å; N136-D140 WeakPolarHBondContact O-CB 3.39Å; N136-D140 PolarHBondContact O-N 3.49Å
137	S	95.3	Very high	95.1	Very high	9 Å²	9	46.1 Å²	46.1	6%	0.063	24%	0.24	C	C	.	.	H	α-helix	trans	-58.2	-43.5	173.3	-176.9	0	0	0	0	111.9	P77 E78 S133 K134 L135 I139 D140 L141	P77-S137 WeakPolarHBondContact CD-OG 3.46Å; E78-S137 PolarHBondContact OE2-OG 2.89Å; S133-S137 PolarHBondContact O-N 2.88Å; K134-S137 WeakPolarHBondContact O-CB 3.42Å; K134-S137 PolarHBondContact O-N 2.89Å; L135-S137 VanDerWaalsContact C-N 3.35Å; S137-I139 PolarHBondContact O-N 3.02Å; S137-D140 PolarHBondContact O-N 3.28Å; S137-L141 WeakPolarHBondContact O-CB 3.14Å; S137-L141 PolarHBondContact O-N 3.09Å
138	F	97.3	Very high	94.8	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.018	23%	0.232	C	C	.	.	H	α-helix	trans	-60	-49.3	178	-174.1	-78.9	0	0	0	111.8	K134 L135 N136 D140 L141 Q142 A160 I243 I252 L269 F273	K134-F138 PolarHBondContact O-N 3.12Å; L135-F138 WeakPolarHBondContact O-CB 3.48Å; L135-F138 PolarHBondContact O-N 3.49Å; N136-F138 VanDerWaalsContact C-N 3.32Å; N136-F138 PolarHBondContact O-N 3.17Å; F138-D140 VanDerWaalsContact C-N 3.34Å; F138-L141 PolarHBondContact O-N 3.29Å; F138-Q142 WeakPolarHBondContact O-CB 3.44Å; F138-Q142 PolarHBondContact O-N 3.22Å; F138-A160 HydrophobicContact CE1-CB 3.53Å; F138-A160 HydrophobicContact CZ-CB 3.77Å; F138-I243 HydrophobicContact CD1-CD1 3.93Å; F138-I243 HydrophobicContact CE1-CD1 4.06Å; F138-I252 HydrophobicContact CE2-CD1 3.85Å; F138-I252 HydrophobicContact CZ-CD1 3.86Å; F138-I252 HydrophobicContact CZ-CG1 4.25Å; F138-L269 HydrophobicContact CE2-CD2 4.22Å; F138-L269 HydrophobicContact CZ-CD2 4.27Å; F138-F273 HydrophobicContact CB-CD1 4.24Å; F138-F273 HydrophobicContact CB-CE1 3.67Å; F138-F273 HydrophobicContact CB-CE2 4.04Å; F138-F273 HydrophobicContact CB-CZ 3.59Å; F138-F273 HydrophobicContact CD2-CB 4.33Å; F138-F273 AromaticContact CD2-CD1 3.84Å; F138-F273 HydrophobicContact CD2-CD1 3.84Å; F138-F273 AromaticContact CD2-CD2 3.48Å; F138-F273 HydrophobicContact CD2-CD2 3.48Å; F138-F273 VanDerWaalsContact CD2-CD2 3.48Å; F138-F273 HydrophobicContact CD2-CE1 4.07Å; F138-F273 AromaticContact CD2-CE2 3.71Å; F138-F273 HydrophobicContact CD2-CE2 3.71Å; F138-F273 AromaticContact CD2-CG 3.59Å; F138-F273 HydrophobicContact CD2-CG 3.59Å; F138-F273 HydrophobicContact CD2-CZ 4.04Å; F138-F273 HydrophobicContact CE2-CD2 4.06Å; F138-F273 HydrophobicContact CE2-CG 4.24Å; F138-F273 HydrophobicContact CG-CD2 4.41Å; F138-F273 HydrophobicContact CG-CE1 4.38Å; F138-F273 HydrophobicContact CG-CE2 4.21Å; F138-F273 HydrophobicContact CG-CZ 4.24Å; F138-F273 VanDerWaalsContact N-CZ 3.25Å
139	I	95.3	Very high	94.6	Very high	75 Å²	75	45.2 Å²	45.2	39%	0.385	24%	0.235	S	C	.	.	H	α-helix	trans	-65.3	-40.8	-179.7	-65.3	168	0	0	0	110.6	L135 N136 S137 Q142 E143	L135-I139 HydrophobicContact CD1-CD1 4.26Å; L135-I139 HydrophobicContact CG-CD1 4.19Å; L135-I139 WeakPolarHBondContact O-CG1 3.39Å; L135-I139 PolarHBondContact O-N 3.27Å; L135-I139 VanDerWaalsContact O-N 3.09Å; N136-I139 PolarHBondContact O-N 2.84Å; S137-I139 PolarHBondContact O-N 3.02Å; I139-Q142 WeakPolarHBondContact O-CB 3.25Å; I139-Q142 PolarHBondContact O-N 3.49Å; I139-E143 PolarHBondContact O-N 3.21Å
140	D	95	Very high	94.5	Very high	63 Å²	63	41.3 Å²	41.3	34%	0.337	21%	0.211	S	C	.	.	H	α-helix	trans	-64.3	-46	178.2	-179.7	61	0	0	0	112	N136 S137 F138 Q142 E143 K144	N136-D140 VanDerWaalsContact O-CB 3.28Å; N136-D140 WeakPolarHBondContact O-CB 3.39Å; N136-D140 PolarHBondContact O-N 3.49Å; S137-D140 PolarHBondContact O-N 3.28Å; F138-D140 VanDerWaalsContact C-N 3.34Å; D140-Q142 VanDerWaalsContact C-N 3.31Å; D140-Q142 PolarHBondContact O-N 3.43Å; D140-E143 PolarHBondContact O-N 3.14Å; D140-K144 WeakPolarHBondContact O-CB 3.1Å; D140-K144 WeakPolarHBondContact O-CG 3.38Å; D140-K144 PolarHBondContact O-N 3.44Å; D140-K144 IonicContact OD1-NZ 3.73Å; D140-K144 WeakPolarHBondContact OD2-CE 3.31Å; D140-K144 IonicContact OD2-NZ 3.53Å; D140-K144 PolarHBondContact OD2-NZ 2.95Å
141	L	96.6	Very high	94.4	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.7	-42.8	174.7	-177.3	58.5	0	0	0	111.2	L75 C76 S137 F138 E143 K144 L145 T268 L269 M272 F273	L75-L141 HydrophobicContact CB-CD1 3.74Å; C76-L141 HydrophobicContact CB-CB 4.23Å; C76-L141 HydrophobicContact CB-CD1 4.2Å; C76-L141 HydrophobicContact CB-CD2 4.02Å; C76-L141 HydrophobicContact CB-CG 4.38Å; S137-L141 WeakPolarHBondContact O-CB 3.14Å; S137-L141 PolarHBondContact O-N 3.09Å; F138-L141 PolarHBondContact O-N 3.29Å; L141-E143 PolarHBondContact O-N 3.1Å; L141-K144 PolarHBondContact O-N 2.7Å; L141-L145 HydrophobicContact CD1-CD1 4.3Å; L141-L145 HydrophobicContact CD1-CG 4.17Å; L141-L145 HydrophobicContact CG-CD1 4.1Å; L141-L145 HydrophobicContact CG-CG 4.4Å; L141-L145 WeakPolarHBondContact O-CB 3.47Å; L141-L145 VanDerWaalsContact O-CG 3.27Å; L141-L145 WeakPolarHBondContact O-CG 3.36Å; L141-L145 PolarHBondContact O-N 3.41Å; L141-T268 HydrophobicContact CD2-CG2 4.45Å; L141-L269 HydrophobicContact CD2-CD2 4Å; L141-L269 HydrophobicContact CG-CD2 4.16Å; L141-M272 HydrophobicContact CD2-CB 4.07Å; L141-M272 HydrophobicContact CD2-CG 3.81Å; L141-F273 HydrophobicContact CD2-CE2 3.98Å
142	Q	96.3	Very high	94.5	Very high	21 Å²	21	51.5 Å²	51.5	10%	0.098	25%	0.247	C	C	.	.	H	α-helix	trans	-56.8	-48.7	176	-171.9	-168.3	-80.3	0	0	111.7	F138 I139 D140 L145 H146 I158	F138-Q142 WeakPolarHBondContact O-CB 3.44Å; F138-Q142 PolarHBondContact O-N 3.22Å; I139-Q142 WeakPolarHBondContact O-CB 3.25Å; I139-Q142 PolarHBondContact O-N 3.49Å; D140-Q142 VanDerWaalsContact C-N 3.31Å; D140-Q142 PolarHBondContact O-N 3.43Å; Q142-L145 PolarHBondContact O-N 3.38Å; Q142-H146 PolarHBondContact O-CD2 3.42Å; Q142-H146 PolarHBondContact O-N 2.87Å; Q142-I158 HydrophobicContact CG-CB 3.91Å; Q142-I158 HydrophobicContact CG-CD1 3.89Å; Q142-I158 HydrophobicContact CG-CG2 4.03Å
143	E	93.8	Very high	94.6	Very high	65 Å²	65	45.5 Å²	45.5	30%	0.304	22%	0.218	S	C	.	.	H	α-helix	trans	-67.8	-39.2	179.8	-74.5	-64.6	139.7	0	0	112.1	I139 D140 L141 L145 H146 Q147 R153	I139-E143 PolarHBondContact O-N 3.21Å; D140-E143 PolarHBondContact O-N 3.14Å; L141-E143 PolarHBondContact O-N 3.1Å; E143-L145 PolarHBondContact O-N 2.83Å; E143-H146 WeakPolarHBondContact O-CB 3.46Å; E143-H146 PolarHBondContact O-N 2.88Å; E143-H146 IonicContact OE1-ND1 2.71Å; E143-Q147 WeakPolarHBondContact O-CG 3.22Å; E143-Q147 PolarHBondContact O-N 3.35Å; E143-R153 IonicContact OE1-NH2 3.71Å; E143-R153 PolarHBondContact OE1-NH2 2.99Å; E143-R153 IonicContact OE2-NH2 2.94Å
144	K	94.6	Very high	94.9	Very high	32 Å²	32	45 Å²	45	14%	0.139	22%	0.215	C	C	.	.	H	α-helix	trans	-61.4	-43.7	174.2	-76.5	171.1	172.9	166.3	0	112.1	T3 L75 D140 L141 H146 Q147 N148	T3-K144 WeakPolarHBondContact O-CE 3.44Å; T3-K144 PolarHBondContact O-NZ 2.58Å; L75-K144 HydrophobicContact CB-CD 4.37Å; L75-K144 PolarHBondContact O-NZ 2.82Å; D140-K144 WeakPolarHBondContact O-CB 3.1Å; D140-K144 WeakPolarHBondContact O-CG 3.38Å; D140-K144 PolarHBondContact O-N 3.44Å; D140-K144 IonicContact OD1-NZ 3.73Å; D140-K144 WeakPolarHBondContact OD2-CE 3.31Å; D140-K144 IonicContact OD2-NZ 3.53Å; D140-K144 PolarHBondContact OD2-NZ 2.95Å; L141-K144 PolarHBondContact O-N 2.7Å; K144-H146 VanDerWaalsContact C-N 3.34Å; K144-Q147 PolarHBondContact O-N 2.91Å; K144-N148 WeakPolarHBondContact O-CB 3.38Å; K144-N148 PolarHBondContact O-N 3.36Å; K144-N148 PolarHBondContact O-ND2 3Å
145	L	96.3	Very high	95	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.2	-41.7	174.1	-68.8	174.5	0	0	0	110.9	Y72 L141 Q142 E143 Q147 N148 L149 C150 I158 V265 T268 L269	Y72-L145 HydrophobicContact CD1-CD2 4.34Å; Y72-L145 HydrophobicContact CG-CD2 4.3Å; L141-L145 HydrophobicContact CD1-CD1 4.3Å; L141-L145 HydrophobicContact CD1-CG 4.17Å; L141-L145 HydrophobicContact CG-CD1 4.1Å; L141-L145 HydrophobicContact CG-CG 4.4Å; L141-L145 WeakPolarHBondContact O-CB 3.47Å; L141-L145 VanDerWaalsContact O-CG 3.27Å; L141-L145 WeakPolarHBondContact O-CG 3.36Å; L141-L145 PolarHBondContact O-N 3.41Å; Q142-L145 PolarHBondContact O-N 3.38Å; E143-L145 PolarHBondContact O-N 2.83Å; L145-Q147 VanDerWaalsContact C-N 3.35Å; L145-Q147 PolarHBondContact O-N 2.65Å; L145-N148 PolarHBondContact O-N 3.49Å; L145-L149 PolarHBondContact O-N 3.42Å; L145-C150 VanDerWaalsContact O-CB 3.28Å; L145-C150 WeakPolarHBondContact O-CB 3.49Å; L145-C150 PolarHBondContact O-N 3.25Å; L145-C150 PolarHBondContact O-SG 2.84Å; L145-I158 HydrophobicContact CB-CD1 4.12Å; L145-I158 HydrophobicContact CD1-CD1 4.36Å; L145-V265 HydrophobicContact CD1-CG1 4.31Å; L145-T268 HydrophobicContact CD1-CG2 4.24Å; L145-L269 HydrophobicContact CD1-CD2 4.45Å; L145-L269 HydrophobicContact CD1-CG 4.16Å
146	H	95.6	Very high	95	Very high	2 Å²	2	44 Å²	44	1%	0.009	21%	0.212	C	C	.	.	H	α-helix	trans	-57	-43.8	174.8	-78.2	-180	0	0	0	113	Q142 E143 K144 C150 K152 R153 I158	Q142-H146 PolarHBondContact O-CD2 3.42Å; Q142-H146 PolarHBondContact O-N 2.87Å; E143-H146 WeakPolarHBondContact O-CB 3.46Å; E143-H146 PolarHBondContact O-N 2.88Å; E143-H146 IonicContact OE1-ND1 2.71Å; K144-H146 VanDerWaalsContact C-N 3.34Å; H146-C150 WeakPolarHBondContact O-CB 3.23Å; H146-K152 WeakPolarHBondContact O-CA 3.5Å; H146-K152 PolarHBondContact O-N 3.03Å; H146-R153 HydrophobicContact CB-CG 3.91Å; H146-R153 PolarHBondContact CE1-NE 2.85Å; H146-R153 PolarHBondContact ND1-NE 3.39Å; H146-R153 PolarHBondContact ND1-NH2 2.8Å; H146-R153 PolarHBondContact O-N 3.38Å; H146-I158 VanDerWaalsContact NE2-CB 3.29Å; H146-I158 WeakPolarHBondContact NE2-CB 3.39Å; H146-I158 WeakPolarHBondContact NE2-CD1 3.5Å; H146-I158 VanDerWaalsContact NE2-CG1 3.31Å; H146-I158 WeakPolarHBondContact NE2-CG1 3.37Å; H146-I158 PolarHBondContact NE2-N 3.36Å
147	Q	91.7	Very high	95.2	Very high	69 Å²	69	39.4 Å²	39.4	32%	0.322	19%	0.187	S	C	.	.	H	α-helix	trans	-70.5	-43.9	179.3	-66.3	-52	-40.8	0	0	112.4	E143 K144 L145 Y209	E143-Q147 WeakPolarHBondContact O-CG 3.22Å; E143-Q147 PolarHBondContact O-N 3.35Å; K144-Q147 PolarHBondContact O-N 2.91Å; L145-Q147 VanDerWaalsContact C-N 3.35Å; L145-Q147 PolarHBondContact O-N 2.65Å; Q147-Y209 PolarHBondContact NE2-OH 2.89Å
148	N	90.9	Very high	95.4	Very high	64 Å²	64	39.3 Å²	39.3	34%	0.342	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-89.3	-171.5	-66.1	-33.9	0	0	0	111.9	K144 L145 C150 R151	K144-N148 WeakPolarHBondContact O-CB 3.38Å; K144-N148 PolarHBondContact O-N 3.36Å; K144-N148 PolarHBondContact O-ND2 3Å; L145-N148 PolarHBondContact O-N 3.49Å; N148-C150 VanDerWaalsContact C-N 3.26Å; N148-C150 PolarHBondContact O-N 3.48Å; N148-R151 PolarHBondContact O-N 3.35Å
149	L	92.4	Very high	95.4	Very high	14 Å²	14	39.2 Å²	39.2	7%	0.073	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-38.8	-172.4	178.6	56.7	0	0	0	112.4	Y72 L145 R151 K261 V264 V265	Y72-L149 HydrophobicContact CD1-CB 4.47Å; Y72-L149 HydrophobicContact CD2-CD2 3.96Å; Y72-L149 HydrophobicContact CE1-CB 4.05Å; Y72-L149 HydrophobicContact CE2-CD1 4.02Å; Y72-L149 HydrophobicContact CE2-CD2 3.83Å; Y72-L149 HydrophobicContact CE2-CG 4.39Å; Y72-L149 HydrophobicContact CG-CD2 4.38Å; L145-L149 PolarHBondContact O-N 3.42Å; L149-R151 VanDerWaalsContact C-N 3.31Å; L149-R151 PolarHBondContact O-N 3.45Å; L149-K261 HydrophobicContact CD1-CD 4.22Å; L149-K261 HydrophobicContact CD1-CG 4.13Å; L149-V264 HydrophobicContact CD2-CB 4.2Å; L149-V264 HydrophobicContact CD2-CG1 3.54Å; L149-V265 HydrophobicContact CD2-CG2 3.54Å; L149-V265 HydrophobicContact CG-CG2 4.06Å
150	C	95.6	Very high	95.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-5.5	-179.2	-59	0	0	0	0	114.5	L145 H146 N148 R153 S154 L155 V156	L145-C150 VanDerWaalsContact O-CB 3.28Å; L145-C150 WeakPolarHBondContact O-CB 3.49Å; L145-C150 PolarHBondContact O-N 3.25Å; L145-C150 PolarHBondContact O-SG 2.84Å; H146-C150 WeakPolarHBondContact O-CB 3.23Å; N148-C150 VanDerWaalsContact C-N 3.26Å; N148-C150 PolarHBondContact O-N 3.48Å; C150-R153 CarbonylContact O-C 3.56Å; C150-R153 PolarHBondContact O-N 3.1Å; C150-S154 PolarHBondContact O-N 2.98Å; C150-L155 PolarHBondContact O-N 2.78Å; C150-V156 HydrophobicContact CB-CB 4.14Å; C150-V156 WeakPolarHBondContact CB-O 3.33Å
151	R	93.9	Very high	95.6	Very high	178 Å²	178	32.9 Å²	32.9	67%	0.672	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	63.7	-178	-63.7	-69.4	-168.7	169.9	0.1	112.7	N148 L149 R153 S154 L155	N148-R151 PolarHBondContact O-N 3.35Å; L149-R151 VanDerWaalsContact C-N 3.31Å; L149-R151 PolarHBondContact O-N 3.45Å; R151-R153 VanDerWaalsContact C-N 3.32Å; R151-R153 PolarHBondContact O-N 3Å; R151-S154 VanDerWaalsContact CB-OG 3.28Å; R151-S154 WeakPolarHBondContact CB-OG 3.3Å; R151-S154 VanDerWaalsContact O-CB 3.3Å; R151-S154 WeakPolarHBondContact O-CB 3.04Å; R151-S154 PolarHBondContact O-N 2.99Å; R151-S154 VanDerWaalsContact O-N 3.09Å; R151-S154 PolarHBondContact O-OG 3.3Å; R151-L155 HydrophobicContact CB-CD1 4.23Å; R151-L155 HydrophobicContact CB-CG 4.23Å; R151-L155 HydrophobicContact CG-CD1 3.73Å; R151-L155 HydrophobicContact CG-CG 4.27Å
152	K	94.5	Very high	95.7	Very high	113 Å²	113	33.7 Å²	33.7	49%	0.491	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	47.6	-176.4	-59.6	-170.9	175.1	-168.8	0	112.7	H146 S154 Y209	H146-K152 WeakPolarHBondContact O-CA 3.5Å; H146-K152 PolarHBondContact O-N 3.03Å; K152-S154 PolarHBondContact O-N 2.88Å; K152-Y209 HydrophobicContact CB-CE1 4.09Å; K152-Y209 WeakPolarHBondContact O-CD1 3.44Å; K152-Y209 WeakPolarHBondContact O-CE1 3.29Å
153	R	96.5	Very high	95.8	Very high	21 Å²	21	33.1 Å²	33.1	8%	0.079	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	7.1	-176.3	-47.9	179.5	-176.2	179	-1	116	R117 E143 H146 C150 R151 V156 A157 Y209 L212 P234 I235	R117-R153 VanDerWaalsContact CZ-O 3.28Å; R117-R153 PolarHBondContact NH1-O 3.36Å; R117-R153 PolarHBondContact NH2-O 3.22Å; E143-R153 IonicContact OE1-NH2 3.71Å; E143-R153 PolarHBondContact OE1-NH2 2.99Å; E143-R153 IonicContact OE2-NH2 2.94Å; H146-R153 HydrophobicContact CB-CG 3.91Å; H146-R153 PolarHBondContact CE1-NE 2.85Å; H146-R153 PolarHBondContact ND1-NE 3.39Å; H146-R153 PolarHBondContact ND1-NH2 2.8Å; H146-R153 PolarHBondContact O-N 3.38Å; C150-R153 CarbonylContact O-C 3.56Å; C150-R153 PolarHBondContact O-N 3.1Å; R151-R153 VanDerWaalsContact C-N 3.32Å; R151-R153 PolarHBondContact O-N 3Å; R153-V156 VanDerWaalsContact CA-O 3.26Å; R153-V156 WeakPolarHBondContact CA-O 3.11Å; R153-A157 HydrophobicContact CB-CB 4.38Å; R153-Y209 HydrophobicContact CB-CD1 4.2Å; R153-Y209 HydrophobicContact CB-CE1 4.35Å; R153-Y209 HydrophobicContact CG-CD1 4.1Å; R153-Y209 HydrophobicContact CG-CE1 3.87Å; R153-L212 HydrophobicContact CB-CD1 4.16Å; R153-P234 HydrophobicContact CB-CB 3.96Å; R153-P234 WeakPolarHBondContact CD-O 3.37Å; R153-P234 PolarHBondContact NH1-O 2.98Å; R153-P234 VanDerWaalsContact NH1-O 3.14Å; R153-I235 PolarHBondContact NH1-O 2.89Å
154	S	96	Very high	96	Very high	46 Å²	46	34.7 Å²	34.7	32%	0.322	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-41.4	178.1	61.8	0	0	0	0	111.6	R117 C150 R151 K152	R117-S154 PolarHBondContact NH1-O 2.84Å; R117-S154 PolarHBondContact NH2-O 2.86Å; C150-S154 PolarHBondContact O-N 2.98Å; R151-S154 VanDerWaalsContact CB-OG 3.28Å; R151-S154 WeakPolarHBondContact CB-OG 3.3Å; R151-S154 VanDerWaalsContact O-CB 3.3Å; R151-S154 WeakPolarHBondContact O-CB 3.04Å; R151-S154 PolarHBondContact O-N 2.99Å; R151-S154 VanDerWaalsContact O-N 3.09Å; R151-S154 PolarHBondContact O-OG 3.3Å; K152-S154 PolarHBondContact O-N 2.88Å
155	L	96.8	Very high	96.1	Very high	46 Å²	46	35.4 Å²	35.4	24%	0.241	17%	0.173	C	C	.	.	S	Bend	trans	-88.7	-43.3	-179.4	-61.8	179.9	0	0	0	112.9	C150 R151 G256 T257 K261	C150-L155 PolarHBondContact O-N 2.78Å; R151-L155 HydrophobicContact CB-CD1 4.23Å; R151-L155 HydrophobicContact CB-CG 4.23Å; R151-L155 HydrophobicContact CG-CD1 3.73Å; R151-L155 HydrophobicContact CG-CG 4.27Å; L155-G256 CarbonylContact O-C 3.09Å; L155-G256 WeakPolarHBondContact O-CA 3.34Å; L155-T257 PolarHBondContact O-N 3.01Å; L155-K261 HydrophobicContact CB-CD 4.31Å; L155-K261 HydrophobicContact CD1-CD 3.55Å
156	V	98	Very high	96.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	137.1	-175.9	179.3	0	0	0	0	110.6	C150 R153 A254 T255 K261 A262 V265	C150-V156 HydrophobicContact CB-CB 4.14Å; C150-V156 WeakPolarHBondContact CB-O 3.33Å; R153-V156 VanDerWaalsContact CA-O 3.26Å; R153-V156 WeakPolarHBondContact CA-O 3.11Å; V156-A254 HydrophobicContact CG1-CB 3.94Å; V156-T255 CarbonylContact C-O 3.53Å; V156-T255 VanDerWaalsContact CA-O 3.25Å; V156-T255 WeakPolarHBondContact CA-O 3.25Å; V156-K261 HydrophobicContact CG2-CB 3.67Å; V156-A262 HydrophobicContact CG1-CB 4.32Å; V156-A262 HydrophobicContact CG2-CB 4.12Å; V156-V265 HydrophobicContact CG1-CB 4.29Å; V156-V265 HydrophobicContact CG1-CG1 4.24Å; V156-V265 HydrophobicContact CG1-CG2 4.25Å
157	A	97.8	Very high	96.2	Very high	5 Å²	5	39.7 Å²	39.7	4%	0.041	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	136.9	172.2	0	0	0	0	0	108.7	R153 P233 P234 A254 T255	R153-A157 HydrophobicContact CB-CB 4.38Å; A157-P233 HydrophobicContact CB-CB 4.37Å; A157-P234 VanDerWaalsContact CB-CA 3.47Å; A157-P234 HydrophobicContact CB-CB 3.45Å; A157-P234 VanDerWaalsContact CB-CB 3.45Å; A157-A254 CarbonylContact O-C 3.48Å; A157-A254 WeakPolarHBondContact O-CA 3.29Å; A157-T255 PolarHBondContact N-O 2.75Å; A157-T255 PolarHBondContact O-N 2.81Å; A157-T255 PolarHBondContact O-OG1 3.27Å
158	I	98.1	Very high	96.4	Very high	8 Å²	8	38.9 Å²	38.9	4%	0.041	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	131.2	-173.4	-52.6	161.4	0	0	0	107.6	Q142 L145 H146 I252 E253 V265 L269	Q142-I158 HydrophobicContact CG-CB 3.91Å; Q142-I158 HydrophobicContact CG-CD1 3.89Å; Q142-I158 HydrophobicContact CG-CG2 4.03Å; L145-I158 HydrophobicContact CB-CD1 4.12Å; L145-I158 HydrophobicContact CD1-CD1 4.36Å; H146-I158 VanDerWaalsContact NE2-CB 3.29Å; H146-I158 WeakPolarHBondContact NE2-CB 3.39Å; H146-I158 WeakPolarHBondContact NE2-CD1 3.5Å; H146-I158 VanDerWaalsContact NE2-CG1 3.31Å; H146-I158 WeakPolarHBondContact NE2-CG1 3.37Å; H146-I158 PolarHBondContact NE2-N 3.36Å; I158-I252 HydrophobicContact CG2-CG2 4.17Å; I158-E253 CarbonylContact C-O 3.49Å; I158-E253 WeakPolarHBondContact CA-O 3.4Å; I158-V265 HydrophobicContact CD1-CG1 3.19Å; I158-V265 HydrophobicContact CG1-CG1 3.35Å; I158-L269 HydrophobicContact CD1-CD1 3.96Å; I158-L269 HydrophobicContact CG1-CD1 4.46Å; I158-L269 HydrophobicContact CG2-CD1 3.5Å
159	G	97	Very high	96.7	Very high	1 Å²	1	38 Å²	38	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	148.7	164.1	0	0	0	0	0	110.5	I252 E253	G159-I252 WeakPolarHBondContact O-CA 3.48Å; G159-E253 VanDerWaalsContact CA-CD 3.41Å; G159-E253 WeakPolarHBondContact CA-OE1 3.35Å; G159-E253 WeakPolarHBondContact CA-OE2 3.4Å; G159-E253 PolarHBondContact N-O 2.74Å; G159-E253 PolarHBondContact O-N 2.92Å
160	A	97.9	Very high	97	Very high	5 Å²	5	37.3 Å²	37.3	4%	0.041	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	128.8	176.2	0	0	0	0	0	107.4	F138 N237 I243 V250	F138-A160 HydrophobicContact CE1-CB 3.53Å; F138-A160 HydrophobicContact CZ-CB 3.77Å; A160-N237 PolarHBondContact N-ND2 3.11Å; A160-I243 HydrophobicContact CB-CD1 4.15Å; A160-I243 HydrophobicContact CB-CG2 4.45Å; A160-V250 HydrophobicContact CB-CG1 4.41Å
161	H	98.3	Very high	97.1	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	137.1	-164.7	-65.1	-53.9	0	0	0	111.6	L163 L166 L230 S241 V250 F251 E253	H161-L163 PolarHBondContact O-N 2.82Å; H161-L163 VanDerWaalsContact O-N 3.15Å; H161-L166 HydrophobicContact CB-CD1 3.87Å; H161-L230 PolarHBondContact CE1-O 2.93Å; H161-S241 CarbonylContact C-O 3.56Å; H161-S241 VanDerWaalsContact CA-O 3.23Å; H161-S241 WeakPolarHBondContact CA-O 3.46Å; H161-S241 PolarHBondContact ND1-OG 2.68Å; H161-V250 CarbonylContact O-C 3.4Å; H161-V250 VanDerWaalsContact O-CA 3.31Å; H161-V250 WeakPolarHBondContact O-CA 3.37Å; H161-F251 HydrophobicContact CB-CB 4.35Å; H161-F251 HydrophobicContact CB-CD1 4.31Å; H161-F251 AromaticContact CD2-CD1 3.94Å; H161-F251 PolarHBondContact N-O 3.09Å; H161-F251 PolarHBondContact O-N 2.92Å; H161-E253 IonicContact CD2-OE1 3.61Å; H161-E253 IonicContact CD2-OE2 3.13Å; H161-E253 PolarHBondContact CD2-OE2 3.43Å; H161-E253 VanDerWaalsContact NE2-CD 3.33Å; H161-E253 IonicContact NE2-OE1 3.64Å; H161-E253 PolarHBondContact NE2-OE1 2.85Å; H161-E253 IonicContact NE2-OE2 2.8Å; H161-E253 PolarHBondContact NE2-OE2 3.05Å; H161-E253 VanDerWaalsContact NE2-OE2 3.1Å
162	D	98.4	Very high	97.3	Very high	18 Å²	18	31.5 Å²	31.5	10%	0.096	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	108.4	165.5	-165.3	-29.9	0	0	0	108.9	D164 T165 S241 T247	D162-D164 PolarHBondContact O-N 2.82Å; D162-D164 WeakPolarHBondContact OD1-CB 3.28Å; D162-D164 PolarHBondContact OD1-N 2.86Å; D162-T165 HydrophobicContact CB-CG2 4.18Å; D162-T165 PolarHBondContact O-N 3.29Å; D162-T165 PolarHBondContact O-OG1 3.39Å; D162-S241 PolarHBondContact N-O 3.08Å; D162-T247 HydrophobicContact CB-CG2 3.91Å; D162-T247 VanDerWaalsContact CG-CG2 3.46Å; D162-T247 WeakPolarHBondContact OD2-CB 3.37Å; D162-T247 WeakPolarHBondContact OD2-CG2 3.39Å; D162-T247 PolarHBondContact OD2-OG1 2.79Å
163	L	97.9	Very high	97.4	Very high	8 Å²	8	27.2 Å²	27.2	4%	0.042	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-69.5	-24.6	-176.4	178.5	59.2	0	0	0	111.9	I105 V124 H161 T165 L166 P168 F170 N249 F251	I105-L163 HydrophobicContact CD1-CD1 4.05Å; I105-L163 HydrophobicContact CD1-CD2 3.82Å; V124-L163 HydrophobicContact CG1-CD2 3.68Å; V124-L163 HydrophobicContact CG2-CD2 4.08Å; H161-L163 PolarHBondContact O-N 2.82Å; H161-L163 VanDerWaalsContact O-N 3.15Å; L163-T165 PolarHBondContact O-N 2.75Å; L163-L166 PolarHBondContact O-N 2.93Å; L163-P168 HydrophobicContact CD1-CG 4.28Å; L163-F170 HydrophobicContact CD1-CE2 4.26Å; L163-F170 HydrophobicContact CD1-CZ 3.85Å; L163-N249 HydrophobicContact CB-CB 3.89Å; L163-N249 WeakPolarHBondContact CB-O 3.28Å; L163-N249 HydrophobicContact CD2-CB 4.21Å; L163-N249 HydrophobicContact CG-CB 4.44Å; L163-N249 PolarHBondContact N-O 2.95Å; L163-F251 HydrophobicContact CB-CB 4.19Å; L163-F251 HydrophobicContact CD1-CB 4.2Å
164	D	97.5	Very high	97.4	Very high	98 Å²	98	26.3 Å²	26.3	52%	0.524	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	-73.4	-13.6	-177.4	-64.6	-32.2	0	0	0	112.4	D162 N249	D162-D164 PolarHBondContact O-N 2.82Å; D162-D164 WeakPolarHBondContact OD1-CB 3.28Å; D162-D164 PolarHBondContact OD1-N 2.86Å; D164-N249 PolarHBondContact OD1-ND2 3.46Å; D164-N249 PolarHBondContact OD2-ND2 3.09Å; D164-N249 VanDerWaalsContact OD2-ND2 3.16Å
165	T	97.1	Very high	97.4	Very high	48 Å²	48	27 Å²	27	29%	0.294	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-94.5	-0.2	175.5	76	0	0	0	0	113.1	D162 L163 H240 S241	D162-T165 HydrophobicContact CB-CG2 4.18Å; D162-T165 PolarHBondContact O-N 3.29Å; D162-T165 PolarHBondContact O-OG1 3.39Å; L163-T165 PolarHBondContact O-N 2.75Å; T165-H240 PolarHBondContact O-NE2 3.19Å; T165-H240 PolarHBondContact OG1-O 2.95Å; T165-S241 WeakPolarHBondContact OG1-CA 3.38Å
166	L	97	Very high	97.4	Very high	10 Å²	10	27.5 Å²	27.5	5%	0.052	15%	0.154	C	C	.	.			trans	-120.3	155.6	-168	-65.8	176.7	0	0	0	113	H161 L163 P168 F170 L230	H161-L166 HydrophobicContact CB-CD1 3.87Å; L163-L166 PolarHBondContact O-N 2.93Å; L166-P168 WeakPolarHBondContact O-CD 3.18Å; L166-F170 HydrophobicContact CB-CE1 3.98Å; L166-F170 HydrophobicContact CB-CZ 4.15Å; L166-F170 HydrophobicContact CD1-CE1 4.22Å; L166-F170 HydrophobicContact CD1-CZ 4.27Å; L166-L230 HydrophobicContact CD1-CD1 4.23Å; L166-L230 HydrophobicContact CD1-CD2 3.61Å; L166-L230 HydrophobicContact CD1-CG 3.7Å; L166-L230 HydrophobicContact CD2-CD1 3.65Å; L166-L230 HydrophobicContact CD2-CG 3.84Å; L166-L230 HydrophobicContact CG-CG 4.42Å
167	N	97	Very high	97.2	Very high	82 Å²	82	28.1 Å²	28.1	44%	0.439	16%	0.158	S	C	.	.			trans	-121	92.9	-178.9	-61.2	-71.7	0	0	0	112.3	D224 S225 S226	N167-D224 PolarHBondContact N-OD2 3.31Å; N167-D224 WeakPolarHBondContact O-CB 3.45Å; N167-S225 WeakPolarHBondContact CB-OG 3.39Å; N167-S225 WeakPolarHBondContact O-CB 3.47Å; N167-S225 PolarHBondContact O-N 3Å; N167-S225 PolarHBondContact O-OG 3.01Å; N167-S226 PolarHBondContact ND2-OG 3.31Å
168	P	96	Very high	97	Very high	52 Å²	52	34.4 Å²	34.4	34%	0.338	19%	0.185	S	C	.	.	S	Bend	trans	-55.1	154.3	172.9	-23.7	32.9	0	0	0	113.2	I105 L163 L166 F170	I105-P168 HydrophobicContact CD1-CG 4.07Å; I105-P168 HydrophobicContact CG1-CB 4.25Å; I105-P168 HydrophobicContact CG1-CG 4.04Å; I105-P168 HydrophobicContact CG2-CB 4.17Å; I105-P168 HydrophobicContact CG2-CG 4.34Å; L163-P168 HydrophobicContact CD1-CG 4.28Å; L166-P168 WeakPolarHBondContact O-CD 3.18Å; P168-F170 HydrophobicContact CB-CE2 4.35Å; P168-F170 HydrophobicContact CB-CZ 4.3Å; P168-F170 HydrophobicContact CG-CE1 4.34Å; P168-F170 HydrophobicContact CG-CE2 4.01Å; P168-F170 HydrophobicContact CG-CZ 3.71Å
169	P	96.7	Very high	96.8	Very high	45 Å²	45	39.6 Å²	39.6	29%	0.292	21%	0.212	S	C	.	.	S	Bend	cis	-74.2	165.8	3	32.7	-38.4	0	0	0	113.2	Q106 F171 D224 S225	Q106-P169 HydrophobicContact CB-CB 4.12Å; Q106-P169 WeakPolarHBondContact O-CA 3.11Å; Q106-P169 WeakPolarHBondContact O-CB 3.46Å; P169-F171 HydrophobicContact CG-CE2 4.11Å; P169-F171 HydrophobicContact CG-CZ 4.05Å; P169-D224 CarbonylContact O-C 3.53Å; P169-S225 PolarHBondContact O-N 3.48Å; P169-S225 VanDerWaalsContact O-N 3.08Å
170	F	98.4	Very high	96.7	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	156.6	177.2	-56.8	-56.5	0	0	0	111.2	I105 Q106 L107 H108 L163 L166 P168 F223 D224 L230 F251	I105-F170 HydrophobicContact CG2-CD2 3.78Å; I105-F170 HydrophobicContact CG2-CE2 3.62Å; Q106-F170 PolarHBondContact O-N 2.83Å; L107-F170 CarbonylContact C-O 3.44Å; L107-F170 WeakPolarHBondContact CA-O 3.42Å; L107-F170 HydrophobicContact CB-CB 4.44Å; L107-F170 HydrophobicContact CD1-CB 3.47Å; L107-F170 VanDerWaalsContact CD1-CB 3.47Å; H108-F170 PolarHBondContact N-O 3.03Å; L163-F170 HydrophobicContact CD1-CE2 4.26Å; L163-F170 HydrophobicContact CD1-CZ 3.85Å; L166-F170 HydrophobicContact CB-CE1 3.98Å; L166-F170 HydrophobicContact CB-CZ 4.15Å; L166-F170 HydrophobicContact CD1-CE1 4.22Å; L166-F170 HydrophobicContact CD1-CZ 4.27Å; P168-F170 HydrophobicContact CB-CE2 4.35Å; P168-F170 HydrophobicContact CB-CZ 4.3Å; P168-F170 HydrophobicContact CG-CE1 4.34Å; P168-F170 HydrophobicContact CG-CE2 4.01Å; P168-F170 HydrophobicContact CG-CZ 3.71Å; F170-F223 CarbonylContact C-O 3.57Å; F170-F223 WeakPolarHBondContact CA-O 3.29Å; F170-D224 HydrophobicContact CD1-CB 3.73Å; F170-D224 HydrophobicContact CE1-CB 3.78Å; F170-L230 HydrophobicContact CD1-CD1 4.28Å; F170-L230 HydrophobicContact CD1-CD2 3.97Å; F170-L230 HydrophobicContact CE1-CD1 4.39Å; F170-L230 HydrophobicContact CE1-CD2 4Å; F170-F251 HydrophobicContact CD2-CD2 4.28Å; F170-F251 HydrophobicContact CD2-CE1 4.18Å; F170-F251 AromaticContact CD2-CE2 3.7Å; F170-F251 HydrophobicContact CD2-CE2 3.7Å; F170-F251 AromaticContact CD2-CZ 3.64Å; F170-F251 HydrophobicContact CD2-CZ 3.64Å; F170-F251 HydrophobicContact CE2-CD1 4.33Å; F170-F251 AromaticContact CE2-CD2 3.77Å; F170-F251 HydrophobicContact CE2-CD2 3.77Å; F170-F251 HydrophobicContact CE2-CE1 4.26Å; F170-F251 AromaticContact CE2-CE2 3.67Å; F170-F251 HydrophobicContact CE2-CE2 3.67Å; F170-F251 HydrophobicContact CE2-CG 4.1Å; F170-F251 AromaticContact CE2-CZ 3.94Å; F170-F251 HydrophobicContact CE2-CZ 3.94Å; F170-F251 HydrophobicContact CG-CZ 4.44Å
171	F	98.4	Very high	96.6	Very high	56 Å²	56	45.5 Å²	45.5	25%	0.246	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	129.5	-179.3	-60.3	-88.9	0	0	0	109.9	H108 P169 I222 F223	H108-F171 HydrophobicContact CB-CD1 3.7Å; H108-F171 HydrophobicContact CB-CE1 4.01Å; H108-F171 CarbonylContact O-C 3.58Å; H108-F171 WeakPolarHBondContact O-CA 3.41Å; P169-F171 HydrophobicContact CG-CE2 4.11Å; P169-F171 HydrophobicContact CG-CZ 4.05Å; F171-I222 VanDerWaalsContact O-CA 3.3Å; F171-I222 WeakPolarHBondContact O-CA 3.4Å; F171-F223 HydrophobicContact CB-CD1 4.17Å; F171-F223 HydrophobicContact CB-CD2 4.21Å; F171-F223 HydrophobicContact CB-CE1 3.67Å; F171-F223 HydrophobicContact CB-CE2 3.72Å; F171-F223 HydrophobicContact CB-CG 4.42Å; F171-F223 HydrophobicContact CB-CZ 3.43Å; F171-F223 VanDerWaalsContact CB-CZ 3.43Å; F171-F223 HydrophobicContact CD2-CD2 4.21Å; F171-F223 AromaticContact CD2-CE2 3.83Å; F171-F223 HydrophobicContact CD2-CE2 3.83Å; F171-F223 HydrophobicContact CD2-CZ 4.37Å; F171-F223 AromaticContact CG-CE2 3.95Å; F171-F223 HydrophobicContact CG-CE2 3.95Å; F171-F223 HydrophobicContact CG-CZ 4.01Å; F171-F223 PolarHBondContact N-O 3.13Å; F171-F223 PolarHBondContact O-N 3.41Å
172	Y	98.3	Very high	96.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	110.7	172	-179.3	-137.8	0	0	0	109.5	H108 V109 L110 T113 R117 V120 P220 I221 I222 T255	H108-Y172 PolarHBondContact O-N 3.18Å; V109-Y172 HydrophobicContact CG1-CD1 4.01Å; L110-Y172 PolarHBondContact N-O 2.91Å; T113-Y172 HydrophobicContact CG2-CD1 3.78Å; T113-Y172 HydrophobicContact CG2-CD2 4.16Å; T113-Y172 HydrophobicContact CG2-CE1 3.75Å; T113-Y172 HydrophobicContact CG2-CE2 4.17Å; T113-Y172 HydrophobicContact CG2-CG 3.97Å; T113-Y172 WeakPolarHBondContact CG2-O 3.35Å; R117-Y172 VanDerWaalsContact CB-OH 3.26Å; R117-Y172 WeakPolarHBondContact CB-OH 3.38Å; R117-Y172 VanDerWaalsContact O-CE1 3.29Å; R117-Y172 WeakPolarHBondContact O-CE1 3.33Å; R117-Y172 PolarHBondContact O-OH 3.23Å; V120-Y172 HydrophobicContact CB-CD1 3.77Å; V120-Y172 HydrophobicContact CB-CE1 4.07Å; V120-Y172 HydrophobicContact CB-CG 4.39Å; V120-Y172 HydrophobicContact CG1-CD1 3.54Å; V120-Y172 HydrophobicContact CG1-CE1 4.27Å; V120-Y172 HydrophobicContact CG1-CG 4.13Å; Y172-P220 HydrophobicContact CE2-CB 3.72Å; Y172-I221 WeakPolarHBondContact CD2-O 3.24Å; Y172-I222 HydrophobicContact CD2-CD1 4.09Å; Y172-I222 HydrophobicContact CD2-CG1 3.47Å; Y172-I222 VanDerWaalsContact CD2-CG1 3.47Å; Y172-I222 HydrophobicContact CE2-CG1 4.24Å; Y172-I222 HydrophobicContact CG-CG1 4.15Å; Y172-T255 HydrophobicContact CD2-CG2 4.47Å; Y172-T255 HydrophobicContact CE1-CG2 4.41Å; Y172-T255 HydrophobicContact CE2-CG2 3.93Å
173	D	97.2	Very high	96.4	Very high	23 Å²	23	49 Å²	49	12%	0.123	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	163.9	-172.6	-166.1	8.4	0	0	0	110.4	L110 S112 K175 P220 I221 F223	L110-D173 HydrophobicContact CB-CB 4.4Å; L110-D173 HydrophobicContact CD1-CB 3.87Å; L110-D173 HydrophobicContact CG-CB 4.44Å; S112-D173 WeakPolarHBondContact CB-OD1 3.35Å; S112-D173 PolarHBondContact OG-OD1 2.77Å; D173-K175 WeakPolarHBondContact OD2-CE 3.33Å; D173-K175 WeakPolarHBondContact OD2-CG 3.49Å; D173-P220 CarbonylContact O-C 3.57Å; D173-P220 WeakPolarHBondContact O-CA 3.36Å; D173-I221 PolarHBondContact N-O 2.9Å; D173-I221 PolarHBondContact O-N 2.91Å; D173-F223 HydrophobicContact CB-CE1 3.77Å
174	A	96.4	Very high	96.3	Very high	2 Å²	2	48.6 Å²	48.6	2%	0.017	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	118.2	164.9	0	0	0	0	0	109.3	S112 I116 K218 Y219	S112-A174 WeakPolarHBondContact CB-O 3Å; S112-A174 PolarHBondContact OG-N 3.32Å; I116-A174 HydrophobicContact CD1-CB 4.01Å; A174-K218 HydrophobicContact CB-CB 3.93Å; A174-K218 WeakPolarHBondContact O-CD 3.49Å; A174-Y219 VanDerWaalsContact CA-O 3.28Å; A174-Y219 WeakPolarHBondContact CA-O 3.47Å
175	K	96.1	Very high	96.1	Very high	60 Å²	60	46.2 Å²	46.2	26%	0.261	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	162.9	-178.4	-63.3	-172	-173.3	170.3	0	111.2	D173 I180 K218 Y219 I221	D173-K175 WeakPolarHBondContact OD2-CE 3.33Å; D173-K175 WeakPolarHBondContact OD2-CG 3.49Å; K175-I180 HydrophobicContact CB-CD1 4.08Å; K175-I180 HydrophobicContact CB-CG1 3.87Å; K175-K218 CarbonylContact O-C 3.55Å; K175-K218 WeakPolarHBondContact O-CA 3.46Å; K175-K218 WeakPolarHBondContact O-CB 3.46Å; K175-Y219 PolarHBondContact N-O 3.03Å; K175-Y219 VanDerWaalsContact N-O 3.1Å; K175-Y219 PolarHBondContact O-N 3Å; K175-I221 HydrophobicContact CD-CD1 3.74Å; K175-I221 HydrophobicContact CG-CD1 4.11Å
176	C	95.6	Very high	95.7	Very high	56 Å²	56	49.2 Å²	49.2	38%	0.378	25%	0.247	S	C	.	.			trans	-61.7	138.6	174.4	-62.9	0	0	0	0	109.4	K178 D179	C176-K178 PolarHBondContact O-N 3.36Å; C176-D179 WeakPolarHBondContact CB-OD2 3.3Å; C176-D179 PolarHBondContact O-N 3.33Å
177	P	94.1	Very high	95.5	Very high	13 Å²	13	51.9 Å²	51.9	8%	0.084	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-53.8	-30.7	-176.7	-30.7	37.7	0	0	0	115	D179 A193 E194 P217 Y219	P177-D179 VanDerWaalsContact C-N 3.34Å; P177-A193 HydrophobicContact CB-CB 4.33Å; P177-A193 WeakPolarHBondContact O-CB 3.44Å; P177-A193 PolarHBondContact O-N 3.14Å; P177-E194 HydrophobicContact CB-CG 3.57Å; P177-P217 WeakPolarHBondContact CD-O 3.32Å; P177-Y219 HydrophobicContact CB-CD2 3.87Å; P177-Y219 HydrophobicContact CB-CE2 3.69Å; P177-Y219 HydrophobicContact CB-CG 4.5Å; P177-Y219 HydrophobicContact CG-CD1 3.99Å; P177-Y219 HydrophobicContact CG-CD2 3.73Å; P177-Y219 HydrophobicContact CG-CE1 3.82Å; P177-Y219 HydrophobicContact CG-CE2 3.59Å; P177-Y219 HydrophobicContact CG-CG 3.92Å
178	K	93.6	Very high	95.1	Very high	138 Å²	138	53.6 Å²	53.6	60%	0.6	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-69.2	-28.9	177.5	-64.2	-178.7	-178.4	-178.7	0	114	C176 I180 E194	C176-K178 PolarHBondContact O-N 3.36Å; K178-I180 VanDerWaalsContact C-N 3.34Å; K178-E194 VanDerWaalsContact CE-CD 3.45Å; K178-E194 WeakPolarHBondContact CE-OE1 3.17Å; K178-E194 VanDerWaalsContact CE-OE2 3.23Å; K178-E194 WeakPolarHBondContact CE-OE2 3.2Å; K178-E194 HydrophobicContact CG-CG 4.19Å; K178-E194 VanDerWaalsContact CG-OE1 3.32Å; K178-E194 WeakPolarHBondContact CG-OE1 3.4Å; K178-E194 WeakPolarHBondContact CG-OE2 3.39Å
179	D	94.2	Very high	95	Very high	116 Å²	116	57.3 Å²	57.3	62%	0.62	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-89.7	-6.2	-175.9	-57.2	-32.4	0	0	0	112	C176 P177	C176-D179 WeakPolarHBondContact CB-OD2 3.3Å; C176-D179 PolarHBondContact O-N 3.33Å; P177-D179 VanDerWaalsContact C-N 3.34Å
180	I	95.4	Very high	94.9	Very high	2 Å²	2	61.1 Å²	61.1	1%	0.01	30%	0.298	C	S	.	.			trans	-97.7	110.5	178.2	-60.1	164.1	0	0	0	107.4	K175 K178 F182 S192 A193 I221	K175-I180 HydrophobicContact CB-CD1 4.08Å; K175-I180 HydrophobicContact CB-CG1 3.87Å; K178-I180 VanDerWaalsContact C-N 3.34Å; I180-F182 HydrophobicContact CG2-CD1 4.01Å; I180-F182 HydrophobicContact CG2-CE1 4.19Å; I180-S192 CarbonylContact O-C 3.5Å; I180-S192 WeakPolarHBondContact O-CA 3.28Å; I180-A193 HydrophobicContact CB-CB 3.87Å; I180-A193 HydrophobicContact CD1-CB 4.39Å; I180-A193 HydrophobicContact CG2-CB 3.99Å; I180-A193 PolarHBondContact O-N 2.77Å; I180-I221 HydrophobicContact CB-CG2 4.48Å; I180-I221 HydrophobicContact CD1-CG2 3.63Å; I180-I221 HydrophobicContact CG1-CD1 4.31Å; I180-I221 HydrophobicContact CG1-CG2 3.95Å; I180-I221 HydrophobicContact CG2-CG2 3.7Å
181	R	96.1	Very high	94.8	Very high	129 Å²	129	62.8 Å²	62.8	49%	0.487	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	127	173.3	-62.9	-173.7	69.1	86.7	7.5	109.6	E190 H191 E195	R181-E190 PolarHBondContact NH2-O 3.43Å; R181-H191 WeakPolarHBondContact CA-O 3.18Å; R181-E195 IonicContact NH1-OE1 3.85Å; R181-E195 PolarHBondContact NH1-OE1 3.18Å
182	F	96.7	Very high	94.6	Very high	8 Å²	8	60.5 Å²	60.5	4%	0.035	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	165.3	176.4	73.5	-69.2	0	0	0	111.5	I180 A184 H191 L196 V229 M232 I236	I180-F182 HydrophobicContact CG2-CD1 4.01Å; I180-F182 HydrophobicContact CG2-CE1 4.19Å; F182-A184 HydrophobicContact CE2-CB 4.15Å; F182-A184 HydrophobicContact CZ-CB 4.33Å; F182-A184 PolarHBondContact O-N 2.71Å; F182-H191 PolarHBondContact N-O 3.18Å; F182-H191 VanDerWaalsContact N-O 3.14Å; F182-H191 PolarHBondContact O-N 3.38Å; F182-H191 VanDerWaalsContact O-N 3.1Å; F182-L196 HydrophobicContact CD1-CD1 4.18Å; F182-L196 HydrophobicContact CE1-CD1 3.49Å; F182-L196 VanDerWaalsContact CE1-CD1 3.49Å; F182-L196 HydrophobicContact CZ-CD1 3.85Å; F182-V229 HydrophobicContact CB-CB 3.64Å; F182-V229 HydrophobicContact CB-CG1 4.14Å; F182-V229 HydrophobicContact CB-CG2 3.97Å; F182-V229 HydrophobicContact CD1-CB 4.41Å; F182-V229 HydrophobicContact CD1-CG1 4Å; F182-V229 HydrophobicContact CD2-CB 4.15Å; F182-V229 HydrophobicContact CD2-CG1 3.87Å; F182-V229 HydrophobicContact CE1-CG1 4.37Å; F182-V229 HydrophobicContact CE2-CG1 4.24Å; F182-V229 HydrophobicContact CG-CB 3.84Å; F182-V229 HydrophobicContact CG-CG1 3.75Å; F182-V229 HydrophobicContact CG-CG2 4.41Å; F182-V229 HydrophobicContact CZ-CG1 4.48Å; F182-M232 HydrophobicContact CE1-CB 4.05Å; F182-M232 HydrophobicContact CE1-SD 4.48Å; F182-M232 HydrophobicContact CZ-CB 3.81Å; F182-I236 HydrophobicContact CE2-CG2 4.44Å; F182-I236 HydrophobicContact CZ-CG2 4Å
183	K	95.8	Very high	94.5	Very high	82 Å²	82	60.5 Å²	60.5	36%	0.357	30%	0.297	S	S	.	.			trans	-84.1	105.2	172.9	-171.3	176.3	178.2	168.1	0	109.4	K187 T188 E190 G238 E239	K183-K187 WeakPolarHBondContact CE-O 3.31Å; K183-K187 WeakPolarHBondContact CG-O 3.39Å; K183-T188 VanDerWaalsContact CE-C 3.44Å; K183-T188 WeakPolarHBondContact CE-O 3.2Å; K183-T188 PolarHBondContact NZ-O 3.12Å; K183-E190 HydrophobicContact CB-CG 4.17Å; K183-G238 WeakPolarHBondContact O-CA 3.46Å; K183-E239 HydrophobicContact CB-CB 4.39Å; K183-E239 HydrophobicContact CD-CB 4.04Å; K183-E239 HydrophobicContact CD-CG 4.22Å; K183-E239 HydrophobicContact CG-CB 3.82Å; K183-E239 HydrophobicContact CG-CG 4.43Å; K183-E239 PolarHBondContact O-N 3.18Å
184	A	95.1	Very high	94.3	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-71.6	156	179.6	0	0	0	0	0	112	F182 N186 K187 L196 F200 I236	F182-A184 HydrophobicContact CE2-CB 4.15Å; F182-A184 HydrophobicContact CZ-CB 4.33Å; F182-A184 PolarHBondContact O-N 2.71Å; A184-N186 PolarHBondContact O-N 3.48Å; A184-K187 HydrophobicContact CB-CG 4.09Å; A184-K187 VanDerWaalsContact O-CB 3.29Å; A184-K187 WeakPolarHBondContact O-CB 3.29Å; A184-K187 PolarHBondContact O-N 3.24Å; A184-L196 HydrophobicContact CB-CD1 4.04Å; A184-L196 HydrophobicContact CB-CD2 3.75Å; A184-F200 HydrophobicContact CB-CZ 4.14Å; A184-I236 HydrophobicContact CB-CD1 4.17Å; A184-I236 HydrophobicContact CB-CG2 4Å
185	L	92.5	Very high	94.2	Very high	49 Å²	49	66.3 Å²	66.3	26%	0.257	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	133.5	-179	-169.4	70.7	0	0	0	111.7	K187 I236 N237 E239 R242	L185-K187 PolarHBondContact O-N 2.93Å; L185-I236 HydrophobicContact CB-CD1 4.01Å; L185-I236 HydrophobicContact CB-CG1 3.9Å; L185-N237 WeakPolarHBondContact CB-O 3.38Å; L185-N237 PolarHBondContact N-O 2.89Å; L185-E239 WeakPolarHBondContact CA-OE2 3.45Å; L185-R242 HydrophobicContact CD1-CB 3.88Å; L185-R242 HydrophobicContact CD1-CG 3.77Å
186	N	90.2	Very high	94.1	Very high	111 Å²	111	63.4 Å²	63.4	59%	0.594	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	21.1	-175.1	-58.9	-47.5	0	0	0	114.9	A184 E239 R242	A184-N186 PolarHBondContact O-N 3.48Å; N186-E239 PolarHBondContact N-OE2 3.35Å; N186-R242 PolarHBondContact OD1-NH1 3.45Å; N186-R242 VanDerWaalsContact OD1-NH1 3.09Å
187	K	91	Very high	94	Very high	65 Å²	65	61.7 Å²	61.7	28%	0.283	30%	0.297	S	S	.	.			trans	-106.6	153.6	168.3	-58.7	-61	-178.5	-178.1	0	110.7	K183 A184 L185	K183-K187 WeakPolarHBondContact CE-O 3.31Å; K183-K187 WeakPolarHBondContact CG-O 3.39Å; A184-K187 HydrophobicContact CB-CG 4.09Å; A184-K187 VanDerWaalsContact O-CB 3.29Å; A184-K187 WeakPolarHBondContact O-CB 3.29Å; A184-K187 PolarHBondContact O-N 3.24Å; L185-K187 PolarHBondContact O-N 2.93Å
188	T	89.9	Confident	93.9	Very high	119 Å²	119	67.8 Å²	67.8	73%	0.73	33%	0.325	S	S	*	.	S	Bend	trans	-93.9	-32.1	-180	46.5	0	0	0	0	113	K183	K183-T188 VanDerWaalsContact CE-C 3.44Å; K183-T188 WeakPolarHBondContact CE-O 3.2Å; K183-T188 PolarHBondContact NZ-O 3.12Å
189	E	92.9	Very high	93.8	Very high	129 Å²	129	64 Å²	64	60%	0.603	31%	0.31	S	S	*	.	S	Bend	trans	-111.2	159.9	-174.9	-62.8	-178.1	178.2	0	0	112
190	E	94.6	Very high	93.8	Very high	125 Å²	125	58.6 Å²	58.6	58%	0.584	28%	0.281	S	S	*	.			trans	-83.1	129	173.3	-67.5	-174	172.6	0	0	111.1	R181 K183	R181-E190 PolarHBondContact NH2-O 3.43Å; K183-E190 HydrophobicContact CB-CG 4.17Å
191	H	96	Very high	93.6	Very high	35 Å²	35	60.6 Å²	60.6	16%	0.162	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	151	178.6	-68	-67.3	0	0	0	110.6	R181 F182 E195 L196	R181-H191 WeakPolarHBondContact CA-O 3.18Å; F182-H191 PolarHBondContact N-O 3.18Å; F182-H191 VanDerWaalsContact N-O 3.14Å; F182-H191 PolarHBondContact O-N 3.38Å; F182-H191 VanDerWaalsContact O-N 3.1Å; H191-E195 WeakPolarHBondContact CA-OE2 3.3Å; H191-E195 HydrophobicContact CB-CB 4.12Å; H191-E195 IonicContact CG-OE2 2.66Å; H191-E195 IonicContact ND1-OE2 3.82Å; H191-E195 PolarHBondContact ND1-OE2 3.02Å; H191-L196 HydrophobicContact CB-CD2 3.69Å; H191-L196 HydrophobicContact CB-CG 3.77Å
192	S	95.9	Very high	93.2	Very high	8 Å²	8	61.3 Å²	61.3	6%	0.056	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	157.3	166	65.6	0	0	0	0	111	I180 E194 E195 L196	I180-S192 CarbonylContact O-C 3.5Å; I180-S192 WeakPolarHBondContact O-CA 3.28Å; S192-E194 PolarHBondContact O-N 2.89Å; S192-E195 PolarHBondContact N-OE2 2.65Å; S192-E195 VanDerWaalsContact N-OE2 3.15Å; S192-E195 WeakPolarHBondContact O-CB 3.49Å; S192-E195 PolarHBondContact O-N 2.9Å; S192-E195 VanDerWaalsContact O-N 3.13Å; S192-E195 WeakPolarHBondContact OG-CG 3.46Å; S192-E195 PolarHBondContact OG-N 3.45Å; S192-E195 PolarHBondContact OG-OE1 2.77Å; S192-L196 WeakPolarHBondContact O-CG 3.47Å; S192-L196 PolarHBondContact O-N 3.46Å
193	A	94.9	Very high	92.9	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63.7	-30.1	177.5	0	0	0	0	0	112.5	P177 I180 L196 M197 Y219 M232	P177-A193 HydrophobicContact CB-CB 4.33Å; P177-A193 WeakPolarHBondContact O-CB 3.44Å; P177-A193 PolarHBondContact O-N 3.14Å; I180-A193 HydrophobicContact CB-CB 3.87Å; I180-A193 HydrophobicContact CD1-CB 4.39Å; I180-A193 HydrophobicContact CG2-CB 3.99Å; I180-A193 PolarHBondContact O-N 2.77Å; A193-L196 PolarHBondContact O-N 2.95Å; A193-M197 VanDerWaalsContact O-CG 3.31Å; A193-M197 WeakPolarHBondContact O-CG 3.36Å; A193-M197 PolarHBondContact O-N 3.43Å; A193-Y219 HydrophobicContact CB-CD2 3.83Å; A193-Y219 HydrophobicContact CB-CE2 4.3Å; A193-M232 HydrophobicContact CB-SD 3.65Å
194	E	93.2	Very high	92.3	Very high	79 Å²	79	65.3 Å²	65.3	37%	0.369	34%	0.339	S	S	.	.	H	α-helix	trans	-62.9	-45.2	171.2	-67.4	-169.8	156.2	0	0	111.9	P177 K178 S192 M197 Q198	P177-E194 HydrophobicContact CB-CG 3.57Å; K178-E194 VanDerWaalsContact CE-CD 3.45Å; K178-E194 WeakPolarHBondContact CE-OE1 3.17Å; K178-E194 VanDerWaalsContact CE-OE2 3.23Å; K178-E194 WeakPolarHBondContact CE-OE2 3.2Å; K178-E194 HydrophobicContact CG-CG 4.19Å; K178-E194 VanDerWaalsContact CG-OE1 3.32Å; K178-E194 WeakPolarHBondContact CG-OE1 3.4Å; K178-E194 WeakPolarHBondContact CG-OE2 3.39Å; S192-E194 PolarHBondContact O-N 2.89Å; E194-M197 PolarHBondContact O-N 3.01Å; E194-Q198 PolarHBondContact O-N 3.49Å
195	E	94.6	Very high	91.9	Very high	68 Å²	68	71.9 Å²	71.9	32%	0.318	37%	0.37	S	S	.	.	H	α-helix	trans	-62.2	-43.5	175.2	-71.6	156.2	-138.7	0	0	111	R181 H191 S192 M197 Q198 I199	R181-E195 IonicContact NH1-OE1 3.85Å; R181-E195 PolarHBondContact NH1-OE1 3.18Å; H191-E195 WeakPolarHBondContact CA-OE2 3.3Å; H191-E195 HydrophobicContact CB-CB 4.12Å; H191-E195 IonicContact CG-OE2 2.66Å; H191-E195 IonicContact ND1-OE2 3.82Å; H191-E195 PolarHBondContact ND1-OE2 3.02Å; S192-E195 PolarHBondContact N-OE2 2.65Å; S192-E195 VanDerWaalsContact N-OE2 3.15Å; S192-E195 WeakPolarHBondContact O-CB 3.49Å; S192-E195 PolarHBondContact O-N 2.9Å; S192-E195 VanDerWaalsContact O-N 3.13Å; S192-E195 WeakPolarHBondContact OG-CG 3.46Å; S192-E195 PolarHBondContact OG-N 3.45Å; S192-E195 PolarHBondContact OG-OE1 2.77Å; E195-M197 VanDerWaalsContact C-N 3.34Å; E195-M197 PolarHBondContact O-N 3.48Å; E195-Q198 PolarHBondContact O-N 3.12Å; E195-Q198 VanDerWaalsContact O-N 3.15Å; E195-I199 VanDerWaalsContact O-CG1 3.29Å; E195-I199 WeakPolarHBondContact O-CG1 3.49Å; E195-I199 PolarHBondContact O-N 2.81Å
196	L	94.1	Very high	91.8	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-60.7	-41.6	178.5	-72.1	176.5	0	0	0	112.2	F182 A184 H191 S192 A193 Q198 I199 F200	F182-L196 HydrophobicContact CD1-CD1 4.18Å; F182-L196 HydrophobicContact CE1-CD1 3.49Å; F182-L196 VanDerWaalsContact CE1-CD1 3.49Å; F182-L196 HydrophobicContact CZ-CD1 3.85Å; A184-L196 HydrophobicContact CB-CD1 4.04Å; A184-L196 HydrophobicContact CB-CD2 3.75Å; H191-L196 HydrophobicContact CB-CD2 3.69Å; H191-L196 HydrophobicContact CB-CG 3.77Å; S192-L196 WeakPolarHBondContact O-CG 3.47Å; S192-L196 PolarHBondContact O-N 3.46Å; A193-L196 PolarHBondContact O-N 2.95Å; L196-Q198 VanDerWaalsContact C-N 3.28Å; L196-Q198 PolarHBondContact O-N 3.46Å; L196-I199 PolarHBondContact O-N 2.95Å; L196-F200 HydrophobicContact CB-CD2 4.17Å; L196-F200 HydrophobicContact CB-CE2 3.87Å; L196-F200 HydrophobicContact CD2-CE2 3.87Å; L196-F200 HydrophobicContact CD2-CZ 3.91Å; L196-F200 HydrophobicContact CG-CE2 4.32Å; L196-F200 WeakPolarHBondContact O-CB 3.38Å; L196-F200 WeakPolarHBondContact O-CD2 3.44Å; L196-F200 WeakPolarHBondContact O-CG 3.34Å; L196-F200 PolarHBondContact O-N 2.59Å
197	M	93.3	Very high	91.8	Very high	20 Å²	20	71.1 Å²	71.1	10%	0.099	36%	0.36	C	S	.	.	H	α-helix	trans	-59.6	-40.1	175.9	-71.3	-60.5	-176.7	0	0	111.9	A193 E194 E195 S201 L210 I213 Y219 M232 I235	A193-M197 VanDerWaalsContact O-CG 3.31Å; A193-M197 WeakPolarHBondContact O-CG 3.36Å; A193-M197 PolarHBondContact O-N 3.43Å; E194-M197 PolarHBondContact O-N 3.01Å; E195-M197 VanDerWaalsContact C-N 3.34Å; E195-M197 PolarHBondContact O-N 3.48Å; M197-S201 PolarHBondContact O-N 2.92Å; M197-L210 HydrophobicContact SD-CB 4.24Å; M197-L210 HydrophobicContact SD-CD2 3.72Å; M197-L210 HydrophobicContact SD-CG 4.45Å; M197-I213 HydrophobicContact CE-CD1 3.68Å; M197-I213 HydrophobicContact CE-CG1 3.61Å; M197-Y219 HydrophobicContact CE-CD2 3.69Å; M197-Y219 HydrophobicContact CE-CE1 4.27Å; M197-Y219 HydrophobicContact CE-CE2 3.24Å; M197-Y219 HydrophobicContact CE-CG 4.36Å; M197-Y219 HydrophobicContact CG-CE2 3.71Å; M197-Y219 HydrophobicContact SD-CE2 4.33Å; M197-M232 HydrophobicContact CE-CE 3.95Å; M197-I235 HydrophobicContact CE-CG1 4.13Å
198	Q	92.5	Very high	91.9	Very high	140 Å²	140	72 Å²	72	65%	0.654	37%	0.365	S	S	*	.	H	α-helix	trans	-69.2	-44.3	176.2	-65.1	176.5	11.1	0	0	111.7	E194 E195 L196 F200 S201	E194-Q198 PolarHBondContact O-N 3.49Å; E195-Q198 PolarHBondContact O-N 3.12Å; E195-Q198 VanDerWaalsContact O-N 3.15Å; L196-Q198 VanDerWaalsContact C-N 3.28Å; L196-Q198 PolarHBondContact O-N 3.46Å; Q198-F200 PolarHBondContact O-N 2.87Å; Q198-S201 WeakPolarHBondContact O-CB 3.46Å; Q198-S201 PolarHBondContact O-N 3.01Å; Q198-S201 PolarHBondContact O-OG 3.25Å
199	I	91.5	Very high	92.1	Very high	58 Å²	58	66.6 Å²	66.6	30%	0.297	33%	0.331	S	S	.	.	H	α-helix	trans	-59.8	-47.4	178.7	-69.1	164.5	0	0	0	110.5	E195 L196 S201 N202	E195-I199 VanDerWaalsContact O-CG1 3.29Å; E195-I199 WeakPolarHBondContact O-CG1 3.49Å; E195-I199 PolarHBondContact O-N 2.81Å; L196-I199 PolarHBondContact O-N 2.95Å; I199-S201 VanDerWaalsContact C-N 3.26Å; I199-S201 PolarHBondContact O-N 2.85Å; I199-N202 PolarHBondContact O-N 3.05Å
200	F	93.2	Very high	92.2	Very high	3 Å²	3	60.8 Å²	60.8	1%	0.013	30%	0.304	C	S	.	.	H	α-helix	trans	-76.5	-10.4	-177.4	-61.1	-41.3	0	0	0	113.9	A184 L196 Q198 N202 D203 L206 L210 I235 I236	A184-F200 HydrophobicContact CB-CZ 4.14Å; L196-F200 HydrophobicContact CB-CD2 4.17Å; L196-F200 HydrophobicContact CB-CE2 3.87Å; L196-F200 HydrophobicContact CD2-CE2 3.87Å; L196-F200 HydrophobicContact CD2-CZ 3.91Å; L196-F200 HydrophobicContact CG-CE2 4.32Å; L196-F200 WeakPolarHBondContact O-CB 3.38Å; L196-F200 WeakPolarHBondContact O-CD2 3.44Å; L196-F200 WeakPolarHBondContact O-CG 3.34Å; L196-F200 PolarHBondContact O-N 2.59Å; Q198-F200 PolarHBondContact O-N 2.87Å; F200-N202 PolarHBondContact O-N 3.42Å; F200-D203 HydrophobicContact CB-CB 4.35Å; F200-D203 HydrophobicContact CD1-CB 4.29Å; F200-D203 WeakPolarHBondContact O-CB 3.5Å; F200-D203 PolarHBondContact O-N 3.13Å; F200-L206 HydrophobicContact CB-CB 4.18Å; F200-L206 HydrophobicContact CD1-CD1 3.62Å; F200-L206 HydrophobicContact CD2-CD1 4.31Å; F200-L206 HydrophobicContact CE1-CD1 3.69Å; F200-L206 HydrophobicContact CE2-CD1 4.37Å; F200-L206 HydrophobicContact CG-CB 4.33Å; F200-L206 HydrophobicContact CG-CD1 3.96Å; F200-L206 HydrophobicContact CZ-CD1 4.09Å; F200-L210 HydrophobicContact CB-CD1 4.12Å; F200-L210 HydrophobicContact CB-CD2 3.81Å; F200-I235 HydrophobicContact CD2-CG2 4.11Å; F200-I235 HydrophobicContact CE2-CG2 4.41Å; F200-I236 HydrophobicContact CE1-CD1 4.06Å; F200-I236 HydrophobicContact CE2-CB 4.47Å; F200-I236 HydrophobicContact CE2-CD1 4.07Å; F200-I236 HydrophobicContact CE2-CG2 4.01Å; F200-I236 HydrophobicContact CZ-CD1 3.46Å; F200-I236 VanDerWaalsContact CZ-CD1 3.46Å; F200-I236 HydrophobicContact CZ-CG2 4.37Å
201	S	91.5	Very high	92.2	Very high	45 Å²	45	58.3 Å²	58.3	32%	0.315	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-23	174	74.3	0	0	0	0	113.2	M197 Q198 I199 K207	M197-S201 PolarHBondContact O-N 2.92Å; Q198-S201 WeakPolarHBondContact O-CB 3.46Å; Q198-S201 PolarHBondContact O-N 3.01Å; Q198-S201 PolarHBondContact O-OG 3.25Å; I199-S201 VanDerWaalsContact C-N 3.26Å; I199-S201 PolarHBondContact O-N 2.85Å; S201-K207 VanDerWaalsContact O-CD 3.23Å; S201-K207 WeakPolarHBondContact O-CD 3.38Å; S201-K207 WeakPolarHBondContact O-CE 3.47Å
202	N	89	Confident	92.2	Very high	143 Å²	143	59.1 Å²	59.1	77%	0.765	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-3.9	175.1	-64.8	-40.7	0	0	0	113	I199 F200	I199-N202 PolarHBondContact O-N 3.05Å; F200-N202 PolarHBondContact O-N 3.42Å
203	D	89.2	Confident	92.1	Very high	51 Å²	51	58.8 Å²	58.8	27%	0.273	30%	0.302	S	S	.	.			trans	-81.5	127.7	-179.7	-171.7	-70.3	0	0	0	110.6	F200 H205 L206 K207	F200-D203 HydrophobicContact CB-CB 4.35Å; F200-D203 HydrophobicContact CD1-CB 4.29Å; F200-D203 WeakPolarHBondContact O-CB 3.5Å; F200-D203 PolarHBondContact O-N 3.13Å; D203-H205 VanDerWaalsContact C-N 3.28Å; D203-H205 PolarHBondContact O-N 3.4Å; D203-H205 WeakPolarHBondContact OD1-CA 3.25Å; D203-H205 PolarHBondContact OD1-N 3.23Å; D203-L206 HydrophobicContact CB-CB 4.22Å; D203-L206 PolarHBondContact OD1-N 3.08Å; D203-K207 WeakPolarHBondContact O-CB 3.06Å; D203-K207 PolarHBondContact O-N 3.44Å
204	T	83.7	Confident	91.9	Very high	123 Å²	123	62.7 Å²	62.7	76%	0.755	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-29.4	-176	48	0	0	0	0	113.5
205	H	85.6	Confident	91.9	Very high	138 Å²	138	65.4 Å²	65.4	64%	0.639	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-43.7	-175.6	-68.4	-82.5	0	0	0	112	D203 Q208 Y209	D203-H205 VanDerWaalsContact C-N 3.28Å; D203-H205 PolarHBondContact O-N 3.4Å; D203-H205 WeakPolarHBondContact OD1-CA 3.25Å; D203-H205 PolarHBondContact OD1-N 3.23Å; H205-Q208 WeakPolarHBondContact O-CG 3.29Å; H205-Q208 PolarHBondContact O-NE2 3.09Å; H205-Q208 VanDerWaalsContact O-NE2 3.1Å; H205-Y209 WeakPolarHBondContact O-CE2 3.39Å
206	L	90.2	Very high	91.7	Very high	21 Å²	21	66.7 Å²	66.7	11%	0.11	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-24.8	-172.5	-65.8	175.9	0	0	0	114	F200 D203 Q208 Y209 I235 I236	F200-L206 HydrophobicContact CB-CB 4.18Å; F200-L206 HydrophobicContact CD1-CD1 3.62Å; F200-L206 HydrophobicContact CD2-CD1 4.31Å; F200-L206 HydrophobicContact CE1-CD1 3.69Å; F200-L206 HydrophobicContact CE2-CD1 4.37Å; F200-L206 HydrophobicContact CG-CB 4.33Å; F200-L206 HydrophobicContact CG-CD1 3.96Å; F200-L206 HydrophobicContact CZ-CD1 4.09Å; D203-L206 HydrophobicContact CB-CB 4.22Å; D203-L206 PolarHBondContact OD1-N 3.08Å; L206-Q208 PolarHBondContact O-N 3.04Å; L206-Y209 HydrophobicContact CD2-CD2 4.16Å; L206-Y209 PolarHBondContact O-N 2.64Å; L206-I235 WeakPolarHBondContact CD2-O 3.45Å; L206-I236 HydrophobicContact CD1-CD1 3.75Å; L206-I236 HydrophobicContact CD1-CG1 4.48Å
207	K	91.8	Very high	91.7	Very high	124 Å²	124	71.6 Å²	71.6	54%	0.539	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-37.2	-179.3	176.1	-176.9	-170.6	166.8	0	113.4	S201 D203 Y209 L210 P211	S201-K207 VanDerWaalsContact O-CD 3.23Å; S201-K207 WeakPolarHBondContact O-CD 3.38Å; S201-K207 WeakPolarHBondContact O-CE 3.47Å; D203-K207 WeakPolarHBondContact O-CB 3.06Å; D203-K207 PolarHBondContact O-N 3.44Å; K207-Y209 PolarHBondContact O-N 3.35Å; K207-L210 PolarHBondContact O-N 3.32Å; K207-P211 WeakPolarHBondContact O-CD 3.47Å
208	Q	92.2	Very high	91.7	Very high	83 Å²	83	74.6 Å²	74.6	39%	0.388	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-20.4	-178.4	71.5	-174.5	-48	0	0	113.9	H205 L206	H205-Q208 WeakPolarHBondContact O-CG 3.29Å; H205-Q208 PolarHBondContact O-NE2 3.09Å; H205-Q208 VanDerWaalsContact O-NE2 3.1Å; L206-Q208 PolarHBondContact O-N 3.04Å
209	Y	94.9	Very high	92	Very high	5 Å²	5	68.7 Å²	68.7	2%	0.02	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-19.2	-178	-54	-55.8	0	0	0	113.2	Q147 K152 R153 H205 L206 K207 P211 L212 I235	Q147-Y209 PolarHBondContact NE2-OH 2.89Å; K152-Y209 HydrophobicContact CB-CE1 4.09Å; K152-Y209 WeakPolarHBondContact O-CD1 3.44Å; K152-Y209 WeakPolarHBondContact O-CE1 3.29Å; R153-Y209 HydrophobicContact CB-CD1 4.2Å; R153-Y209 HydrophobicContact CB-CE1 4.35Å; R153-Y209 HydrophobicContact CG-CD1 4.1Å; R153-Y209 HydrophobicContact CG-CE1 3.87Å; H205-Y209 WeakPolarHBondContact O-CE2 3.39Å; L206-Y209 HydrophobicContact CD2-CD2 4.16Å; L206-Y209 PolarHBondContact O-N 2.64Å; K207-Y209 PolarHBondContact O-N 3.35Å; Y209-P211 VanDerWaalsContact C-CD 3.45Å; Y209-P211 VanDerWaalsContact C-N 3.34Å; Y209-L212 HydrophobicContact CD1-CD1 4.37Å; Y209-L212 VanDerWaalsContact O-CB 3.23Å; Y209-L212 WeakPolarHBondContact O-CB 3.4Å; Y209-L212 VanDerWaalsContact O-CG 3.28Å; Y209-L212 WeakPolarHBondContact O-CG 3.35Å; Y209-L212 PolarHBondContact O-N 3.21Å; Y209-I235 VanDerWaalsContact O-CD1 3.24Å; Y209-I235 WeakPolarHBondContact O-CD1 3.4Å
210	L	95.2	Very high	92.2	Very high	7 Å²	7	66 Å²	66	4%	0.037	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-54.6	-43.4	179.7	-47.5	178.7	0	0	0	112.7	M197 F200 K207 L212 I213 Q214 I235	M197-L210 HydrophobicContact SD-CB 4.24Å; M197-L210 HydrophobicContact SD-CD2 3.72Å; M197-L210 HydrophobicContact SD-CG 4.45Å; F200-L210 HydrophobicContact CB-CD1 4.12Å; F200-L210 HydrophobicContact CB-CD2 3.81Å; K207-L210 PolarHBondContact O-N 3.32Å; L210-L212 PolarHBondContact O-N 3.01Å; L210-I213 PolarHBondContact O-N 2.96Å; L210-I213 VanDerWaalsContact O-N 3.11Å; L210-Q214 VanDerWaalsContact O-CB 3.28Å; L210-Q214 WeakPolarHBondContact O-CB 3.35Å; L210-Q214 PolarHBondContact O-N 3.4Å; L210-I235 HydrophobicContact CD2-CD1 4.26Å; L210-I235 HydrophobicContact CD2-CG2 3.98Å
211	P	94.9	Very high	92.5	Very high	74 Å²	74	66 Å²	66	48%	0.481	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-57.8	-16.9	178.7	-26.3	37	0	0	0	115.4	K207 Y209 I213	K207-P211 WeakPolarHBondContact O-CD 3.47Å; Y209-P211 VanDerWaalsContact C-CD 3.45Å; Y209-P211 VanDerWaalsContact C-N 3.34Å; P211-I213 VanDerWaalsContact C-N 3.28Å; P211-I213 PolarHBondContact O-N 2.98Å
212	L	94	Very high	92.8	Very high	52 Å²	52	63.9 Å²	63.9	27%	0.272	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-65.7	-31.4	178.4	-62	176.9	0	0	0	112.6	R153 Y209 L210 P234	R153-L212 HydrophobicContact CB-CD1 4.16Å; Y209-L212 HydrophobicContact CD1-CD1 4.37Å; Y209-L212 VanDerWaalsContact O-CB 3.23Å; Y209-L212 WeakPolarHBondContact O-CB 3.4Å; Y209-L212 VanDerWaalsContact O-CG 3.28Å; Y209-L212 WeakPolarHBondContact O-CG 3.35Å; Y209-L212 PolarHBondContact O-N 3.21Å; L210-L212 PolarHBondContact O-N 3.01Å; L212-P234 HydrophobicContact CB-CG 3.86Å; L212-P234 HydrophobicContact CD1-CB 4.18Å; L212-P234 HydrophobicContact CD1-CG 3.59Å; L212-P234 HydrophobicContact CG-CG 4.39Å
213	I	94	Very high	93.2	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.005	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.2	-10.4	-179.5	65.1	168.4	0	0	0	114.5	I116 M197 L210 P211 D215 K216 Y219 P220 P234 I235	I116-I213 HydrophobicContact CG2-CG2 3.96Å; M197-I213 HydrophobicContact CE-CD1 3.68Å; M197-I213 HydrophobicContact CE-CG1 3.61Å; L210-I213 PolarHBondContact O-N 2.96Å; L210-I213 VanDerWaalsContact O-N 3.11Å; P211-I213 VanDerWaalsContact C-N 3.28Å; P211-I213 PolarHBondContact O-N 2.98Å; I213-D215 PolarHBondContact O-N 3.22Å; I213-D215 VanDerWaalsContact O-N 3.07Å; I213-K216 HydrophobicContact CB-CG 4.43Å; I213-K216 VanDerWaalsContact O-CB 3.25Å; I213-K216 WeakPolarHBondContact O-CB 3.25Å; I213-K216 WeakPolarHBondContact O-CG 3.44Å; I213-K216 PolarHBondContact O-N 3.15Å; I213-Y219 HydrophobicContact CB-CD1 4.28Å; I213-Y219 HydrophobicContact CD1-CD1 3.99Å; I213-Y219 HydrophobicContact CD1-CD2 4.35Å; I213-Y219 HydrophobicContact CD1-CG 3.88Å; I213-Y219 HydrophobicContact CG1-CD1 4.24Å; I213-Y219 HydrophobicContact CG1-CE1 4.49Å; I213-Y219 WeakPolarHBondContact O-CE1 3.2Å; I213-P220 HydrophobicContact CG2-CG 4.5Å; I213-P234 HydrophobicContact CG2-CG 4.45Å; I213-I235 HydrophobicContact CD1-CD1 4.38Å; I213-I235 HydrophobicContact CD1-CG1 3.74Å; I213-I235 HydrophobicContact CG1-CD1 4.16Å; I213-I235 HydrophobicContact CG1-CG1 4.04Å
214	Q	92.3	Very high	93.6	Very high	81 Å²	81	55.5 Å²	55.5	38%	0.379	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-39.4	-172.6	73	-171.2	3.7	0	0	113.5	L210 K216 Y219	L210-Q214 VanDerWaalsContact O-CB 3.28Å; L210-Q214 WeakPolarHBondContact O-CB 3.35Å; L210-Q214 PolarHBondContact O-N 3.4Å; Q214-K216 VanDerWaalsContact C-N 3.3Å; Q214-K216 PolarHBondContact O-N 3.35Å; Q214-Y219 PolarHBondContact O-OH 2.69Å
215	D	91.3	Very high	94.3	Very high	136 Å²	136	52.5 Å²	52.5	73%	0.727	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	6.5	-175.3	-58.7	-53.9	0	0	0	112.8	I213	I213-D215 PolarHBondContact O-N 3.22Å; I213-D215 VanDerWaalsContact O-N 3.07Å
216	K	92.3	Very high	94.8	Very high	96 Å²	96	49.2 Å²	49.2	42%	0.417	26%	0.26	S	S	.	.	S	Bend	trans	-90.3	145.2	179.8	-57.4	-65.8	-176.6	176.4	0	110.6	I116 I213 Q214 K218 Y219	I116-K216 HydrophobicContact CD1-CB 4.34Å; I116-K216 HydrophobicContact CG2-CG 4.32Å; I213-K216 HydrophobicContact CB-CG 4.43Å; I213-K216 VanDerWaalsContact O-CB 3.25Å; I213-K216 WeakPolarHBondContact O-CB 3.25Å; I213-K216 WeakPolarHBondContact O-CG 3.44Å; I213-K216 PolarHBondContact O-N 3.15Å; Q214-K216 VanDerWaalsContact C-N 3.3Å; Q214-K216 PolarHBondContact O-N 3.35Å; K216-K218 PolarHBondContact O-N 2.83Å; K216-Y219 WeakPolarHBondContact O-CE1 3.15Å
217	P	92.3	Very high	94.9	Very high	103 Å²	103	53.7 Å²	53.7	67%	0.669	29%	0.285	S	S	*	.	S	Bend	trans	-70	-20	-177.2	28.2	-36.1	0	0	0	113.9	P177	P177-P217 WeakPolarHBondContact CD-O 3.32Å
218	K	95.1	Very high	95.2	Very high	82 Å²	82	49.5 Å²	49.5	36%	0.357	27%	0.269	S	S	.	.	S	Bend	trans	-136.1	151.1	-179.6	-62.2	-177	175.2	-169.1	0	108.4	I116 A174 K175 K216	I116-K218 HydrophobicContact CD1-CB 4.17Å; I116-K218 WeakPolarHBondContact CD1-O 3.5Å; A174-K218 HydrophobicContact CB-CB 3.93Å; A174-K218 WeakPolarHBondContact O-CD 3.49Å; K175-K218 CarbonylContact O-C 3.55Å; K175-K218 WeakPolarHBondContact O-CA 3.46Å; K175-K218 WeakPolarHBondContact O-CB 3.46Å; K216-K218 PolarHBondContact O-N 2.83Å
219	Y	97.1	Very high	95.4	Very high	17 Å²	17	46.3 Å²	46.3	7%	0.067	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	139.6	175.8	-64.8	-12.5	0	0	0	111.2	A174 K175 P177 A193 M197 I213 Q214 K216 M232	A174-Y219 VanDerWaalsContact CA-O 3.28Å; A174-Y219 WeakPolarHBondContact CA-O 3.47Å; K175-Y219 PolarHBondContact N-O 3.03Å; K175-Y219 VanDerWaalsContact N-O 3.1Å; K175-Y219 PolarHBondContact O-N 3Å; P177-Y219 HydrophobicContact CB-CD2 3.87Å; P177-Y219 HydrophobicContact CB-CE2 3.69Å; P177-Y219 HydrophobicContact CB-CG 4.5Å; P177-Y219 HydrophobicContact CG-CD1 3.99Å; P177-Y219 HydrophobicContact CG-CD2 3.73Å; P177-Y219 HydrophobicContact CG-CE1 3.82Å; P177-Y219 HydrophobicContact CG-CE2 3.59Å; P177-Y219 HydrophobicContact CG-CG 3.92Å; A193-Y219 HydrophobicContact CB-CD2 3.83Å; A193-Y219 HydrophobicContact CB-CE2 4.3Å; M197-Y219 HydrophobicContact CE-CD2 3.69Å; M197-Y219 HydrophobicContact CE-CE1 4.27Å; M197-Y219 HydrophobicContact CE-CE2 3.24Å; M197-Y219 HydrophobicContact CE-CG 4.36Å; M197-Y219 HydrophobicContact CG-CE2 3.71Å; M197-Y219 HydrophobicContact SD-CE2 4.33Å; I213-Y219 HydrophobicContact CB-CD1 4.28Å; I213-Y219 HydrophobicContact CD1-CD1 3.99Å; I213-Y219 HydrophobicContact CD1-CD2 4.35Å; I213-Y219 HydrophobicContact CD1-CG 3.88Å; I213-Y219 HydrophobicContact CG1-CD1 4.24Å; I213-Y219 HydrophobicContact CG1-CE1 4.49Å; I213-Y219 WeakPolarHBondContact O-CE1 3.2Å; Q214-Y219 PolarHBondContact O-OH 2.69Å; K216-Y219 WeakPolarHBondContact O-CE1 3.15Å; Y219-M232 HydrophobicContact CD2-SD 4.07Å
220	P	97.5	Very high	95.5	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.006	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	137	178	-7.8	24.2	0	0	0	110.2	I116 Y172 D173 I213 M232 P233	I116-P220 HydrophobicContact CG2-CG 4.05Å; Y172-P220 HydrophobicContact CE2-CB 3.72Å; D173-P220 CarbonylContact O-C 3.57Å; D173-P220 WeakPolarHBondContact O-CA 3.36Å; I213-P220 HydrophobicContact CG2-CG 4.5Å; P220-M232 WeakPolarHBondContact O-CA 3.41Å; P220-M232 WeakPolarHBondContact O-CG 3.46Å; P220-P233 WeakPolarHBondContact CD-O 3.4Å; P220-P233 VanDerWaalsContact CG-O 3.26Å; P220-P233 WeakPolarHBondContact CG-O 3.37Å; P220-P233 WeakPolarHBondContact O-CD 3.39Å
221	I	97.7	Very high	95.6	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.015	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	149.4	172.9	56.7	160.5	0	0	0	110.5	Y172 D173 K175 I180 F223 S231 M232	Y172-I221 WeakPolarHBondContact CD2-O 3.24Å; D173-I221 PolarHBondContact N-O 2.9Å; D173-I221 PolarHBondContact O-N 2.91Å; K175-I221 HydrophobicContact CD-CD1 3.74Å; K175-I221 HydrophobicContact CG-CD1 4.11Å; I180-I221 HydrophobicContact CB-CG2 4.48Å; I180-I221 HydrophobicContact CD1-CG2 3.63Å; I180-I221 HydrophobicContact CG1-CD1 4.31Å; I180-I221 HydrophobicContact CG1-CG2 3.95Å; I180-I221 HydrophobicContact CG2-CG2 3.7Å; I221-F223 HydrophobicContact CD1-CD1 3.74Å; I221-F223 HydrophobicContact CD1-CE1 4.17Å; I221-F223 HydrophobicContact CG1-CD1 4.16Å; I221-S231 WeakPolarHBondContact CA-O 3.19Å; I221-M232 HydrophobicContact CG2-CB 4.35Å; I221-M232 HydrophobicContact CG2-CG 4.17Å
222	I	98.5	Very high	95.7	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	132.7	166.9	-61.8	174.5	0	0	0	107.8	L107 V120 F171 Y172 V229 L230 S231 P233 E253 T255	L107-I222 HydrophobicContact CD1-CG2 4.3Å; V120-I222 HydrophobicContact CG2-CD1 4.31Å; F171-I222 VanDerWaalsContact O-CA 3.3Å; F171-I222 WeakPolarHBondContact O-CA 3.4Å; Y172-I222 HydrophobicContact CD2-CD1 4.09Å; Y172-I222 HydrophobicContact CD2-CG1 3.47Å; Y172-I222 VanDerWaalsContact CD2-CG1 3.47Å; Y172-I222 HydrophobicContact CE2-CG1 4.24Å; Y172-I222 HydrophobicContact CG-CG1 4.15Å; I222-V229 CarbonylContact O-C 3.51Å; I222-L230 HydrophobicContact CB-CB 4.35Å; I222-L230 HydrophobicContact CG2-CB 4.19Å; I222-L230 HydrophobicContact CG2-CD2 3.99Å; I222-L230 PolarHBondContact O-N 3.26Å; I222-S231 PolarHBondContact N-O 3.29Å; I222-S231 PolarHBondContact O-N 2.89Å; I222-P233 HydrophobicContact CD1-CG 4.34Å; I222-E253 HydrophobicContact CD1-CB 4.42Å; I222-E253 HydrophobicContact CD1-CG 3.55Å; I222-T255 HydrophobicContact CD1-CG2 3.8Å
223	F	98.1	Very high	95.8	Very high	17 Å²	17	40.1 Å²	40.1	8%	0.075	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	160.6	179.4	62.9	-83.2	0	0	0	111.8	F170 F171 D173 I221 T228	F170-F223 CarbonylContact C-O 3.57Å; F170-F223 WeakPolarHBondContact CA-O 3.29Å; F171-F223 HydrophobicContact CB-CD1 4.17Å; F171-F223 HydrophobicContact CB-CD2 4.21Å; F171-F223 HydrophobicContact CB-CE1 3.67Å; F171-F223 HydrophobicContact CB-CE2 3.72Å; F171-F223 HydrophobicContact CB-CG 4.42Å; F171-F223 HydrophobicContact CB-CZ 3.43Å; F171-F223 VanDerWaalsContact CB-CZ 3.43Å; F171-F223 HydrophobicContact CD2-CD2 4.21Å; F171-F223 AromaticContact CD2-CE2 3.83Å; F171-F223 HydrophobicContact CD2-CE2 3.83Å; F171-F223 HydrophobicContact CD2-CZ 4.37Å; F171-F223 AromaticContact CG-CE2 3.95Å; F171-F223 HydrophobicContact CG-CE2 3.95Å; F171-F223 HydrophobicContact CG-CZ 4.01Å; F171-F223 PolarHBondContact N-O 3.13Å; F171-F223 PolarHBondContact O-N 3.41Å; D173-F223 HydrophobicContact CB-CE1 3.77Å; I221-F223 HydrophobicContact CD1-CD1 3.74Å; I221-F223 HydrophobicContact CD1-CE1 4.17Å; I221-F223 HydrophobicContact CG1-CD1 4.16Å; F223-T228 CarbonylContact C-O 3.57Å; F223-T228 WeakPolarHBondContact CA-O 3.12Å; F223-T228 VanDerWaalsContact CB-O 3.27Å; F223-T228 WeakPolarHBondContact CB-O 3.33Å
224	D	98	Very high	95.9	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-179.2	-179.1	81.3	-8.2	0	0	0	113.3	N167 P169 F170 S226 N227 T228 L230	N167-D224 PolarHBondContact N-OD2 3.31Å; N167-D224 WeakPolarHBondContact O-CB 3.45Å; P169-D224 CarbonylContact O-C 3.53Å; F170-D224 HydrophobicContact CD1-CB 3.73Å; F170-D224 HydrophobicContact CE1-CB 3.78Å; D224-S226 PolarHBondContact O-N 2.99Å; D224-S226 VanDerWaalsContact O-N 3.15Å; D224-S226 VanDerWaalsContact OD1-CA 3.3Å; D224-S226 WeakPolarHBondContact OD1-CA 3.21Å; D224-S226 WeakPolarHBondContact OD1-CB 3.23Å; D224-S226 PolarHBondContact OD1-N 3.3Å; D224-N227 PolarHBondContact O-N 2.93Å; D224-N227 PolarHBondContact OD1-N 2.88Å; D224-T228 PolarHBondContact N-O 3.49Å; D224-T228 VanDerWaalsContact OD1-CB 3.24Å; D224-T228 WeakPolarHBondContact OD1-CB 3.39Å; D224-T228 PolarHBondContact OD1-N 3.33Å; D224-T228 PolarHBondContact OD1-OG1 2.95Å; D224-L230 HydrophobicContact CB-CD1 3.97Å
225	S	96.6	Very high	96	Very high	61 Å²	61	36.4 Å²	36.4	43%	0.427	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.7	178.5	64.9	0	0	0	0	114.2	N167 P169 N227	N167-S225 WeakPolarHBondContact CB-OG 3.39Å; N167-S225 WeakPolarHBondContact O-CB 3.47Å; N167-S225 PolarHBondContact O-N 3Å; N167-S225 PolarHBondContact O-OG 3.01Å; P169-S225 PolarHBondContact O-N 3.48Å; P169-S225 VanDerWaalsContact O-N 3.08Å; S225-N227 VanDerWaalsContact C-N 3.32Å
226	S	95.9	Very high	96.2	Very high	68 Å²	68	30.7 Å²	30.7	48%	0.476	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	6.9	175	-59.9	0	0	0	0	112.7	N167 D224 T228	N167-S226 PolarHBondContact ND2-OG 3.31Å; D224-S226 PolarHBondContact O-N 2.99Å; D224-S226 VanDerWaalsContact O-N 3.15Å; D224-S226 VanDerWaalsContact OD1-CA 3.3Å; D224-S226 WeakPolarHBondContact OD1-CA 3.21Å; D224-S226 WeakPolarHBondContact OD1-CB 3.23Å; D224-S226 PolarHBondContact OD1-N 3.3Å; S226-T228 PolarHBondContact O-N 2.98Å
227	N	94.2	Very high	96.4	Very high	115 Å²	115	27.4 Å²	27.4	62%	0.615	16%	0.159	S	C	*	.			trans	61.7	20.6	-171.6	-62.1	-69.9	0	0	0	114.4	D224 S225 V229	D224-N227 PolarHBondContact O-N 2.93Å; D224-N227 PolarHBondContact OD1-N 2.88Å; S225-N227 VanDerWaalsContact C-N 3.32Å; N227-V229 PolarHBondContact O-N 3.14Å
228	T	96.2	Very high	96.6	Very high	36 Å²	36	22.6 Å²	22.6	22%	0.221	13%	0.128	C	C	.	.			trans	-73.3	122.7	172.8	-47.7	0	0	0	0	108.7	F223 D224 S226 L230 H240	F223-T228 CarbonylContact C-O 3.57Å; F223-T228 WeakPolarHBondContact CA-O 3.12Å; F223-T228 VanDerWaalsContact CB-O 3.27Å; F223-T228 WeakPolarHBondContact CB-O 3.33Å; D224-T228 PolarHBondContact N-O 3.49Å; D224-T228 VanDerWaalsContact OD1-CB 3.24Å; D224-T228 WeakPolarHBondContact OD1-CB 3.39Å; D224-T228 PolarHBondContact OD1-N 3.33Å; D224-T228 PolarHBondContact OD1-OG1 2.95Å; S226-T228 PolarHBondContact O-N 2.98Å; T228-L230 WeakPolarHBondContact O-CD1 3.42Å; T228-L230 PolarHBondContact O-N 3.04Å; T228-H240 HydrophobicContact CG2-CB 4.2Å; T228-H240 VanDerWaalsContact CG2-CD2 3.48Å; T228-H240 WeakPolarHBondContact CG2-CD2 3.44Å
229	V	97.3	Very high	96.6	Very high	17 Å²	17	20.8 Å²	20.8	10%	0.103	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	119.4	177.5	179.8	0	0	0	0	109.7	F182 I222 N227	F182-V229 HydrophobicContact CB-CB 3.64Å; F182-V229 HydrophobicContact CB-CG1 4.14Å; F182-V229 HydrophobicContact CB-CG2 3.97Å; F182-V229 HydrophobicContact CD1-CB 4.41Å; F182-V229 HydrophobicContact CD1-CG1 4Å; F182-V229 HydrophobicContact CD2-CB 4.15Å; F182-V229 HydrophobicContact CD2-CG1 3.87Å; F182-V229 HydrophobicContact CE1-CG1 4.37Å; F182-V229 HydrophobicContact CE2-CG1 4.24Å; F182-V229 HydrophobicContact CG-CB 3.84Å; F182-V229 HydrophobicContact CG-CG1 3.75Å; F182-V229 HydrophobicContact CG-CG2 4.41Å; F182-V229 HydrophobicContact CZ-CG1 4.48Å; I222-V229 CarbonylContact O-C 3.51Å; N227-V229 PolarHBondContact O-N 3.14Å
230	L	97.5	Very high	96.5	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-49	175.8	-81.7	68.3	0	0	0	110.7	H161 L166 F170 I222 D224 T228 G238 F251	H161-L230 PolarHBondContact CE1-O 2.93Å; L166-L230 HydrophobicContact CD1-CD1 4.23Å; L166-L230 HydrophobicContact CD1-CD2 3.61Å; L166-L230 HydrophobicContact CD1-CG 3.7Å; L166-L230 HydrophobicContact CD2-CD1 3.65Å; L166-L230 HydrophobicContact CD2-CG 3.84Å; L166-L230 HydrophobicContact CG-CG 4.42Å; F170-L230 HydrophobicContact CD1-CD1 4.28Å; F170-L230 HydrophobicContact CD1-CD2 3.97Å; F170-L230 HydrophobicContact CE1-CD1 4.39Å; F170-L230 HydrophobicContact CE1-CD2 4Å; I222-L230 HydrophobicContact CB-CB 4.35Å; I222-L230 HydrophobicContact CG2-CB 4.19Å; I222-L230 HydrophobicContact CG2-CD2 3.99Å; I222-L230 PolarHBondContact O-N 3.26Å; D224-L230 HydrophobicContact CB-CD1 3.97Å; T228-L230 WeakPolarHBondContact O-CD1 3.42Å; T228-L230 PolarHBondContact O-N 3.04Å; L230-G238 WeakPolarHBondContact O-CA 3.36Å; L230-G238 PolarHBondContact O-N 2.89Å; L230-F251 HydrophobicContact CD2-CD1 4.13Å; L230-F251 HydrophobicContact CD2-CE1 4.06Å
231	S	97.2	Very high	96.5	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	158.3	-175.7	61	0	0	0	0	111.6	I221 I222 E253	I221-S231 WeakPolarHBondContact CA-O 3.19Å; I222-S231 PolarHBondContact N-O 3.29Å; I222-S231 PolarHBondContact O-N 2.89Å; S231-E253 PolarHBondContact OG-OE1 2.93Å
232	M	97.1	Very high	96.4	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	80.1	167.6	-173.6	-174.3	75.5	0	0	109	F182 A193 M197 Y219 P220 I221 I235 I236	F182-M232 HydrophobicContact CE1-CB 4.05Å; F182-M232 HydrophobicContact CE1-SD 4.48Å; F182-M232 HydrophobicContact CZ-CB 3.81Å; A193-M232 HydrophobicContact CB-SD 3.65Å; M197-M232 HydrophobicContact CE-CE 3.95Å; Y219-M232 HydrophobicContact CD2-SD 4.07Å; P220-M232 WeakPolarHBondContact O-CA 3.41Å; P220-M232 WeakPolarHBondContact O-CG 3.46Å; I221-M232 HydrophobicContact CG2-CB 4.35Å; I221-M232 HydrophobicContact CG2-CG 4.17Å; M232-I235 HydrophobicContact CE-CB 3.63Å; M232-I235 HydrophobicContact CE-CG1 3.79Å; M232-I235 HydrophobicContact CE-CG2 3.85Å; M232-I235 WeakPolarHBondContact O-CB 3.47Å; M232-I235 PolarHBondContact O-N 2.95Å; M232-I236 PolarHBondContact N-O 2.98Å; M232-I236 PolarHBondContact O-N 3.46Å
233	P	96.2	Very high	96.3	Very high	7 Å²	7	31.2 Å²	31.2	5%	0.045	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	144.8	-175.5	-19.2	33.6	0	0	0	112.2	A157 P220 I222 T255	A157-P233 HydrophobicContact CB-CB 4.37Å; P220-P233 WeakPolarHBondContact CD-O 3.4Å; P220-P233 VanDerWaalsContact CG-O 3.26Å; P220-P233 WeakPolarHBondContact CG-O 3.37Å; P220-P233 WeakPolarHBondContact O-CD 3.39Å; I222-P233 HydrophobicContact CD1-CG 4.34Å; P233-T255 HydrophobicContact CB-CG2 4.1Å; P233-T255 WeakPolarHBondContact CB-OG1 3.46Å; P233-T255 HydrophobicContact CG-CG2 3.87Å
234	P	95.5	Very high	96.2	Very high	3 Å²	3	32.2 Å²	32.2	2%	0.019	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	cis	-91	17.3	1.7	37.9	-37.4	0	0	0	114.3	R153 A157 L212 I213	R153-P234 HydrophobicContact CB-CB 3.96Å; R153-P234 WeakPolarHBondContact CD-O 3.37Å; R153-P234 PolarHBondContact NH1-O 2.98Å; R153-P234 VanDerWaalsContact NH1-O 3.14Å; A157-P234 VanDerWaalsContact CB-CA 3.47Å; A157-P234 HydrophobicContact CB-CB 3.45Å; A157-P234 VanDerWaalsContact CB-CB 3.45Å; L212-P234 HydrophobicContact CB-CG 3.86Å; L212-P234 HydrophobicContact CD1-CB 4.18Å; L212-P234 HydrophobicContact CD1-CG 3.59Å; L212-P234 HydrophobicContact CG-CG 4.39Å; I213-P234 HydrophobicContact CG2-CG 4.45Å
235	I	95.5	Very high	96.1	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-64.1	-164.5	-54	-53.6	0	0	0	111.7	R153 M197 F200 L206 Y209 L210 I213 M232	R153-I235 PolarHBondContact NH1-O 2.89Å; M197-I235 HydrophobicContact CE-CG1 4.13Å; F200-I235 HydrophobicContact CD2-CG2 4.11Å; F200-I235 HydrophobicContact CE2-CG2 4.41Å; L206-I235 WeakPolarHBondContact CD2-O 3.45Å; Y209-I235 VanDerWaalsContact O-CD1 3.24Å; Y209-I235 WeakPolarHBondContact O-CD1 3.4Å; L210-I235 HydrophobicContact CD2-CD1 4.26Å; L210-I235 HydrophobicContact CD2-CG2 3.98Å; I213-I235 HydrophobicContact CD1-CD1 4.38Å; I213-I235 HydrophobicContact CD1-CG1 3.74Å; I213-I235 HydrophobicContact CG1-CD1 4.16Å; I213-I235 HydrophobicContact CG1-CG1 4.04Å; M232-I235 HydrophobicContact CE-CB 3.63Å; M232-I235 HydrophobicContact CE-CG1 3.79Å; M232-I235 HydrophobicContact CE-CG2 3.85Å; M232-I235 WeakPolarHBondContact O-CB 3.47Å; M232-I235 PolarHBondContact O-N 2.95Å
236	I	95.3	Very high	96.1	Very high	16 Å²	16	40.2 Å²	40.2	8%	0.082	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	153.1	-170.8	-157.2	165.9	0	0	0	112.8	F182 A184 L185 F200 L206 M232	F182-I236 HydrophobicContact CE2-CG2 4.44Å; F182-I236 HydrophobicContact CZ-CG2 4Å; A184-I236 HydrophobicContact CB-CD1 4.17Å; A184-I236 HydrophobicContact CB-CG2 4Å; L185-I236 HydrophobicContact CB-CD1 4.01Å; L185-I236 HydrophobicContact CB-CG1 3.9Å; F200-I236 HydrophobicContact CE1-CD1 4.06Å; F200-I236 HydrophobicContact CE2-CB 4.47Å; F200-I236 HydrophobicContact CE2-CD1 4.07Å; F200-I236 HydrophobicContact CE2-CG2 4.01Å; F200-I236 HydrophobicContact CZ-CD1 3.46Å; F200-I236 VanDerWaalsContact CZ-CD1 3.46Å; F200-I236 HydrophobicContact CZ-CG2 4.37Å; L206-I236 HydrophobicContact CD1-CD1 3.75Å; L206-I236 HydrophobicContact CD1-CG1 4.48Å; M232-I236 PolarHBondContact N-O 2.98Å; M232-I236 PolarHBondContact O-N 3.46Å
237	N	96.1	Very high	96.2	Very high	28 Å²	28	37 Å²	37	15%	0.15	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	164.9	170.9	-61.7	0.7	0	0	0	110.6	A160 L185	A160-N237 PolarHBondContact N-ND2 3.11Å; L185-N237 WeakPolarHBondContact CB-O 3.38Å; L185-N237 PolarHBondContact N-O 2.89Å
238	G	95.4	Very high	96.3	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.01	17%	0.172	C	C	.	.	B	Isolated β-bridge	trans	-81.6	149.4	172.7	0	0	0	0	0	112.1	K183 L230 H240	K183-G238 WeakPolarHBondContact O-CA 3.46Å; L230-G238 WeakPolarHBondContact O-CA 3.36Å; L230-G238 PolarHBondContact O-N 2.89Å; G238-H240 VanDerWaalsContact C-N 3.3Å
239	E	96.5	Very high	96.4	Very high	45 Å²	45	35.3 Å²	35.3	21%	0.21	17%	0.165	C	C	.	.	S	Bend	trans	-69.1	-30.3	175.8	-174.8	63.6	-165.2	0	0	111.9	K183 L185 N186 S241 R242	K183-E239 HydrophobicContact CB-CB 4.39Å; K183-E239 HydrophobicContact CD-CB 4.04Å; K183-E239 HydrophobicContact CD-CG 4.22Å; K183-E239 HydrophobicContact CG-CB 3.82Å; K183-E239 HydrophobicContact CG-CG 4.43Å; K183-E239 PolarHBondContact O-N 3.18Å; L185-E239 WeakPolarHBondContact CA-OE2 3.45Å; N186-E239 PolarHBondContact N-OE2 3.35Å; E239-S241 VanDerWaalsContact C-N 3.29Å; E239-S241 PolarHBondContact O-N 3.49Å; E239-R242 VanDerWaalsContact O-CB 3.25Å; E239-R242 WeakPolarHBondContact O-CB 3.37Å; E239-R242 PolarHBondContact O-N 3.27Å; E239-R242 WeakPolarHBondContact OE1-CD 3.31Å; E239-R242 IonicContact OE1-NH1 2.71Å; E239-R242 PolarHBondContact OE1-NH1 2.94Å
240	H	95.4	Very high	96.5	Very high	101 Å²	101	34.7 Å²	34.7	47%	0.468	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-34.8	-175.2	-177.3	82.3	0	0	0	113.6	T165 T228 G238	T165-H240 PolarHBondContact O-NE2 3.19Å; T165-H240 PolarHBondContact OG1-O 2.95Å; T228-H240 HydrophobicContact CG2-CB 4.2Å; T228-H240 VanDerWaalsContact CG2-CD2 3.48Å; T228-H240 WeakPolarHBondContact CG2-CD2 3.44Å; G238-H240 VanDerWaalsContact C-N 3.3Å
241	S	95.8	Very high	96.5	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	24.3	179.4	55.7	0	0	0	0	112.4	H161 D162 T165 E239 I243	H161-S241 CarbonylContact C-O 3.56Å; H161-S241 VanDerWaalsContact CA-O 3.23Å; H161-S241 WeakPolarHBondContact CA-O 3.46Å; H161-S241 PolarHBondContact ND1-OG 2.68Å; D162-S241 PolarHBondContact N-O 3.08Å; T165-S241 WeakPolarHBondContact OG1-CA 3.38Å; E239-S241 VanDerWaalsContact C-N 3.29Å; E239-S241 PolarHBondContact O-N 3.49Å; S241-I243 PolarHBondContact O-N 3.43Å
242	R	96.2	Very high	96.6	Very high	118 Å²	118	34.7 Å²	34.7	45%	0.445	16%	0.162	S	C	.	.			trans	-60.1	126.2	178.3	173.8	178.8	176	170.1	5.7	111.4	L185 N186 E239	L185-R242 HydrophobicContact CD1-CB 3.88Å; L185-R242 HydrophobicContact CD1-CG 3.77Å; N186-R242 PolarHBondContact OD1-NH1 3.45Å; N186-R242 VanDerWaalsContact OD1-NH1 3.09Å; E239-R242 VanDerWaalsContact O-CB 3.25Å; E239-R242 WeakPolarHBondContact O-CB 3.37Å; E239-R242 PolarHBondContact O-N 3.27Å; E239-R242 WeakPolarHBondContact OE1-CD 3.31Å; E239-R242 IonicContact OE1-NH1 2.71Å; E239-R242 PolarHBondContact OE1-NH1 2.94Å
243	I	96.5	Very high	96.6	Very high	20 Å²	20	34.8 Å²	34.8	10%	0.103	16%	0.162	C	C	.	.			trans	-69.5	143.9	172	60.8	170.9	0	0	0	111.8	L135 F138 A160 S241 T247 V250	L135-I243 HydrophobicContact CD1-CD1 3.7Å; L135-I243 HydrophobicContact CD1-CG1 3.98Å; F138-I243 HydrophobicContact CD1-CD1 3.93Å; F138-I243 HydrophobicContact CE1-CD1 4.06Å; A160-I243 HydrophobicContact CB-CD1 4.15Å; A160-I243 HydrophobicContact CB-CG2 4.45Å; S241-I243 PolarHBondContact O-N 3.43Å; I243-T247 HydrophobicContact CG2-CG2 4.46Å; I243-V250 HydrophobicContact CG2-CG1 4.15Å; I243-V250 HydrophobicContact CG2-CG2 4.44Å
244	S	96.4	Very high	96.7	Very high	39 Å²	39	34.4 Å²	34.4	27%	0.273	16%	0.16	S	C	.	.			trans	-146.6	176.5	178.1	72.3	0	0	0	0	111.2	K246 T247	S244-K246 PolarHBondContact O-N 3.44Å; S244-K246 VanDerWaalsContact O-N 3.14Å; S244-K246 PolarHBondContact OG-N 2.84Å; S244-T247 PolarHBondContact N-OG1 3.1Å; S244-T247 VanDerWaalsContact O-CB 3.27Å; S244-T247 WeakPolarHBondContact O-CB 3.29Å; S244-T247 PolarHBondContact O-N 2.89Å; S244-T247 PolarHBondContact O-OG1 2.83Å
245	T	95.9	Very high	96.8	Very high	54 Å²	54	34.3 Å²	34.3	33%	0.331	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-17	172.8	55.1	0	0	0	0	113.4	L130 E132 L135 R248	L130-T245 WeakPolarHBondContact O-CA 3.2Å; L130-T245 WeakPolarHBondContact O-CB 3.44Å; E132-T245 HydrophobicContact CG-CG2 4.05Å; L135-T245 HydrophobicContact CD2-CG2 4.24Å; T245-R248 PolarHBondContact O-NH1 3.44Å; T245-R248 VanDerWaalsContact O-NH1 3.07Å
246	K	96.2	Very high	96.9	Very high	175 Å²	175	34.3 Å²	34.3	76%	0.761	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-18.4	175.5	-62.2	-178.9	-177.1	176.2	0	113.1	S244 R248	S244-K246 PolarHBondContact O-N 3.44Å; S244-K246 VanDerWaalsContact O-N 3.14Å; S244-K246 PolarHBondContact OG-N 2.84Å; K246-R248 PolarHBondContact O-NH1 3.05Å
247	T	97.3	Very high	96.9	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.173	C	C	.	.			trans	-61.4	137.6	179.6	-58.7	0	0	0	0	109.7	D162 I243 S244 N249 V250	D162-T247 HydrophobicContact CB-CG2 3.91Å; D162-T247 VanDerWaalsContact CG-CG2 3.46Å; D162-T247 WeakPolarHBondContact OD2-CB 3.37Å; D162-T247 WeakPolarHBondContact OD2-CG2 3.39Å; D162-T247 PolarHBondContact OD2-OG1 2.79Å; I243-T247 HydrophobicContact CG2-CG2 4.46Å; S244-T247 PolarHBondContact N-OG1 3.1Å; S244-T247 VanDerWaalsContact O-CB 3.27Å; S244-T247 WeakPolarHBondContact O-CB 3.29Å; S244-T247 PolarHBondContact O-N 2.89Å; S244-T247 PolarHBondContact O-OG1 2.83Å; T247-N249 WeakPolarHBondContact CG2-O 3.43Å; T247-V250 HydrophobicContact CG2-CG2 3.67Å
248	R	97.4	Very high	96.9	Very high	102 Å²	102	37.4 Å²	37.4	39%	0.385	18%	0.178	S	C	.	.			trans	-119.5	-26.6	178.4	-69	-65.5	175.8	-89.3	1.5	112.6	N127 I128 T245 K246	N127-R248 CarbonylContact C-O 3.56Å; N127-R248 WeakPolarHBondContact CA-O 3.26Å; N127-R248 PolarHBondContact N-O 2.94Å; I128-R248 WeakPolarHBondContact CG2-O 3.07Å; I128-R248 PolarHBondContact N-O 3.33Å; I128-R248 WeakPolarHBondContact O-CD 3.39Å; T245-R248 PolarHBondContact O-NH1 3.44Å; T245-R248 VanDerWaalsContact O-NH1 3.07Å; K246-R248 PolarHBondContact O-NH1 3.05Å
249	N	98.3	Very high	97	Very high	15 Å²	15	39.9 Å²	39.9	8%	0.08	19%	0.191	C	C	.	.			trans	-123.5	123.3	176.7	-57.3	-60.2	0	0	0	108.4	L125 R126 N127 L163 D164 T247	L125-N249 WeakPolarHBondContact O-CA 3.35Å; R126-N249 WeakPolarHBondContact CA-OD1 3.42Å; R126-N249 WeakPolarHBondContact CD-OD1 3.41Å; N127-N249 PolarHBondContact N-OD1 3.22Å; N127-N249 VanDerWaalsContact N-OD1 3.08Å; L163-N249 HydrophobicContact CB-CB 3.89Å; L163-N249 WeakPolarHBondContact CB-O 3.28Å; L163-N249 HydrophobicContact CD2-CB 4.21Å; L163-N249 HydrophobicContact CG-CB 4.44Å; L163-N249 PolarHBondContact N-O 2.95Å; D164-N249 PolarHBondContact OD1-ND2 3.46Å; D164-N249 PolarHBondContact OD2-ND2 3.09Å; D164-N249 VanDerWaalsContact OD2-ND2 3.16Å; T247-N249 WeakPolarHBondContact CG2-O 3.43Å
250	V	98.4	Very high	96.9	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.024	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	119.7	-177.5	-176.1	0	0	0	0	108.6	V124 L125 I128 A160 H161 I243 T247 I252	V124-V250 WeakPolarHBondContact CA-O 3.19Å; L125-V250 HydrophobicContact CB-CB 4.42Å; L125-V250 PolarHBondContact N-O 3.29Å; L125-V250 PolarHBondContact O-N 2.82Å; I128-V250 HydrophobicContact CG2-CG2 3.79Å; A160-V250 HydrophobicContact CB-CG1 4.41Å; H161-V250 CarbonylContact O-C 3.4Å; H161-V250 VanDerWaalsContact O-CA 3.31Å; H161-V250 WeakPolarHBondContact O-CA 3.37Å; I243-V250 HydrophobicContact CG2-CG1 4.15Å; I243-V250 HydrophobicContact CG2-CG2 4.44Å; T247-V250 HydrophobicContact CG2-CG2 3.67Å; V250-I252 HydrophobicContact CG1-CD1 4.38Å; V250-I252 HydrophobicContact CG1-CG1 3.74Å
251	F	98.6	Very high	97	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	122.5	166.5	174.6	-98.3	0	0	0	108.2	A122 V124 H161 L163 F170 L230 E253 V286	A122-F251 HydrophobicContact CB-CE2 3.67Å; A122-F251 HydrophobicContact CB-CZ 3.61Å; V124-F251 HydrophobicContact CG2-CB 4.42Å; V124-F251 HydrophobicContact CG2-CD2 3.83Å; H161-F251 HydrophobicContact CB-CB 4.35Å; H161-F251 HydrophobicContact CB-CD1 4.31Å; H161-F251 AromaticContact CD2-CD1 3.94Å; H161-F251 PolarHBondContact N-O 3.09Å; H161-F251 PolarHBondContact O-N 2.92Å; L163-F251 HydrophobicContact CB-CB 4.19Å; L163-F251 HydrophobicContact CD1-CB 4.2Å; F170-F251 HydrophobicContact CD2-CD2 4.28Å; F170-F251 HydrophobicContact CD2-CE1 4.18Å; F170-F251 AromaticContact CD2-CE2 3.7Å; F170-F251 HydrophobicContact CD2-CE2 3.7Å; F170-F251 AromaticContact CD2-CZ 3.64Å; F170-F251 HydrophobicContact CD2-CZ 3.64Å; F170-F251 HydrophobicContact CE2-CD1 4.33Å; F170-F251 AromaticContact CE2-CD2 3.77Å; F170-F251 HydrophobicContact CE2-CD2 3.77Å; F170-F251 HydrophobicContact CE2-CE1 4.26Å; F170-F251 AromaticContact CE2-CE2 3.67Å; F170-F251 HydrophobicContact CE2-CE2 3.67Å; F170-F251 HydrophobicContact CE2-CG 4.1Å; F170-F251 AromaticContact CE2-CZ 3.94Å; F170-F251 HydrophobicContact CE2-CZ 3.94Å; F170-F251 HydrophobicContact CG-CZ 4.44Å; L230-F251 HydrophobicContact CD2-CD1 4.13Å; L230-F251 HydrophobicContact CD2-CE1 4.06Å; F251-E253 HydrophobicContact CE1-CB 4.03Å; F251-E253 HydrophobicContact CZ-CB 4.37Å; F251-V286 HydrophobicContact CD2-CG2 4.29Å; F251-V286 HydrophobicContact CE2-CG1 4.27Å; F251-V286 HydrophobicContact CE2-CG2 3.95Å
252	I	98.5	Very high	97.1	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	127.5	-179.7	-53.9	175.1	0	0	0	107.4	A122 G123 L125 F138 I158 G159 V250 L266 L269 I270	A122-I252 CarbonylContact C-O 3.53Å; A122-I252 WeakPolarHBondContact CA-O 3.31Å; A122-I252 WeakPolarHBondContact CB-O 3.48Å; G123-I252 PolarHBondContact N-O 3.34Å; G123-I252 PolarHBondContact O-N 3.25Å; L125-I252 HydrophobicContact CD1-CD1 3.94Å; L125-I252 HydrophobicContact CG-CD1 4.26Å; F138-I252 HydrophobicContact CE2-CD1 3.85Å; F138-I252 HydrophobicContact CZ-CD1 3.86Å; F138-I252 HydrophobicContact CZ-CG1 4.25Å; I158-I252 HydrophobicContact CG2-CG2 4.17Å; G159-I252 WeakPolarHBondContact O-CA 3.48Å; V250-I252 HydrophobicContact CG1-CD1 4.38Å; V250-I252 HydrophobicContact CG1-CG1 3.74Å; I252-L266 HydrophobicContact CB-CD1 4.13Å; I252-L266 HydrophobicContact CG2-CD1 3.89Å; I252-L269 HydrophobicContact CD1-CB 4.46Å; I252-L269 HydrophobicContact CG2-CD1 4.12Å; I252-I270 HydrophobicContact CD1-CG1 4.33Å
253	E	98.1	Very high	97.1	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	150.4	170.7	85.6	-82	-166.6	0	0	112.4	V120 V121 A122 I158 G159 H161 I222 S231 F251	V120-E253 HydrophobicContact CG2-CB 4.37Å; V121-E253 CarbonylContact O-C 3.58Å; V121-E253 WeakPolarHBondContact O-CA 3.48Å; A122-E253 HydrophobicContact CB-CB 4.16Å; I158-E253 CarbonylContact C-O 3.49Å; I158-E253 WeakPolarHBondContact CA-O 3.4Å; G159-E253 VanDerWaalsContact CA-CD 3.41Å; G159-E253 WeakPolarHBondContact CA-OE1 3.35Å; G159-E253 WeakPolarHBondContact CA-OE2 3.4Å; G159-E253 PolarHBondContact N-O 2.74Å; G159-E253 PolarHBondContact O-N 2.92Å; H161-E253 IonicContact CD2-OE1 3.61Å; H161-E253 IonicContact CD2-OE2 3.13Å; H161-E253 PolarHBondContact CD2-OE2 3.43Å; H161-E253 VanDerWaalsContact NE2-CD 3.33Å; H161-E253 IonicContact NE2-OE1 3.64Å; H161-E253 PolarHBondContact NE2-OE1 2.85Å; H161-E253 IonicContact NE2-OE2 2.8Å; H161-E253 PolarHBondContact NE2-OE2 3.05Å; H161-E253 VanDerWaalsContact NE2-OE2 3.1Å; I222-E253 HydrophobicContact CD1-CB 4.42Å; I222-E253 HydrophobicContact CD1-CG 3.55Å; S231-E253 PolarHBondContact OG-OE1 2.93Å; F251-E253 HydrophobicContact CE1-CB 4.03Å; F251-E253 HydrophobicContact CZ-CB 4.37Å
254	A	98.3	Very high	97.2	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	114.9	170.5	0	0	0	0	0	109.7	V120 V121 V156 A157 A262 V265	V120-A254 WeakPolarHBondContact CA-O 3.27Å; V121-A254 HydrophobicContact CG2-CB 3.82Å; V121-A254 PolarHBondContact N-O 3.46Å; V121-A254 PolarHBondContact O-N 3.48Å; V156-A254 HydrophobicContact CG1-CB 3.94Å; A157-A254 CarbonylContact O-C 3.48Å; A157-A254 WeakPolarHBondContact O-CA 3.29Å; A254-A262 HydrophobicContact CB-CB 4.32Å; A254-V265 HydrophobicContact CB-CG1 4.49Å
255	T	97.9	Very high	97.2	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.006	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	138.4	177	58.2	0	0	0	0	111.1	R117 F119 V120 V156 A157 Y172 I222 P233	R117-T255 PolarHBondContact NH2-O 3.39Å; F119-T255 CarbonylContact O-C 3.54Å; F119-T255 WeakPolarHBondContact O-CA 3.47Å; V120-T255 HydrophobicContact CB-CG2 4.06Å; V120-T255 HydrophobicContact CG2-CG2 3.69Å; V156-T255 CarbonylContact C-O 3.53Å; V156-T255 VanDerWaalsContact CA-O 3.25Å; V156-T255 WeakPolarHBondContact CA-O 3.25Å; A157-T255 PolarHBondContact N-O 2.75Å; A157-T255 PolarHBondContact O-N 2.81Å; A157-T255 PolarHBondContact O-OG1 3.27Å; Y172-T255 HydrophobicContact CD2-CG2 4.47Å; Y172-T255 HydrophobicContact CE1-CG2 4.41Å; Y172-T255 HydrophobicContact CE2-CG2 3.93Å; I222-T255 HydrophobicContact CD1-CG2 3.8Å; P233-T255 HydrophobicContact CB-CG2 4.1Å; P233-T255 WeakPolarHBondContact CB-OG1 3.46Å; P233-T255 HydrophobicContact CG-CG2 3.87Å
256	G	96.1	Very high	97.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	169.3	-173.3	0	0	0	0	0	116.7	R117 F119 L155	R117-G256 CarbonylContact C-O 3.57Å; F119-G256 PolarHBondContact N-O 3.43Å; F119-G256 VanDerWaalsContact N-O 3.15Å; F119-G256 PolarHBondContact O-N 2.98Å; L155-G256 CarbonylContact O-C 3.09Å; L155-G256 WeakPolarHBondContact O-CA 3.34Å
257	T	96.1	Very high	97.4	Very high	63 Å²	63	24.4 Å²	24.4	39%	0.387	12%	0.118	S	C	.	.	S	Bend	trans	-93.6	-11.2	165.5	61.7	0	0	0	0	111.8	R117 F119 L155	R117-T257 HydrophobicContact CG-CG2 4.15Å; F119-T257 WeakPolarHBondContact CE2-O 3.36Å; L155-T257 PolarHBondContact O-N 3.01Å
258	D	96.8	Very high	97.4	Very high	46 Å²	46	24.5 Å²	24.5	25%	0.246	12%	0.118	C	C	.	.			trans	-126.2	109.9	178.8	-176.6	-37.9	0	0	0	108.8	H260 K261 A262	D258-H260 PolarHBondContact OD1-N 2.88Å; D258-K261 HydrophobicContact CB-CB 4.16Å; D258-K261 HydrophobicContact CB-CD 4.21Å; D258-K261 HydrophobicContact CB-CG 4.28Å; D258-K261 PolarHBondContact OD1-N 3.37Å; D258-K261 WeakPolarHBondContact OD2-CD 3.26Å; D258-K261 WeakPolarHBondContact OD2-CE 3.41Å; D258-A262 PolarHBondContact O-N 2.77Å; D258-A262 VanDerWaalsContact O-N 3.11Å
259	L	96.1	Very high	97.4	Very high	53 Å²	53	19.6 Å²	19.6	28%	0.277	10%	0.1	S	C	.	.	H	α-helix	trans	-64.9	-42.8	-177.6	177.6	61	0	0	0	111.9	F119 V121 K261 A262 I263	F119-L259 HydrophobicContact CB-CB 4.36Å; F119-L259 HydrophobicContact CB-CD1 4.2Å; F119-L259 HydrophobicContact CD1-CB 4.09Å; F119-L259 HydrophobicContact CD1-CD1 4.4Å; F119-L259 HydrophobicContact CD2-CB 3.97Å; F119-L259 HydrophobicContact CE1-CB 4.4Å; F119-L259 HydrophobicContact CE2-CB 4.3Å; F119-L259 HydrophobicContact CG-CB 3.87Å; F119-L259 HydrophobicContact CG-CD1 4.38Å; V121-L259 HydrophobicContact CG1-CD1 3.76Å; L259-K261 VanDerWaalsContact C-N 3.34Å; L259-K261 PolarHBondContact O-N 2.48Å; L259-A262 WeakPolarHBondContact O-CB 3.5Å; L259-A262 PolarHBondContact O-N 3.48Å; L259-A262 VanDerWaalsContact O-N 3.14Å; L259-I263 HydrophobicContact CD1-CD1 4.19Å; L259-I263 HydrophobicContact CD1-CG1 4.34Å; L259-I263 HydrophobicContact CG-CD1 4.01Å; L259-I263 WeakPolarHBondContact O-CG1 3.41Å; L259-I263 PolarHBondContact O-N 3.33Å
260	H	95.5	Very high	97.4	Very high	121 Å²	121	18.9 Å²	18.9	56%	0.56	10%	0.096	S	C	*	.	H	α-helix	trans	-62.2	-45.1	-178	-179.3	-83.9	0	0	0	110.4	D258 A262 I263 V264	D258-H260 PolarHBondContact OD1-N 2.88Å; H260-A262 VanDerWaalsContact C-N 3.31Å; H260-A262 PolarHBondContact O-N 2.92Å; H260-I263 PolarHBondContact O-N 3.22Å; H260-V264 VanDerWaalsContact O-CG2 3.3Å; H260-V264 WeakPolarHBondContact O-CG2 3.44Å; H260-V264 PolarHBondContact O-N 2.81Å
261	K	96.5	Very high	97.4	Very high	59 Å²	59	18.7 Å²	18.7	26%	0.257	10%	0.095	S	C	.	.	H	α-helix	trans	-65	-35.4	175.8	-67	-177.1	-167.5	-52	0	112.5	L149 L155 V156 D258 L259 I263 V264 V265	L149-K261 HydrophobicContact CD1-CD 4.22Å; L149-K261 HydrophobicContact CD1-CG 4.13Å; L155-K261 HydrophobicContact CB-CD 4.31Å; L155-K261 HydrophobicContact CD1-CD 3.55Å; V156-K261 HydrophobicContact CG2-CB 3.67Å; D258-K261 HydrophobicContact CB-CB 4.16Å; D258-K261 HydrophobicContact CB-CD 4.21Å; D258-K261 HydrophobicContact CB-CG 4.28Å; D258-K261 PolarHBondContact OD1-N 3.37Å; D258-K261 WeakPolarHBondContact OD2-CD 3.26Å; D258-K261 WeakPolarHBondContact OD2-CE 3.41Å; L259-K261 VanDerWaalsContact C-N 3.34Å; L259-K261 PolarHBondContact O-N 2.48Å; K261-I263 VanDerWaalsContact C-N 3.32Å; K261-V264 PolarHBondContact O-N 3.46Å; K261-V265 WeakPolarHBondContact O-CB 3.37Å; K261-V265 WeakPolarHBondContact O-CG2 3.3Å; K261-V265 PolarHBondContact O-N 3.1Å
262	A	97.6	Very high	97.3	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-63.3	-41.5	176.7	0	0	0	0	0	111.3	V121 V156 A254 D258 L259 H260 L266	V121-A262 HydrophobicContact CG2-CB 3.92Å; V121-A262 WeakPolarHBondContact CG2-O 3.22Å; V156-A262 HydrophobicContact CG1-CB 4.32Å; V156-A262 HydrophobicContact CG2-CB 4.12Å; A254-A262 HydrophobicContact CB-CB 4.32Å; D258-A262 PolarHBondContact O-N 2.77Å; D258-A262 VanDerWaalsContact O-N 3.11Å; L259-A262 WeakPolarHBondContact O-CB 3.5Å; L259-A262 PolarHBondContact O-N 3.48Å; L259-A262 VanDerWaalsContact O-N 3.14Å; H260-A262 VanDerWaalsContact C-N 3.31Å; H260-A262 PolarHBondContact O-N 2.92Å; A262-L266 WeakPolarHBondContact O-CB 3.5Å; A262-L266 PolarHBondContact O-N 3.14Å
263	I	97.6	Very high	97.3	Very high	38 Å²	38	18.7 Å²	18.7	20%	0.195	10%	0.095	C	C	.	.	H	α-helix	trans	-61.3	-53.8	173.9	-66.1	167	0	0	0	110.5	V121 L259 H260 K261 V265 L266 D267 Y298	V121-I263 HydrophobicContact CG1-CG1 4.03Å; L259-I263 HydrophobicContact CD1-CD1 4.19Å; L259-I263 HydrophobicContact CD1-CG1 4.34Å; L259-I263 HydrophobicContact CG-CD1 4.01Å; L259-I263 WeakPolarHBondContact O-CG1 3.41Å; L259-I263 PolarHBondContact O-N 3.33Å; H260-I263 PolarHBondContact O-N 3.22Å; K261-I263 VanDerWaalsContact C-N 3.32Å; I263-V265 VanDerWaalsContact C-N 3.26Å; I263-V265 PolarHBondContact O-N 3.03Å; I263-L266 PolarHBondContact O-N 3.22Å; I263-L266 VanDerWaalsContact O-N 3.08Å; I263-D267 WeakPolarHBondContact CG2-OD2 3.37Å; I263-D267 WeakPolarHBondContact O-CB 3.5Å; I263-D267 PolarHBondContact O-N 3.35Å; I263-Y298 HydrophobicContact CD1-CE1 3.83Å; I263-Y298 HydrophobicContact CG1-CD1 4.25Å; I263-Y298 HydrophobicContact CG1-CE1 3.7Å
264	V	96.8	Very high	97.3	Very high	5 Å²	5	18.7 Å²	18.7	3%	0.03	10%	0.095	C	C	.	.	H	α-helix	trans	-54.8	-43.2	-179.7	172.2	0	0	0	0	111.8	Y72 L149 H260 K261 T268 H372	Y72-V264 HydrophobicContact CD2-CG1 4.1Å; Y72-V264 HydrophobicContact CE2-CG1 4.33Å; L149-V264 HydrophobicContact CD2-CB 4.2Å; L149-V264 HydrophobicContact CD2-CG1 3.54Å; H260-V264 VanDerWaalsContact O-CG2 3.3Å; H260-V264 WeakPolarHBondContact O-CG2 3.44Å; H260-V264 PolarHBondContact O-N 2.81Å; K261-V264 PolarHBondContact O-N 3.46Å; V264-T268 VanDerWaalsContact O-CB 3.3Å; V264-T268 WeakPolarHBondContact O-CB 3.46Å; V264-T268 PolarHBondContact O-N 2.69Å; V264-T268 PolarHBondContact O-OG1 3.44Å; V264-H372 HydrophobicContact CG1-CB 4.22Å; V264-H372 HydrophobicContact CG2-CB 4.16Å
265	V	97.2	Very high	97.2	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-66.1	-43.8	179.3	166.2	0	0	0	0	111.9	L145 L149 V156 I158 A254 K261 I263 L269	L145-V265 HydrophobicContact CD1-CG1 4.31Å; L149-V265 HydrophobicContact CD2-CG2 3.54Å; L149-V265 HydrophobicContact CG-CG2 4.06Å; V156-V265 HydrophobicContact CG1-CB 4.29Å; V156-V265 HydrophobicContact CG1-CG1 4.24Å; V156-V265 HydrophobicContact CG1-CG2 4.25Å; I158-V265 HydrophobicContact CD1-CG1 3.19Å; I158-V265 HydrophobicContact CG1-CG1 3.35Å; A254-V265 HydrophobicContact CB-CG1 4.49Å; K261-V265 WeakPolarHBondContact O-CB 3.37Å; K261-V265 WeakPolarHBondContact O-CG2 3.3Å; K261-V265 PolarHBondContact O-N 3.1Å; I263-V265 VanDerWaalsContact C-N 3.26Å; I263-V265 PolarHBondContact O-N 3.03Å; V265-L269 PolarHBondContact O-N 3.11Å; V265-L269 VanDerWaalsContact O-N 3.11Å
266	L	98.3	Very high	97.2	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.8	-49.2	177.4	-179.8	68.4	0	0	0	110.9	V121 I252 A262 I263 T268 L269 I270 P299	V121-L266 HydrophobicContact CB-CD2 3.96Å; V121-L266 HydrophobicContact CG2-CB 3.92Å; V121-L266 HydrophobicContact CG2-CD2 3.76Å; V121-L266 HydrophobicContact CG2-CG 4.41Å; I252-L266 HydrophobicContact CB-CD1 4.13Å; I252-L266 HydrophobicContact CG2-CD1 3.89Å; A262-L266 WeakPolarHBondContact O-CB 3.5Å; A262-L266 PolarHBondContact O-N 3.14Å; I263-L266 PolarHBondContact O-N 3.22Å; I263-L266 VanDerWaalsContact O-N 3.08Å; L266-T268 VanDerWaalsContact C-N 3.32Å; L266-T268 PolarHBondContact O-N 2.99Å; L266-L269 PolarHBondContact O-N 3.14Å; L266-I270 HydrophobicContact CD1-CD1 3.73Å; L266-I270 HydrophobicContact CD1-CG1 4.28Å; L266-I270 HydrophobicContact CD2-CD1 4.43Å; L266-I270 HydrophobicContact CG-CD1 3.81Å; L266-I270 WeakPolarHBondContact O-CB 3.32Å; L266-I270 WeakPolarHBondContact O-CG1 3.29Å; L266-I270 PolarHBondContact O-N 3.43Å; L266-P299 HydrophobicContact CD2-CB 4.22Å
267	D	97.8	Very high	97.3	Very high	5 Å²	5	22.8 Å²	22.8	3%	0.027	11%	0.114	C	C	.	.	H	α-helix	trans	-60.3	-42.8	179.2	-71	-13.7	0	0	0	110.6	I263 I270 T271 P299 L301 H372	I263-D267 WeakPolarHBondContact CG2-OD2 3.37Å; I263-D267 WeakPolarHBondContact O-CB 3.5Å; I263-D267 PolarHBondContact O-N 3.35Å; D267-I270 PolarHBondContact O-N 2.86Å; D267-T271 VanDerWaalsContact O-CB 3.28Å; D267-T271 WeakPolarHBondContact O-CB 3.37Å; D267-T271 WeakPolarHBondContact O-CG2 3.2Å; D267-T271 PolarHBondContact O-N 3.31Å; D267-T271 PolarHBondContact O-OG1 3.33Å; D267-P299 WeakPolarHBondContact OD1-CB 3.36Å; D267-L301 HydrophobicContact CB-CD2 4.37Å; D267-H372 IonicContact OD2-CE1 2.77Å; D267-H372 PolarHBondContact OD2-CE1 3.44Å; D267-H372 IonicContact OD2-NE2 2.73Å
268	T	97.4	Very high	97.2	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.006	12%	0.124	C	C	.	.	H	α-helix	trans	-58.6	-51.7	175.8	-58	0	0	0	0	111	L141 L145 V264 L266 I270 T271 M272	L141-T268 HydrophobicContact CD2-CG2 4.45Å; L145-T268 HydrophobicContact CD1-CG2 4.24Å; V264-T268 VanDerWaalsContact O-CB 3.3Å; V264-T268 WeakPolarHBondContact O-CB 3.46Å; V264-T268 PolarHBondContact O-N 2.69Å; V264-T268 PolarHBondContact O-OG1 3.44Å; L266-T268 VanDerWaalsContact C-N 3.32Å; L266-T268 PolarHBondContact O-N 2.99Å; T268-I270 PolarHBondContact O-N 3.15Å; T268-T271 PolarHBondContact O-N 3.36Å; T268-T271 PolarHBondContact O-OG1 3.22Å; T268-T271 VanDerWaalsContact O-OG1 3.09Å; T268-M272 HydrophobicContact CG2-CG 4.47Å; T268-M272 WeakPolarHBondContact O-CB 3.25Å; T268-M272 WeakPolarHBondContact O-CG 3.49Å; T268-M272 PolarHBondContact O-N 2.83Å
269	L	97.9	Very high	97.2	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.7	-43.7	179.9	-78.2	170.7	0	0	0	112.5	F138 L141 L145 I158 I252 V265 L266 M272 F273	F138-L269 HydrophobicContact CE2-CD2 4.22Å; F138-L269 HydrophobicContact CZ-CD2 4.27Å; L141-L269 HydrophobicContact CD2-CD2 4Å; L141-L269 HydrophobicContact CG-CD2 4.16Å; L145-L269 HydrophobicContact CD1-CD2 4.45Å; L145-L269 HydrophobicContact CD1-CG 4.16Å; I158-L269 HydrophobicContact CD1-CD1 3.96Å; I158-L269 HydrophobicContact CG1-CD1 4.46Å; I158-L269 HydrophobicContact CG2-CD1 3.5Å; I252-L269 HydrophobicContact CD1-CB 4.46Å; I252-L269 HydrophobicContact CG2-CD1 4.12Å; V265-L269 PolarHBondContact O-N 3.11Å; V265-L269 VanDerWaalsContact O-N 3.11Å; L266-L269 PolarHBondContact O-N 3.14Å; L269-M272 PolarHBondContact O-N 3.23Å; L269-F273 WeakPolarHBondContact O-CD2 3.3Å; L269-F273 PolarHBondContact O-N 3.07Å; L269-F273 VanDerWaalsContact O-N 3.12Å
270	I	98.1	Very high	97.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.6	-46.6	-178.8	-74.6	179.8	0	0	0	111	L125 I252 L266 D267 T268 M272 F273 S274 A283 P299 L301	L125-I270 HydrophobicContact CD2-CB 4.5Å; L125-I270 HydrophobicContact CD2-CG1 4.36Å; L125-I270 HydrophobicContact CD2-CG2 4.1Å; I252-I270 HydrophobicContact CD1-CG1 4.33Å; L266-I270 HydrophobicContact CD1-CD1 3.73Å; L266-I270 HydrophobicContact CD1-CG1 4.28Å; L266-I270 HydrophobicContact CD2-CD1 4.43Å; L266-I270 HydrophobicContact CG-CD1 3.81Å; L266-I270 WeakPolarHBondContact O-CB 3.32Å; L266-I270 WeakPolarHBondContact O-CG1 3.29Å; L266-I270 PolarHBondContact O-N 3.43Å; D267-I270 PolarHBondContact O-N 2.86Å; T268-I270 PolarHBondContact O-N 3.15Å; I270-M272 VanDerWaalsContact C-N 3.31Å; I270-M272 PolarHBondContact O-N 3.27Å; I270-F273 PolarHBondContact O-N 2.75Å; I270-S274 WeakPolarHBondContact O-CA 3.3Å; I270-S274 WeakPolarHBondContact O-CB 3.36Å; I270-S274 PolarHBondContact O-N 2.81Å; I270-S274 PolarHBondContact O-OG 3.29Å; I270-A283 HydrophobicContact CG2-CB 3.45Å; I270-A283 VanDerWaalsContact CG2-CB 3.45Å; I270-P299 HydrophobicContact CD1-CB 3.9Å; I270-P299 HydrophobicContact CD1-CG 3.44Å; I270-P299 VanDerWaalsContact CD1-CG 3.44Å; I270-P299 HydrophobicContact CG2-CG 4.25Å; I270-L301 HydrophobicContact CG2-CD1 4.13Å; I270-L301 HydrophobicContact CG2-CD2 4.29Å
271	T	97.7	Very high	97.3	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-67.2	-31.7	-179.4	54.9	0	0	0	0	112.4	F96 D267 T268 L301 P369 T370	F96-T271 HydrophobicContact CD1-CG2 3.77Å; F96-T271 HydrophobicContact CD2-CG2 4.13Å; F96-T271 HydrophobicContact CE1-CG2 3.86Å; F96-T271 VanDerWaalsContact CE1-O 3.22Å; F96-T271 WeakPolarHBondContact CE1-O 3.15Å; F96-T271 HydrophobicContact CE2-CG2 4.23Å; F96-T271 HydrophobicContact CG-CG2 3.9Å; F96-T271 HydrophobicContact CZ-CG2 4.1Å; D267-T271 VanDerWaalsContact O-CB 3.28Å; D267-T271 WeakPolarHBondContact O-CB 3.37Å; D267-T271 WeakPolarHBondContact O-CG2 3.2Å; D267-T271 PolarHBondContact O-N 3.31Å; D267-T271 PolarHBondContact O-OG1 3.33Å; T268-T271 PolarHBondContact O-N 3.36Å; T268-T271 PolarHBondContact O-OG1 3.22Å; T268-T271 VanDerWaalsContact O-OG1 3.09Å; T271-L301 HydrophobicContact CG2-CD2 3.9Å; T271-P369 HydrophobicContact CG2-CB 4.41Å; T271-P369 HydrophobicContact CG2-CG 4.05Å; T271-T370 VanDerWaalsContact CB-CG2 3.49Å; T271-T370 HydrophobicContact CG2-CG2 3.88Å; T271-T370 WeakPolarHBondContact OG1-CG2 3.49Å
272	M	97.3	Very high	97.4	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-72.2	-41.4	175.9	-66	-48.5	108.4	0	0	112.7	D73 C76 E78 G79 R82 L141 T268 L269 I270 T370	D73-M272 HydrophobicContact CB-CE 3.66Å; D73-M272 HydrophobicContact CB-SD 4.3Å; C76-M272 WeakPolarHBondContact SG-CG 3.42Å; C76-M272 VanDerWaalsContact SG-SD 3.65Å; E78-M272 HydrophobicContact CB-CB 4.37Å; G79-M272 WeakPolarHBondContact CA-SD 3.21Å; R82-M272 PolarHBondContact NH2-SD 3.36Å; L141-M272 HydrophobicContact CD2-CB 4.07Å; L141-M272 HydrophobicContact CD2-CG 3.81Å; T268-M272 HydrophobicContact CG2-CG 4.47Å; T268-M272 WeakPolarHBondContact O-CB 3.25Å; T268-M272 WeakPolarHBondContact O-CG 3.49Å; T268-M272 PolarHBondContact O-N 2.83Å; L269-M272 PolarHBondContact O-N 3.23Å; I270-M272 VanDerWaalsContact C-N 3.31Å; I270-M272 PolarHBondContact O-N 3.27Å; M272-T370 HydrophobicContact CE-CG2 3.67Å
273	F	98.2	Very high	97.4	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-101.1	-11	-171.8	-72.3	-85.3	0	0	0	115	L125 I128 K134 F138 L141 L269 I270 E275 Y276	L125-F273 HydrophobicContact CD1-CB 3.75Å; I128-F273 HydrophobicContact CD1-CB 4.24Å; K134-F273 WeakPolarHBondContact O-CE1 3.18Å; F138-F273 HydrophobicContact CB-CD1 4.24Å; F138-F273 HydrophobicContact CB-CE1 3.67Å; F138-F273 HydrophobicContact CB-CE2 4.04Å; F138-F273 HydrophobicContact CB-CZ 3.59Å; F138-F273 HydrophobicContact CD2-CB 4.33Å; F138-F273 AromaticContact CD2-CD1 3.84Å; F138-F273 HydrophobicContact CD2-CD1 3.84Å; F138-F273 AromaticContact CD2-CD2 3.48Å; F138-F273 HydrophobicContact CD2-CD2 3.48Å; F138-F273 VanDerWaalsContact CD2-CD2 3.48Å; F138-F273 HydrophobicContact CD2-CE1 4.07Å; F138-F273 AromaticContact CD2-CE2 3.71Å; F138-F273 HydrophobicContact CD2-CE2 3.71Å; F138-F273 AromaticContact CD2-CG 3.59Å; F138-F273 HydrophobicContact CD2-CG 3.59Å; F138-F273 HydrophobicContact CD2-CZ 4.04Å; F138-F273 HydrophobicContact CE2-CD2 4.06Å; F138-F273 HydrophobicContact CE2-CG 4.24Å; F138-F273 HydrophobicContact CG-CD2 4.41Å; F138-F273 HydrophobicContact CG-CE1 4.38Å; F138-F273 HydrophobicContact CG-CE2 4.21Å; F138-F273 HydrophobicContact CG-CZ 4.24Å; F138-F273 VanDerWaalsContact N-CZ 3.25Å; L141-F273 HydrophobicContact CD2-CE2 3.98Å; L269-F273 WeakPolarHBondContact O-CD2 3.3Å; L269-F273 PolarHBondContact O-N 3.07Å; L269-F273 VanDerWaalsContact O-N 3.12Å; I270-F273 PolarHBondContact O-N 2.75Å; F273-E275 PolarHBondContact O-N 3.15Å; F273-Y276 AromaticContact CD1-CD2 3.89Å; F273-Y276 HydrophobicContact CD1-CD2 3.89Å; F273-Y276 AromaticContact CD1-CE2 3.88Å; F273-Y276 HydrophobicContact CD1-CE2 3.88Å; F273-Y276 HydrophobicContact CE1-CE2 4.14Å; F273-Y276 PolarHBondContact O-N 2.84Å; F273-Y276 VanDerWaalsContact O-N 3.11Å
274	S	98	Very high	97.4	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.007	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-63.5	-18.4	173.7	55	0	0	0	0	113.1	I270 Y276 C277 P280 F281	I270-S274 WeakPolarHBondContact O-CA 3.3Å; I270-S274 WeakPolarHBondContact O-CB 3.36Å; I270-S274 PolarHBondContact O-N 2.81Å; I270-S274 PolarHBondContact O-OG 3.29Å; S274-Y276 PolarHBondContact O-N 3.47Å; S274-C277 WeakPolarHBondContact O-CB 3.32Å; S274-C277 PolarHBondContact O-N 3.07Å; S274-C277 VanDerWaalsContact O-N 3.16Å; S274-P280 CarbonylContact O-C 3.55Å; S274-P280 WeakPolarHBondContact O-CA 3.4Å; S274-F281 PolarHBondContact O-N 2.99Å
275	E	96.8	Very high	97.4	Very high	46 Å²	46	19.7 Å²	19.7	22%	0.215	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-59.5	-24.6	172.1	76.4	173.7	89.2	0	0	112.8	K14 E78 R82 F273 F281	K14-E275 IonicContact NZ-OE1 2.68Å; K14-E275 IonicContact NZ-OE2 4Å; K14-E275 PolarHBondContact NZ-OE2 3.44Å; K14-E275 VanDerWaalsContact NZ-OE2 3.13Å; E78-E275 VanDerWaalsContact CB-OE1 3.26Å; E78-E275 WeakPolarHBondContact CB-OE1 3.07Å; E78-E275 WeakPolarHBondContact CG-OE1 2.79Å; R82-E275 IonicContact NH1-OE1 3.76Å; R82-E275 PolarHBondContact NH1-OE1 2.98Å; F273-E275 PolarHBondContact O-N 3.15Å; E275-F281 HydrophobicContact CB-CD1 4.24Å; E275-F281 HydrophobicContact CB-CE1 3.55Å; E275-F281 HydrophobicContact CB-CZ 3.9Å
276	Y	97.3	Very high	97.5	Very high	31 Å²	31	19.7 Å²	19.7	12%	0.122	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-97.5	1.5	-178.9	-54.1	-47.6	0	0	0	114	K14 E78 I128 V129 K134 F273 S274	K14-Y276 VanDerWaalsContact CE-OH 3.31Å; K14-Y276 WeakPolarHBondContact CE-OH 3.19Å; K14-Y276 PolarHBondContact NZ-OH 3.08Å; E78-Y276 HydrophobicContact CG-CE2 3.71Å; E78-Y276 VanDerWaalsContact CG-OH 3.26Å; E78-Y276 WeakPolarHBondContact CG-OH 3.21Å; E78-Y276 WeakPolarHBondContact OE1-CE2 3.24Å; E78-Y276 PolarHBondContact OE1-OH 2.86Å; I128-Y276 WeakPolarHBondContact CA-O 3.28Å; V129-Y276 PolarHBondContact N-O 2.79Å; K134-Y276 HydrophobicContact CB-CE2 4.17Å; K134-Y276 HydrophobicContact CD-CD1 3.97Å; K134-Y276 HydrophobicContact CD-CD2 3.94Å; K134-Y276 HydrophobicContact CD-CE1 3.87Å; K134-Y276 HydrophobicContact CD-CE2 3.82Å; K134-Y276 HydrophobicContact CD-CG 4Å; K134-Y276 HydrophobicContact CG-CD2 4.26Å; K134-Y276 HydrophobicContact CG-CE1 4.3Å; K134-Y276 HydrophobicContact CG-CE2 3.7Å; F273-Y276 AromaticContact CD1-CD2 3.89Å; F273-Y276 HydrophobicContact CD1-CD2 3.89Å; F273-Y276 AromaticContact CD1-CE2 3.88Å; F273-Y276 HydrophobicContact CD1-CE2 3.88Å; F273-Y276 HydrophobicContact CE1-CE2 4.14Å; F273-Y276 PolarHBondContact O-N 2.84Å; F273-Y276 VanDerWaalsContact O-N 3.11Å; S274-Y276 PolarHBondContact O-N 3.47Å
277	C	97.7	Very high	97.5	Very high	9 Å²	9	21 Å²	21	6%	0.061	12%	0.121	C	C	.	.	S	Bend	trans	-71.7	157.1	176.9	-70.7	0	0	0	0	111.2	R126 S274 E279	R126-C277 WeakPolarHBondContact O-CB 3.33Å; S274-C277 WeakPolarHBondContact O-CB 3.32Å; S274-C277 PolarHBondContact O-N 3.07Å; S274-C277 VanDerWaalsContact O-N 3.16Å; C277-E279 WeakPolarHBondContact CB-O 3.33Å; C277-E279 CarbonylContact O-C 3.43Å; C277-E279 PolarHBondContact O-N 3.36Å; C277-E279 VanDerWaalsContact O-N 3.12Å
278	G	95.1	Very high	97.5	Very high	58 Å²	58	20.8 Å²	20.8	60%	0.598	12%	0.12	S	C	*	.	S	Bend	trans	-58.3	-27.6	178.2	0	0	0	0	0	113	R126 N127	R126-G278 PolarHBondContact O-N 3.3Å; N127-G278 PolarHBondContact O-N 3.46Å; N127-G278 VanDerWaalsContact O-N 3.08Å
279	E	96.5	Very high	97.5	Very high	98 Å²	98	21.7 Å²	21.7	46%	0.458	12%	0.124	S	C	.	.	S	Bend	trans	-115.2	104.6	161.6	-171.3	176.8	177.9	0	0	108.1	K99 C277 T282	K99-E279 WeakPolarHBondContact CE-OE1 2.99Å; K99-E279 IonicContact NZ-OE1 3.87Å; K99-E279 PolarHBondContact NZ-OE1 3.42Å; K99-E279 IonicContact NZ-OE2 3.76Å; K99-E279 PolarHBondContact NZ-OE2 2.92Å; C277-E279 WeakPolarHBondContact CB-O 3.33Å; C277-E279 CarbonylContact O-C 3.43Å; C277-E279 PolarHBondContact O-N 3.36Å; C277-E279 VanDerWaalsContact O-N 3.12Å; E279-T282 WeakPolarHBondContact O-CB 3.13Å; E279-T282 PolarHBondContact O-N 2.95Å
280	P	97.5	Very high	97.4	Very high	69 Å²	69	22.9 Å²	22.9	45%	0.448	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	145.2	-175.3	-28.9	36.3	0	0	0	113.1	S274 T282	S274-P280 CarbonylContact O-C 3.55Å; S274-P280 WeakPolarHBondContact O-CA 3.4Å; P280-T282 PolarHBondContact O-N 3.33Å
281	F	97.2	Very high	96.9	Very high	53 Å²	53	27.1 Å²	27.1	23%	0.232	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	18.3	177.4	-46.5	-69.7	0	0	0	114.9	P94 F96 V97 S274 E275	P94-F281 HydrophobicContact CB-CB 4.39Å; P94-F281 HydrophobicContact CB-CD1 3.54Å; P94-F281 HydrophobicContact CB-CD2 3.71Å; P94-F281 HydrophobicContact CB-CE1 3.58Å; P94-F281 HydrophobicContact CB-CE2 3.77Å; P94-F281 HydrophobicContact CB-CG 3.59Å; P94-F281 HydrophobicContact CB-CZ 3.7Å; P94-F281 HydrophobicContact CG-CD1 3.99Å; P94-F281 HydrophobicContact CG-CE1 3.83Å; P94-F281 HydrophobicContact CG-CZ 4.25Å; F96-F281 WeakPolarHBondContact CA-O 3.29Å; F96-F281 HydrophobicContact CD1-CB 4.01Å; F96-F281 HydrophobicContact CD1-CD1 4.2Å; F96-F281 HydrophobicContact CE1-CB 4.29Å; F96-F281 AromaticContact CE1-CD1 3.61Å; F96-F281 HydrophobicContact CE1-CD1 3.61Å; F96-F281 HydrophobicContact CE1-CE1 4.47Å; F96-F281 HydrophobicContact CE1-CG 4.4Å; F96-F281 HydrophobicContact CZ-CD1 4.2Å; V97-F281 PolarHBondContact N-O 3.47Å; S274-F281 PolarHBondContact O-N 2.99Å; E275-F281 HydrophobicContact CB-CD1 4.24Å; E275-F281 HydrophobicContact CB-CE1 3.55Å; E275-F281 HydrophobicContact CB-CZ 3.9Å
282	T	97.7	Very high	96.6	Very high	18 Å²	18	32.4 Å²	32.4	11%	0.11	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	137	177.1	-59.4	0	0	0	0	110.9	V97 K99 E279 P280	V97-T282 WeakPolarHBondContact O-CA 3.13Å; K99-T282 HydrophobicContact CB-CG2 4.36Å; K99-T282 HydrophobicContact CD-CG2 3.65Å; K99-T282 HydrophobicContact CG-CG2 3.71Å; E279-T282 WeakPolarHBondContact O-CB 3.13Å; E279-T282 PolarHBondContact O-N 2.95Å; P280-T282 PolarHBondContact O-N 3.33Å
283	A	97.5	Very high	96.4	Very high	2 Å²	2	34.6 Å²	34.6	2%	0.017	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	146.7	172.3	0	0	0	0	0	110.7	V97 T98 K99 I270 P299 L301	V97-A283 PolarHBondContact O-N 2.79Å; T98-A283 CarbonylContact C-O 3.49Å; T98-A283 WeakPolarHBondContact CA-O 3.43Å; K99-A283 PolarHBondContact N-O 2.68Å; I270-A283 HydrophobicContact CG2-CB 3.45Å; I270-A283 VanDerWaalsContact CG2-CB 3.45Å; A283-P299 HydrophobicContact CB-CG 3.98Å; A283-L301 HydrophobicContact CB-CD1 3.9Å
284	E	97.6	Very high	96.2	Very high	20 Å²	20	37 Å²	37	9%	0.093	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	129.9	171.4	164.2	175.4	145.7	0	0	109.9	P101 V124 R126	P101-E284 HydrophobicContact CG-CG 3.9Å; V124-E284 HydrophobicContact CB-CB 3.89Å; V124-E284 HydrophobicContact CB-CG 4.08Å; V124-E284 HydrophobicContact CG1-CB 4.24Å; V124-E284 HydrophobicContact CG1-CG 4.48Å; V124-E284 PolarHBondContact N-O 2.97Å; V124-E284 PolarHBondContact O-N 2.89Å; R126-E284 HydrophobicContact CG-CB 4.35Å; R126-E284 WeakPolarHBondContact CG-OE2 3.33Å; R126-E284 IonicContact CZ-OE1 2.79Å; R126-E284 IonicContact CZ-OE2 2.81Å; R126-E284 IonicContact NE-OE1 3.81Å; R126-E284 IonicContact NE-OE2 3.17Å; R126-E284 PolarHBondContact NE-OE2 2.8Å; R126-E284 IonicContact NH2-OE1 2.68Å; R126-E284 PolarHBondContact NH2-OE1 3.43Å; R126-E284 IonicContact NH2-OE2 3.33Å; R126-E284 PolarHBondContact NH2-OE2 3.4Å
285	S	97.7	Very high	96.1	Very high	3 Å²	3	44.6 Å²	44.6	2%	0.021	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	144.9	-179.6	-34.4	0	0	0	0	111.7	T98 K99 L104 Y298	T98-S285 PolarHBondContact OG1-OG 2.97Å; K99-S285 PolarHBondContact O-N 3.23Å; K99-S285 PolarHBondContact O-OG 3.34Å; L104-S285 WeakPolarHBondContact CD1-O 3.15Å; S285-Y298 CarbonylContact C-O 3.37Å; S285-Y298 WeakPolarHBondContact CA-O 3.49Å
286	V	98.2	Very high	96.1	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	132.5	170.4	177	0	0	0	0	108.8	I105 L107 A122 V124 F251 V288 L297 Y298	I105-V286 HydrophobicContact CB-CG2 4.49Å; I105-V286 HydrophobicContact CG2-CG1 4.17Å; I105-V286 HydrophobicContact CG2-CG2 4.35Å; L107-V286 HydrophobicContact CB-CG1 4.11Å; A122-V286 HydrophobicContact CB-CB 4.17Å; A122-V286 HydrophobicContact CB-CG1 4.05Å; A122-V286 HydrophobicContact CB-CG2 4.3Å; V124-V286 HydrophobicContact CG2-CG2 3.85Å; F251-V286 HydrophobicContact CD2-CG2 4.29Å; F251-V286 HydrophobicContact CE2-CG1 4.27Å; F251-V286 HydrophobicContact CE2-CG2 3.95Å; V286-V288 PolarHBondContact O-N 3.05Å; V286-L297 WeakPolarHBondContact O-CA 3.43Å; V286-Y298 PolarHBondContact N-O 2.66Å; V286-Y298 PolarHBondContact O-N 3.4Å
287	E	98.2	Very high	96.1	Very high	28 Å²	28	46.8 Å²	46.8	13%	0.131	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	108.6	173.2	-172.2	178.2	-136.9	0	0	109.8	L104 I105 Q106 L107 I289 R295 L297	L104-E287 HydrophobicContact CD2-CB 3.66Å; L104-E287 HydrophobicContact CD2-CG 4.39Å; L104-E287 HydrophobicContact CG-CB 4.03Å; I105-E287 PolarHBondContact O-N 2.89Å; Q106-E287 CarbonylContact C-O 3.55Å; Q106-E287 VanDerWaalsContact CA-O 3.32Å; Q106-E287 WeakPolarHBondContact CA-O 3.23Å; Q106-E287 HydrophobicContact CG-CB 4.3Å; Q106-E287 PolarHBondContact NE2-OE2 3.36Å; L107-E287 PolarHBondContact N-O 3.17Å; E287-I289 HydrophobicContact CG-CG1 4.01Å; E287-R295 HydrophobicContact CG-CB 4.33Å; E287-R295 VanDerWaalsContact OE1-CD 3.23Å; E287-R295 WeakPolarHBondContact OE1-CD 3.46Å; E287-R295 IonicContact OE1-NH1 3.27Å; E287-L297 HydrophobicContact CB-CD2 3.88Å; E287-L297 HydrophobicContact CG-CD2 4.23Å
288	V	98.1	Very high	96.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	116.6	171.9	179.8	0	0	0	0	108.3	L107 V109 V120 V286 R295 C296 Y298	L107-V288 HydrophobicContact CB-CG2 4.35Å; L107-V288 HydrophobicContact CD2-CG2 4.28Å; L107-V288 WeakPolarHBondContact O-CA 3.39Å; V109-V288 HydrophobicContact CG2-CG1 3.73Å; V120-V288 HydrophobicContact CG1-CG1 4.25Å; V286-V288 PolarHBondContact O-N 3.05Å; V288-R295 WeakPolarHBondContact O-CA 3.38Å; V288-C296 PolarHBondContact N-O 3.31Å; V288-C296 PolarHBondContact O-N 2.85Å; V288-Y298 HydrophobicContact CB-CD2 3.99Å; V288-Y298 HydrophobicContact CB-CE2 4.08Å; V288-Y298 HydrophobicContact CG2-CD2 3.62Å; V288-Y298 HydrophobicContact CG2-CE2 4.14Å
289	I	97.9	Very high	96.2	Very high	19 Å²	19	44.6 Å²	44.6	10%	0.097	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	112.6	180	-57.5	173.2	0	0	0	107.5	Q106 L107 H108 V109 E287 R295	Q106-I289 HydrophobicContact CB-CD1 4.28Å; Q106-I289 HydrophobicContact CG-CD1 4.16Å; L107-I289 PolarHBondContact O-N 3.46Å; H108-I289 VanDerWaalsContact CE1-CD1 3.49Å; H108-I289 WeakPolarHBondContact CE1-CD1 3.36Å; V109-I289 PolarHBondContact N-O 3.05Å; E287-I289 HydrophobicContact CG-CG1 4.01Å; I289-R295 HydrophobicContact CG1-CG 4.2Å; I289-R295 HydrophobicContact CG2-CG 4.45Å
290	Q	94.6	Very high	96	Very high	26 Å²	26	41.7 Å²	41.7	12%	0.121	23%	0.227	C	C	.	.			trans	-75.1	161.9	-179.5	-61.9	-64.7	-5.1	0	0	111.6	D292 G293 S294	Q290-D292 WeakPolarHBondContact CB-OD1 3.3Å; Q290-D292 PolarHBondContact O-N 2.95Å; Q290-G293 WeakPolarHBondContact O-CA 3.3Å; Q290-G293 PolarHBondContact O-N 3.08Å; Q290-S294 VanDerWaalsContact CB-OG 3.24Å; Q290-S294 WeakPolarHBondContact CB-OG 3.44Å; Q290-S294 VanDerWaalsContact CG-OG 3.28Å; Q290-S294 WeakPolarHBondContact CG-OG 3.34Å; Q290-S294 PolarHBondContact N-O 3.38Å
291	H	89	Confident	95.8	Very high	88 Å²	88	38.7 Å²	38.7	41%	0.407	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-23.5	-179.8	71.4	-81.5	0	0	0	114	V109 P111 Q114 G293	V109-H291 WeakPolarHBondContact O-CA 3.34Å; V109-H291 WeakPolarHBondContact O-CB 3.27Å; V109-H291 PolarHBondContact O-N 3.41Å; P111-H291 HydrophobicContact CB-CB 4.4Å; P111-H291 HydrophobicContact CG-CB 3.94Å; Q114-H291 VanDerWaalsContact CD-CE1 3.5Å; Q114-H291 PolarHBondContact NE2-ND1 2.99Å; H291-G293 VanDerWaalsContact C-N 3.3Å
292	D	91.2	Very high	95.5	Very high	112 Å²	112	41.3 Å²	41.3	60%	0.599	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-2.2	174.8	67.9	-4.4	0	0	0	113.2	Q290 S294	Q290-D292 WeakPolarHBondContact CB-OD1 3.3Å; Q290-D292 PolarHBondContact O-N 2.95Å; D292-S294 VanDerWaalsContact OD1-CB 3.25Å; D292-S294 WeakPolarHBondContact OD1-CB 3.46Å; D292-S294 PolarHBondContact OD1-N 3.19Å; D292-S294 PolarHBondContact OD1-OG 2.89Å
293	G	92.2	Very high	95.3	Very high	46 Å²	46	43.6 Å²	43.6	47%	0.474	23%	0.231	S	C	.	.	S	Bend	trans	89	-3.3	-178	0	0	0	0	0	114.8	Q290 H291 R295	Q290-G293 WeakPolarHBondContact O-CA 3.3Å; Q290-G293 PolarHBondContact O-N 3.08Å; H291-G293 VanDerWaalsContact C-N 3.3Å; G293-R295 WeakPolarHBondContact O-CG 3.44Å
294	S	95	Very high	95.1	Very high	50 Å²	50	47.8 Å²	47.8	35%	0.35	25%	0.246	S	C	.	.			trans	-65	147.6	173	65.4	0	0	0	0	111	Q290 D292	Q290-S294 VanDerWaalsContact CB-OG 3.24Å; Q290-S294 WeakPolarHBondContact CB-OG 3.44Å; Q290-S294 VanDerWaalsContact CG-OG 3.28Å; Q290-S294 WeakPolarHBondContact CG-OG 3.34Å; Q290-S294 PolarHBondContact N-O 3.38Å; D292-S294 VanDerWaalsContact OD1-CB 3.25Å; D292-S294 WeakPolarHBondContact OD1-CB 3.46Å; D292-S294 PolarHBondContact OD1-N 3.19Å; D292-S294 PolarHBondContact OD1-OG 2.89Å
295	R	96.3	Very high	94.9	Very high	160 Å²	160	51.8 Å²	51.8	60%	0.604	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.5	129.1	-173.3	-51.2	-170.1	-172.7	-176.8	-1.2	110.2	E287 V288 I289 G293	E287-R295 HydrophobicContact CG-CB 4.33Å; E287-R295 VanDerWaalsContact OE1-CD 3.23Å; E287-R295 WeakPolarHBondContact OE1-CD 3.46Å; E287-R295 IonicContact OE1-NH1 3.27Å; V288-R295 WeakPolarHBondContact O-CA 3.38Å; I289-R295 HydrophobicContact CG1-CG 4.2Å; I289-R295 HydrophobicContact CG2-CG 4.45Å; G293-R295 WeakPolarHBondContact O-CG 3.44Å
296	C	96.3	Very high	94.6	Very high	50 Å²	50	54.9 Å²	54.9	34%	0.338	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	144.4	177.9	-62.2	0	0	0	0	109.7	V288 Y298	V288-C296 PolarHBondContact N-O 3.31Å; V288-C296 PolarHBondContact O-N 2.85Å; C296-Y298 HydrophobicContact CB-CD2 4.29Å; C296-Y298 HydrophobicContact CB-CE2 3.54Å
297	L	97.1	Very high	94.4	Very high	73 Å²	73	57.1 Å²	57.1	38%	0.382	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	132.7	174.2	-62.4	176.9	0	0	0	109.1	L104 V286 E287	L104-L297 HydrophobicContact CD2-CD2 3.83Å; V286-L297 WeakPolarHBondContact O-CA 3.43Å; E287-L297 HydrophobicContact CB-CD2 3.88Å; E287-L297 HydrophobicContact CG-CD2 4.23Å
298	Y	98	Very high	94.1	Very high	21 Å²	21	56 Å²	56	8%	0.082	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	152.1	175	-65.6	-76.8	0	0	0	111	V121 A122 I263 S285 V286 V288 C296	V121-Y298 HydrophobicContact CB-CD1 3.95Å; V121-Y298 HydrophobicContact CB-CD2 4.07Å; V121-Y298 HydrophobicContact CB-CE1 4.29Å; V121-Y298 HydrophobicContact CB-CE2 4.38Å; V121-Y298 HydrophobicContact CB-CG 3.83Å; V121-Y298 HydrophobicContact CG1-CD1 3.75Å; V121-Y298 HydrophobicContact CG1-CD2 3.97Å; V121-Y298 HydrophobicContact CG1-CE1 3.57Å; V121-Y298 HydrophobicContact CG1-CE2 3.77Å; V121-Y298 HydrophobicContact CG1-CG 3.95Å; A122-Y298 CarbonylContact O-C 3.59Å; A122-Y298 WeakPolarHBondContact O-CB 3.48Å; I263-Y298 HydrophobicContact CD1-CE1 3.83Å; I263-Y298 HydrophobicContact CG1-CD1 4.25Å; I263-Y298 HydrophobicContact CG1-CE1 3.7Å; S285-Y298 CarbonylContact C-O 3.37Å; S285-Y298 WeakPolarHBondContact CA-O 3.49Å; V286-Y298 PolarHBondContact N-O 2.66Å; V286-Y298 PolarHBondContact O-N 3.4Å; V288-Y298 HydrophobicContact CB-CD2 3.99Å; V288-Y298 HydrophobicContact CB-CE2 4.08Å; V288-Y298 HydrophobicContact CG2-CD2 3.62Å; V288-Y298 HydrophobicContact CG2-CE2 4.14Å; C296-Y298 HydrophobicContact CB-CD2 4.29Å; C296-Y298 HydrophobicContact CB-CE2 3.54Å
299	P	96.9	Very high	93.9	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.295	C	S	.	.			cis	-65	150.2	-18.6	36.4	-40.9	0	0	0	109.5	T98 L266 D267 I270 A283 L301	T98-P299 PolarHBondContact OG1-O 2.95Å; L266-P299 HydrophobicContact CD2-CB 4.22Å; D267-P299 WeakPolarHBondContact OD1-CB 3.36Å; I270-P299 HydrophobicContact CD1-CB 3.9Å; I270-P299 HydrophobicContact CD1-CG 3.44Å; I270-P299 VanDerWaalsContact CD1-CG 3.44Å; I270-P299 HydrophobicContact CG2-CG 4.25Å; A283-P299 HydrophobicContact CB-CG 3.98Å; P299-L301 HydrophobicContact CB-CD2 3.84Å; P299-L301 HydrophobicContact CB-CG 3.78Å; P299-L301 HydrophobicContact CG-CD1 3.96Å; P299-L301 HydrophobicContact CG-CD2 4.13Å; P299-L301 HydrophobicContact CG-CG 3.74Å
300	S	91.1	Very high	93.6	Very high	38 Å²	38	56.3 Å²	56.3	27%	0.266	29%	0.294	S	S	.	.			trans	-77.2	-37.1	172.4	72.4	0	0	0	0	110.8	T98 D302	T98-S300 WeakPolarHBondContact CG2-O 3.5Å; S300-D302 WeakPolarHBondContact CB-OD2 3.39Å; S300-D302 PolarHBondContact O-N 3.21Å; S300-D302 VanDerWaalsContact OG-CG 3.31Å; S300-D302 PolarHBondContact OG-OD2 3.2Å
301	L	94	Very high	93.5	Very high	6 Å²	6	58.6 Å²	58.6	3%	0.031	31%	0.307	C	S	.	.			trans	52.9	33.4	-175.7	-56.9	178.3	0	0	0	112.2	F96 D267 I270 T271 A283 P299 Y303 P369	F96-L301 HydrophobicContact CB-CD1 4.33Å; D267-L301 HydrophobicContact CB-CD2 4.37Å; I270-L301 HydrophobicContact CG2-CD1 4.13Å; I270-L301 HydrophobicContact CG2-CD2 4.29Å; T271-L301 HydrophobicContact CG2-CD2 3.9Å; A283-L301 HydrophobicContact CB-CD1 3.9Å; P299-L301 HydrophobicContact CB-CD2 3.84Å; P299-L301 HydrophobicContact CB-CG 3.78Å; P299-L301 HydrophobicContact CG-CD1 3.96Å; P299-L301 HydrophobicContact CG-CD2 4.13Å; P299-L301 HydrophobicContact CG-CG 3.74Å; L301-Y303 PolarHBondContact O-N 2.84Å; L301-P369 HydrophobicContact CB-CB 4.45Å; L301-P369 HydrophobicContact CB-CG 4.19Å; L301-P369 HydrophobicContact CD2-CB 4.2Å; L301-P369 HydrophobicContact CD2-CG 4.25Å
302	D	90.9	Very high	93.8	Very high	108 Å²	108	56.4 Å²	56.4	58%	0.578	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-67.4	134.4	-177.4	-61	-45.6	0	0	0	110.5	S300	S300-D302 WeakPolarHBondContact CB-OD2 3.39Å; S300-D302 PolarHBondContact O-N 3.21Å; S300-D302 VanDerWaalsContact OG-CG 3.31Å; S300-D302 PolarHBondContact OG-OD2 3.2Å
303	Y	94.2	Very high	93.9	Very high	66 Å²	66	51.1 Å²	51.1	26%	0.259	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-82.9	133.7	167.4	-77.3	-113.7	0	0	0	108.3	P94 V95 F96 L301 I367 P368 P369	P94-Y303 PolarHBondContact O-OH 3.01Å; V95-Y303 WeakPolarHBondContact CA-OH 3.43Å; F96-Y303 HydrophobicContact CB-CE2 4.33Å; F96-Y303 WeakPolarHBondContact CD2-OH 3.37Å; F96-Y303 PolarHBondContact N-OH 3.29Å; L301-Y303 PolarHBondContact O-N 2.84Å; Y303-I367 WeakPolarHBondContact CA-O 3.47Å; Y303-P368 HydrophobicContact CD1-CB 4.42Å; Y303-P368 HydrophobicContact CE1-CB 3.8Å; Y303-P369 HydrophobicContact CE2-CG 4.24Å
304	R	93.3	Very high	94	Very high	89 Å²	89	49.8 Å²	49.8	34%	0.336	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	126	178.4	-63.1	-179.2	-65.9	156.6	4.8	108.9	I367 R371 I374	R304-I367 HydrophobicContact CB-CB 4.35Å; R304-I367 HydrophobicContact CB-CD1 4.47Å; R304-I367 PolarHBondContact N-O 3.19Å; R304-I367 VanDerWaalsContact N-O 3.14Å; R304-I367 WeakPolarHBondContact O-CB 3.3Å; R304-I367 PolarHBondContact O-N 3.49Å; R304-R371 PolarHBondContact NH2-O 3.24Å; R304-I374 PolarHBondContact NH1-O 3.06Å; R304-I374 PolarHBondContact NH2-O 2.86Å
305	D	92.3	Very high	93.8	Very high	104 Å²	104	54.9 Å²	54.9	56%	0.556	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	122.8	176.2	-66.8	-25.9	0	0	0	109.6	V365 S366	D305-V365 WeakPolarHBondContact CA-O 3.34Å; D305-S366 WeakPolarHBondContact OD1-CA 3.46Å; D305-S366 WeakPolarHBondContact OD1-CB 3.46Å; D305-S366 PolarHBondContact OD1-OG 2.88Å
306	E	92.8	Very high	93.6	Very high	68 Å²	68	52.3 Å²	52.3	32%	0.318	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	133.1	172.7	-76.1	-64.9	162.6	0	0	109.6	V365 I367 I380	E306-V365 PolarHBondContact N-O 3.05Å; E306-V365 PolarHBondContact O-N 3.11Å; E306-I367 HydrophobicContact CB-CD1 3.94Å; E306-I367 HydrophobicContact CG-CD1 3.44Å; E306-I367 VanDerWaalsContact CG-CD1 3.44Å; E306-I380 HydrophobicContact CB-CD1 3.87Å
307	V	92.6	Very high	93.4	Very high	48 Å²	48	51.1 Å²	51.1	29%	0.291	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	124.2	-179.2	-179.6	0	0	0	0	109.3	L362 I363	V307-L362 HydrophobicContact CG1-CB 4.25Å; V307-L362 HydrophobicContact CG1-CD2 4.03Å; V307-I363 WeakPolarHBondContact CA-O 3.35Å
308	V	93	Very high	93	Very high	4 Å²	4	49.9 Å²	49.9	2%	0.024	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	147.3	179.3	64.7	0	0	0	0	110.5	Y312 I313 I363 V365 A377 I380	V308-Y312 HydrophobicContact CG2-CD1 4.03Å; V308-I313 HydrophobicContact CG1-CD1 3.94Å; V308-I313 HydrophobicContact CG2-CD1 3.96Å; V308-I313 HydrophobicContact CG2-CG1 3.85Å; V308-I363 HydrophobicContact CG1-CD1 3.9Å; V308-I363 HydrophobicContact CG1-CG1 3.55Å; V308-I363 PolarHBondContact N-O 2.8Å; V308-I363 WeakPolarHBondContact O-CG1 3.46Å; V308-I363 PolarHBondContact O-N 3.16Å; V308-V365 HydrophobicContact CG1-CG2 3.92Å; V308-A377 HydrophobicContact CB-CB 4.32Å; V308-A377 HydrophobicContact CG2-CB 3.91Å; V308-I380 HydrophobicContact CG1-CD1 4.49Å; V308-I380 HydrophobicContact CG1-CG2 4.14Å
309	S	93.1	Very high	92.7	Very high	13 Å²	13	50 Å²	50	9%	0.091	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	142.2	173.2	68.6	0	0	0	0	111.3	D311 Y312 I313	S309-D311 PolarHBondContact O-N 2.94Å; S309-Y312 WeakPolarHBondContact O-CB 3.46Å; S309-Y312 PolarHBondContact O-N 3.2Å; S309-Y312 VanDerWaalsContact O-N 3.16Å; S309-Y312 WeakPolarHBondContact OG-CB 2.96Å; S309-Y312 PolarHBondContact OG-N 3.49Å; S309-Y312 VanDerWaalsContact OG-N 3.13Å; S309-I313 PolarHBondContact O-N 3.18Å
310	I	92.5	Very high	92.5	Very high	12 Å²	12	55.2 Å²	55.2	6%	0.062	29%	0.29	C	S	.	.	H	α-helix	trans	-60.7	-38	173.7	-66.7	159	0	0	0	110.7	Y312 I313 N314 F321 E323 V326 G361 I363	I310-Y312 VanDerWaalsContact C-N 3.28Å; I310-Y312 PolarHBondContact O-N 2.85Å; I310-I313 PolarHBondContact O-N 3.46Å; I310-N314 WeakPolarHBondContact CG2-ND2 3.5Å; I310-N314 WeakPolarHBondContact O-CB 3.31Å; I310-N314 PolarHBondContact O-N 2.62Å; I310-F321 WeakPolarHBondContact CG2-O 3.37Å; I310-E323 HydrophobicContact CD1-CB 3.35Å; I310-E323 HydrophobicContact CD1-CG 3.71Å; I310-V326 HydrophobicContact CG2-CG2 4.31Å; I310-G361 WeakPolarHBondContact CD1-O 3.39Å; I310-G361 VanDerWaalsContact CG1-O 3.3Å; I310-G361 WeakPolarHBondContact CG1-O 3.31Å; I310-G361 PolarHBondContact N-O 3.44Å; I310-G361 VanDerWaalsContact N-O 3.08Å; I310-I363 HydrophobicContact CD1-CG2 4.32Å; I310-I363 HydrophobicContact CG1-CG2 4.44Å
311	D	91.9	Very high	92.7	Very high	75 Å²	75	54.4 Å²	54.4	40%	0.401	28%	0.282	S	S	.	.	H	α-helix	trans	-60.6	-37.2	176.7	-66.2	-21.2	0	0	0	112.3	S309 R315 T360	S309-D311 PolarHBondContact O-N 2.94Å; D311-R315 WeakPolarHBondContact O-CB 3.47Å; D311-R315 PolarHBondContact O-N 3Å; D311-T360 PolarHBondContact OD2-OG1 3.48Å
312	Y	94.6	Very high	92.6	Very high	42 Å²	42	56.8 Å²	56.8	17%	0.165	30%	0.299	C	S	.	.	H	α-helix	trans	-64.8	-49.5	174.4	174.5	-89.6	0	0	0	110.9	V308 S309 I310 N314 R315 Q316 A377 A381	V308-Y312 HydrophobicContact CG2-CD1 4.03Å; S309-Y312 WeakPolarHBondContact O-CB 3.46Å; S309-Y312 PolarHBondContact O-N 3.2Å; S309-Y312 VanDerWaalsContact O-N 3.16Å; S309-Y312 WeakPolarHBondContact OG-CB 2.96Å; S309-Y312 PolarHBondContact OG-N 3.49Å; S309-Y312 VanDerWaalsContact OG-N 3.13Å; I310-Y312 VanDerWaalsContact C-N 3.28Å; I310-Y312 PolarHBondContact O-N 2.85Å; Y312-N314 PolarHBondContact O-N 3.15Å; Y312-R315 PolarHBondContact O-N 3.36Å; Y312-Q316 HydrophobicContact CD1-CG 4.18Å; Y312-Q316 HydrophobicContact CE1-CG 3.75Å; Y312-Q316 HydrophobicContact CE2-CG 4.14Å; Y312-Q316 WeakPolarHBondContact O-CG 3.43Å; Y312-Q316 PolarHBondContact O-N 3.26Å; Y312-A377 HydrophobicContact CE1-CB 4.12Å; Y312-A381 HydrophobicContact CE1-CB 4.33Å
313	I	94.6	Very high	92.6	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-58.2	-51.7	-179.8	-66.2	168.3	0	0	0	110.4	V308 S309 I310 R315 Q316 L317 V326 I363 A381 V384	V308-I313 HydrophobicContact CG1-CD1 3.94Å; V308-I313 HydrophobicContact CG2-CD1 3.96Å; V308-I313 HydrophobicContact CG2-CG1 3.85Å; S309-I313 PolarHBondContact O-N 3.18Å; I310-I313 PolarHBondContact O-N 3.46Å; I313-R315 VanDerWaalsContact C-N 3.31Å; I313-R315 PolarHBondContact O-N 2.89Å; I313-Q316 PolarHBondContact O-N 3.26Å; I313-L317 HydrophobicContact CG2-CD1 3.81Å; I313-L317 WeakPolarHBondContact O-CG 3.23Å; I313-L317 PolarHBondContact O-N 2.9Å; I313-V326 HydrophobicContact CD1-CG1 3.79Å; I313-I363 HydrophobicContact CD1-CD1 4.37Å; I313-A381 HydrophobicContact CG1-CB 4.2Å; I313-A381 HydrophobicContact CG2-CB 4.48Å; I313-V384 HydrophobicContact CD1-CG2 4.43Å; I313-V384 HydrophobicContact CG2-CB 4.11Å; I313-V384 HydrophobicContact CG2-CG1 3.94Å; I313-V384 HydrophobicContact CG2-CG2 4.14Å
314	N	93.6	Very high	92.5	Very high	19 Å²	19	56.5 Å²	56.5	10%	0.102	30%	0.304	C	S	.	.	H	α-helix	trans	-59.6	-39.8	178.7	-80.9	-23.5	0	0	0	112.2	I310 Y312 G318 T319 F321	I310-N314 WeakPolarHBondContact CG2-ND2 3.5Å; I310-N314 WeakPolarHBondContact O-CB 3.31Å; I310-N314 PolarHBondContact O-N 2.62Å; Y312-N314 PolarHBondContact O-N 3.15Å; N314-G318 WeakPolarHBondContact O-CA 3.34Å; N314-G318 PolarHBondContact O-N 3.32Å; N314-T319 VanDerWaalsContact CB-O 3.27Å; N314-T319 WeakPolarHBondContact CB-O 2.96Å; N314-T319 PolarHBondContact O-N 3.38Å; N314-T319 PolarHBondContact OD1-OG1 3.42Å; N314-T319 VanDerWaalsContact OD1-OG1 3.11Å; N314-F321 PolarHBondContact ND2-N 2.76Å; N314-F321 PolarHBondContact ND2-O 2.82Å; N314-F321 WeakPolarHBondContact OD1-CB 3.32Å; N314-F321 PolarHBondContact OD1-N 3.1Å
315	R	91.1	Very high	92.6	Very high	156 Å²	156	56.8 Å²	56.8	59%	0.589	31%	0.309	S	S	*	.	H	α-helix	trans	-66.9	-39.2	176.9	-176.6	176.2	65.8	-136.6	1.9	112.7	D311 Y312 I313	D311-R315 WeakPolarHBondContact O-CB 3.47Å; D311-R315 PolarHBondContact O-N 3Å; Y312-R315 PolarHBondContact O-N 3.36Å; I313-R315 VanDerWaalsContact C-N 3.31Å; I313-R315 PolarHBondContact O-N 2.89Å
316	Q	91.4	Very high	92.7	Very high	107 Å²	107	51.8 Å²	51.8	50%	0.5	28%	0.282	S	S	.	.	H	α-helix	trans	-69.2	-40.9	177.3	-66.3	-58.5	-23.5	0	0	111.6	Y312 I313 A381	Y312-Q316 HydrophobicContact CD1-CG 4.18Å; Y312-Q316 HydrophobicContact CE1-CG 3.75Å; Y312-Q316 HydrophobicContact CE2-CG 4.14Å; Y312-Q316 WeakPolarHBondContact O-CG 3.43Å; Y312-Q316 PolarHBondContact O-N 3.26Å; I313-Q316 PolarHBondContact O-N 3.26Å; Q316-A381 HydrophobicContact CB-CB 4.49Å
317	L	91.9	Very high	92.7	Very high	25 Å²	25	50.2 Å²	50.2	13%	0.131	28%	0.276	C	S	.	.	H	α-helix	trans	-85.3	-16.3	-177.1	-63.9	178.3	0	0	0	113.8	I313 T319 F321 V384 I393	I313-L317 HydrophobicContact CG2-CD1 3.81Å; I313-L317 WeakPolarHBondContact O-CG 3.23Å; I313-L317 PolarHBondContact O-N 2.9Å; L317-T319 VanDerWaalsContact C-N 3.33Å; L317-T319 HydrophobicContact CB-CG2 3.98Å; L317-F321 HydrophobicContact CD1-CE2 4.26Å; L317-V384 HydrophobicContact CD1-CB 3.99Å; L317-V384 HydrophobicContact CD1-CG1 3.66Å; L317-I393 HydrophobicContact CD2-CD1 4.23Å; L317-I393 WeakPolarHBondContact O-CG2 3.36Å
318	G	90.1	Very high	92.8	Very high	46 Å²	46	52.2 Å²	52.2	47%	0.474	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	27.6	-172.6	0	0	0	0	0	113.3	N314	N314-G318 WeakPolarHBondContact O-CA 3.34Å; N314-G318 PolarHBondContact O-N 3.32Å
319	T	92	Very high	92.9	Very high	23 Å²	23	52.6 Å²	52.6	14%	0.141	29%	0.287	C	S	.	.			trans	-114.2	179.9	-175.8	60.1	0	0	0	0	111.7	N314 L317 F321 I393	N314-T319 VanDerWaalsContact CB-O 3.27Å; N314-T319 WeakPolarHBondContact CB-O 2.96Å; N314-T319 PolarHBondContact O-N 3.38Å; N314-T319 PolarHBondContact OD1-OG1 3.42Å; N314-T319 VanDerWaalsContact OD1-OG1 3.11Å; L317-T319 VanDerWaalsContact C-N 3.33Å; L317-T319 HydrophobicContact CB-CG2 3.98Å; T319-F321 VanDerWaalsContact CB-CE2 3.5Å; T319-F321 HydrophobicContact CG2-CD2 4.4Å; T319-F321 HydrophobicContact CG2-CE2 3.62Å; T319-F321 HydrophobicContact CG2-CZ 3.72Å; T319-F321 WeakPolarHBondContact OG1-CD2 3.37Å; T319-F321 WeakPolarHBondContact OG1-CE2 3.45Å; T319-I393 HydrophobicContact CG2-CG2 4.31Å
320	S	92.1	Very high	93	Very high	111 Å²	111	52 Å²	52	78%	0.776	28%	0.282	S	S	*	.			trans	-136.8	45.5	179.5	66.9	0	0	0	0	111.2
321	F	93.9	Very high	93.1	Very high	21 Å²	21	54.2 Å²	54.2	9%	0.092	29%	0.294	C	S	.	.			trans	-66.5	141.5	-179.3	-60.4	-53.5	0	0	0	111.7	I310 N314 L317 T319 E325 V326 L329 V384 F388	I310-F321 WeakPolarHBondContact CG2-O 3.37Å; N314-F321 PolarHBondContact ND2-N 2.76Å; N314-F321 PolarHBondContact ND2-O 2.82Å; N314-F321 WeakPolarHBondContact OD1-CB 3.32Å; N314-F321 PolarHBondContact OD1-N 3.1Å; L317-F321 HydrophobicContact CD1-CE2 4.26Å; T319-F321 VanDerWaalsContact CB-CE2 3.5Å; T319-F321 HydrophobicContact CG2-CD2 4.4Å; T319-F321 HydrophobicContact CG2-CE2 3.62Å; T319-F321 HydrophobicContact CG2-CZ 3.72Å; T319-F321 WeakPolarHBondContact OG1-CD2 3.37Å; T319-F321 WeakPolarHBondContact OG1-CE2 3.45Å; F321-E325 HydrophobicContact CB-CB 4.22Å; F321-E325 HydrophobicContact CD1-CB 4.41Å; F321-V326 HydrophobicContact CB-CG2 3.65Å; F321-L329 HydrophobicContact CD2-CD1 4.46Å; F321-L329 HydrophobicContact CE2-CD1 4.33Å; F321-L329 HydrophobicContact CZ-CD1 4.39Å; F321-V384 HydrophobicContact CD2-CG1 4.27Å; F321-V384 HydrophobicContact CE2-CG1 4.25Å; F321-F388 AromaticContact CE1-CD2 3.73Å; F321-F388 HydrophobicContact CE1-CD2 3.73Å; F321-F388 HydrophobicContact CE1-CE1 4.39Å; F321-F388 AromaticContact CE1-CE2 3.57Å; F321-F388 HydrophobicContact CE1-CE2 3.57Å; F321-F388 HydrophobicContact CE1-CG 4.24Å; F321-F388 AromaticContact CE1-CZ 3.92Å; F321-F388 HydrophobicContact CE1-CZ 3.92Å; F321-F388 HydrophobicContact CE2-CD1 4.49Å; F321-F388 HydrophobicContact CE2-CG 4.34Å; F321-F388 HydrophobicContact CZ-CB 4.23Å; F321-F388 AromaticContact CZ-CD1 3.68Å; F321-F388 HydrophobicContact CZ-CD1 3.68Å; F321-F388 AromaticContact CZ-CD2 3.5Å; F321-F388 HydrophobicContact CZ-CD2 3.5Å; F321-F388 VanDerWaalsContact CZ-CD2 3.5Å; F321-F388 AromaticContact CZ-CE1 3.76Å; F321-F388 HydrophobicContact CZ-CE1 3.76Å; F321-F388 AromaticContact CZ-CE2 3.64Å; F321-F388 HydrophobicContact CZ-CE2 3.64Å; F321-F388 AromaticContact CZ-CG 3.52Å; F321-F388 HydrophobicContact CZ-CG 3.52Å; F321-F388 AromaticContact CZ-CZ 3.76Å; F321-F388 HydrophobicContact CZ-CZ 3.76Å
322	S	93.2	Very high	93.2	Very high	55 Å²	55	53.5 Å²	53.5	39%	0.385	29%	0.286	S	S	.	.			trans	-75.7	162.4	167.1	66.6	0	0	0	0	111.6	T324 E325 V326	S322-T324 PolarHBondContact O-N 3.33Å; S322-E325 VanDerWaalsContact CB-OE2 3.29Å; S322-E325 WeakPolarHBondContact CB-OE2 3.5Å; S322-E325 PolarHBondContact N-OE2 2.7Å; S322-E325 PolarHBondContact O-N 2.89Å; S322-E325 VanDerWaalsContact O-N 3.12Å; S322-E325 WeakPolarHBondContact OG-CG 3.48Å; S322-E325 PolarHBondContact OG-N 3.41Å; S322-E325 PolarHBondContact OG-OE2 2.89Å; S322-V326 WeakPolarHBondContact O-CG2 3.37Å; S322-V326 PolarHBondContact O-N 2.93Å
323	E	90.9	Very high	93.3	Very high	59 Å²	59	51.8 Å²	51.8	28%	0.276	28%	0.279	S	S	.	.	H	α-helix	trans	-53	-42.8	176.4	-178.4	168.3	174.1	0	0	112.8	I310 E325 V326 I327 S339 I363	I310-E323 HydrophobicContact CD1-CB 3.35Å; I310-E323 HydrophobicContact CD1-CG 3.71Å; E323-E325 PolarHBondContact O-N 3.03Å; E323-V326 PolarHBondContact O-N 2.97Å; E323-I327 HydrophobicContact CG-CD1 3.78Å; E323-I327 HydrophobicContact CG-CG1 4.48Å; E323-I327 WeakPolarHBondContact O-CB 3.24Å; E323-I327 VanDerWaalsContact O-CG1 3.25Å; E323-I327 WeakPolarHBondContact O-CG1 3.06Å; E323-I327 PolarHBondContact O-N 3.41Å; E323-S339 WeakPolarHBondContact OE1-CB 3.39Å; E323-S339 PolarHBondContact OE1-OG 3.18Å; E323-I363 HydrophobicContact CG-CG2 4.08Å
324	T	92.3	Very high	93.3	Very high	110 Å²	110	52.3 Å²	52.3	68%	0.675	29%	0.285	S	S	*	.	H	α-helix	trans	-67	-38.1	-179.2	-51.4	0	0	0	0	111.9	S322 N328	S322-T324 PolarHBondContact O-N 3.33Å; T324-N328 WeakPolarHBondContact O-CB 3.45Å; T324-N328 PolarHBondContact O-N 3.25Å
325	E	94.3	Very high	93.3	Very high	94 Å²	94	51.4 Å²	51.4	44%	0.439	28%	0.281	S	S	.	.	H	α-helix	trans	-66.3	-46.7	176.3	-71.5	165.3	127.2	0	0	111	F321 S322 E323 I327 N328 L329	F321-E325 HydrophobicContact CB-CB 4.22Å; F321-E325 HydrophobicContact CD1-CB 4.41Å; S322-E325 VanDerWaalsContact CB-OE2 3.29Å; S322-E325 WeakPolarHBondContact CB-OE2 3.5Å; S322-E325 PolarHBondContact N-OE2 2.7Å; S322-E325 PolarHBondContact O-N 2.89Å; S322-E325 VanDerWaalsContact O-N 3.12Å; S322-E325 WeakPolarHBondContact OG-CG 3.48Å; S322-E325 PolarHBondContact OG-N 3.41Å; S322-E325 PolarHBondContact OG-OE2 2.89Å; E323-E325 PolarHBondContact O-N 3.03Å; E325-I327 PolarHBondContact O-N 3.36Å; E325-N328 PolarHBondContact O-N 3.4Å; E325-L329 VanDerWaalsContact O-CG 3.29Å; E325-L329 WeakPolarHBondContact O-CG 3.26Å; E325-L329 PolarHBondContact O-N 3.28Å
326	V	94.7	Very high	93.4	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60.2	-46.5	177.3	175.5	0	0	0	0	111.2	I310 I313 F321 S322 E323 N328 L329 L330 I363 V384	I310-V326 HydrophobicContact CG2-CG2 4.31Å; I313-V326 HydrophobicContact CD1-CG1 3.79Å; F321-V326 HydrophobicContact CB-CG2 3.65Å; S322-V326 WeakPolarHBondContact O-CG2 3.37Å; S322-V326 PolarHBondContact O-N 2.93Å; E323-V326 PolarHBondContact O-N 2.97Å; V326-N328 VanDerWaalsContact C-N 3.29Å; V326-N328 PolarHBondContact O-N 3.36Å; V326-L329 PolarHBondContact O-N 2.83Å; V326-L330 HydrophobicContact CG1-CD1 3.83Å; V326-L330 HydrophobicContact CG1-CG 4.3Å; V326-L330 WeakPolarHBondContact O-CB 3.24Å; V326-L330 WeakPolarHBondContact O-CG 3.18Å; V326-L330 PolarHBondContact O-N 3.34Å; V326-I363 HydrophobicContact CG1-CD1 3.67Å; V326-V384 HydrophobicContact CG1-CG2 4.15Å
327	I	93.3	Very high	93.3	Very high	35 Å²	35	43.1 Å²	43.1	18%	0.179	26%	0.255	C	S	.	.	H	α-helix	trans	-59.3	-42.8	177.1	-71.6	170.3	0	0	0	110.6	E323 E325 L330 N331 C337	E323-I327 HydrophobicContact CG-CD1 3.78Å; E323-I327 HydrophobicContact CG-CG1 4.48Å; E323-I327 WeakPolarHBondContact O-CB 3.24Å; E323-I327 VanDerWaalsContact O-CG1 3.25Å; E323-I327 WeakPolarHBondContact O-CG1 3.06Å; E323-I327 PolarHBondContact O-N 3.41Å; E325-I327 PolarHBondContact O-N 3.36Å; I327-L330 PolarHBondContact O-N 3.42Å; I327-N331 WeakPolarHBondContact O-CB 3.34Å; I327-N331 PolarHBondContact O-N 3.22Å; I327-N331 PolarHBondContact O-ND2 3.22Å; I327-N331 VanDerWaalsContact O-ND2 3.17Å; I327-N331 PolarHBondContact O-OD1 2.96Å; I327-C337 HydrophobicContact CB-CB 4.5Å; I327-C337 HydrophobicContact CG1-CB 3.96Å; I327-C337 HydrophobicContact CG2-CB 4.24Å
328	N	93.6	Very high	93	Very high	89 Å²	89	46.5 Å²	46.5	48%	0.476	28%	0.277	S	S	.	.	H	α-helix	trans	-64.8	-41.7	178.6	-170.7	39.8	0	0	0	112.2	T324 E325 V326 N331 R332	T324-N328 WeakPolarHBondContact O-CB 3.45Å; T324-N328 PolarHBondContact O-N 3.25Å; E325-N328 PolarHBondContact O-N 3.4Å; V326-N328 VanDerWaalsContact C-N 3.29Å; V326-N328 PolarHBondContact O-N 3.36Å; N328-N331 PolarHBondContact O-N 2.78Å; N328-R332 WeakPolarHBondContact O-CG 3.18Å; N328-R332 PolarHBondContact O-N 3.17Å
329	L	95.7	Very high	92.7	Very high	13 Å²	13	47.7 Å²	47.7	7%	0.068	28%	0.278	C	S	.	.	H	α-helix	trans	-64.6	-44.1	176.5	-68.9	171.8	0	0	0	111.7	F321 E325 V326 N331 R332 M333 V384 A387 F388	F321-L329 HydrophobicContact CD2-CD1 4.46Å; F321-L329 HydrophobicContact CE2-CD1 4.33Å; F321-L329 HydrophobicContact CZ-CD1 4.39Å; E325-L329 VanDerWaalsContact O-CG 3.29Å; E325-L329 WeakPolarHBondContact O-CG 3.26Å; E325-L329 PolarHBondContact O-N 3.28Å; V326-L329 PolarHBondContact O-N 2.83Å; L329-N331 PolarHBondContact O-N 2.88Å; L329-R332 WeakPolarHBondContact O-CB 3.28Å; L329-R332 PolarHBondContact O-N 3.22Å; L329-M333 PolarHBondContact O-N 3.49Å; L329-V384 HydrophobicContact CB-CG1 4.36Å; L329-V384 HydrophobicContact CD1-CG1 3.8Å; L329-A387 HydrophobicContact CB-CB 3.89Å; L329-A387 HydrophobicContact CD2-CB 3.86Å; L329-A387 HydrophobicContact CG-CB 4.47Å; L329-A387 WeakPolarHBondContact O-CB 3.28Å; L329-F388 HydrophobicContact CD1-CB 4.11Å; L329-F388 HydrophobicContact CD1-CD2 4.45Å; L329-F388 HydrophobicContact CD2-CB 4.2Å
330	L	95.6	Very high	92	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.9	-37.2	176.5	-72	175.2	0	0	0	112.7	V326 I327 R332 M333 G334 F335 C337 I363 V365 I380 V384	V326-L330 HydrophobicContact CG1-CD1 3.83Å; V326-L330 HydrophobicContact CG1-CG 4.3Å; V326-L330 WeakPolarHBondContact O-CB 3.24Å; V326-L330 WeakPolarHBondContact O-CG 3.18Å; V326-L330 PolarHBondContact O-N 3.34Å; I327-L330 PolarHBondContact O-N 3.42Å; L330-R332 PolarHBondContact O-N 2.73Å; L330-M333 CarbonylContact O-C 3.56Å; L330-M333 WeakPolarHBondContact O-CA 3.44Å; L330-M333 PolarHBondContact O-N 3.38Å; L330-G334 PolarHBondContact O-N 2.95Å; L330-F335 HydrophobicContact CB-CB 4.3Å; L330-F335 HydrophobicContact CB-CD2 4.2Å; L330-F335 HydrophobicContact CD2-CD2 3.75Å; L330-F335 HydrophobicContact CD2-CE2 4.13Å; L330-F335 WeakPolarHBondContact O-CD2 2.92Å; L330-F335 PolarHBondContact O-N 3.34Å; L330-F335 VanDerWaalsContact O-N 3.12Å; L330-C337 VanDerWaalsContact CB-SG 3.54Å; L330-C337 VanDerWaalsContact CD1-SG 3.55Å; L330-I363 HydrophobicContact CD1-CD1 3.68Å; L330-V365 HydrophobicContact CD1-CG2 3.91Å; L330-I380 HydrophobicContact CD1-CG2 4.03Å; L330-I380 HydrophobicContact CD2-CG2 3.6Å; L330-I380 HydrophobicContact CG-CG2 4.49Å; L330-V384 HydrophobicContact CD1-CG2 4.36Å; L330-V384 HydrophobicContact CD2-CG2 3.51Å; L330-V384 HydrophobicContact CG-CG2 3.73Å
331	N	94.1	Very high	90.6	Very high	58 Å²	58	46 Å²	46	31%	0.31	27%	0.266	S	S	.	.	H	α-helix	trans	-60.1	-37.3	173.7	-71.8	-23.9	0	0	0	111.5	I86 I327 N328 L329 M333 G334 F335	I86-N331 WeakPolarHBondContact CG2-O 3.45Å; I327-N331 WeakPolarHBondContact O-CB 3.34Å; I327-N331 PolarHBondContact O-N 3.22Å; I327-N331 PolarHBondContact O-ND2 3.22Å; I327-N331 VanDerWaalsContact O-ND2 3.17Å; I327-N331 PolarHBondContact O-OD1 2.96Å; N328-N331 PolarHBondContact O-N 2.78Å; L329-N331 PolarHBondContact O-N 2.88Å; N331-M333 PolarHBondContact O-N 3.39Å; N331-G334 PolarHBondContact O-N 3.03Å; N331-G334 VanDerWaalsContact O-N 3.12Å; N331-F335 WeakPolarHBondContact CA-O 3.45Å; N331-F335 PolarHBondContact OD1-O 2.98Å; N331-F335 VanDerWaalsContact OD1-O 3.14Å
332	R	94.9	Very high	88.7	Confident	60 Å²	60	49.3 Å²	49.3	23%	0.226	29%	0.291	C	S	.	.	H	α-helix	trans	-65.8	-24.2	174.5	-69.9	175.1	65.8	-150.7	-7.4	112.8	F87 N328 L329 L330 G334 A387	F87-R332 WeakPolarHBondContact CA-O 3.46Å; F87-R332 HydrophobicContact CD2-CB 4.41Å; F87-R332 VanDerWaalsContact CE1-NH2 3.26Å; F87-R332 PolarHBondContact N-O 2.99Å; F87-R332 PolarHBondContact O-NE 2.91Å; N328-R332 WeakPolarHBondContact O-CG 3.18Å; N328-R332 PolarHBondContact O-N 3.17Å; L329-R332 WeakPolarHBondContact O-CB 3.28Å; L329-R332 PolarHBondContact O-N 3.22Å; L330-R332 PolarHBondContact O-N 2.73Å; R332-G334 VanDerWaalsContact C-N 3.33Å; R332-A387 PolarHBondContact NH1-O 2.95Å
333	M	95.8	Very high	86.6	Confident	6 Å²	6	53.7 Å²	53.7	3%	0.03	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	5.7	174.3	-62.3	-54.8	-70.3	0	0	114.1	Y31 F87 L329 L330 N331 F335 D383 I386 A387	Y31-M333 HydrophobicContact CE2-CE 4.37Å; Y31-M333 HydrophobicContact CE2-SD 4.29Å; F87-M333 HydrophobicContact CD2-SD 3.93Å; F87-M333 HydrophobicContact CE2-SD 4.16Å; L329-M333 PolarHBondContact O-N 3.49Å; L330-M333 CarbonylContact O-C 3.56Å; L330-M333 WeakPolarHBondContact O-CA 3.44Å; L330-M333 PolarHBondContact O-N 3.38Å; N331-M333 PolarHBondContact O-N 3.39Å; M333-F335 HydrophobicContact CB-CD2 3.95Å; M333-F335 HydrophobicContact CB-CE2 3.84Å; M333-D383 HydrophobicContact CB-CB 4.14Å; M333-D383 HydrophobicContact CE-CB 4.36Å; M333-D383 HydrophobicContact CG-CB 3.94Å; M333-D383 WeakPolarHBondContact CG-O 3.27Å; M333-I386 HydrophobicContact CE-CB 4.2Å; M333-I386 HydrophobicContact CE-CG2 3.8Å; M333-I386 HydrophobicContact SD-CG2 4.12Å; M333-A387 HydrophobicContact CG-CB 3.8Å; M333-A387 HydrophobicContact SD-CB 4.13Å
334	G	93.9	Very high	84.5	Confident	12 Å²	12	58.5 Å²	58.5	12%	0.124	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.3	7.7	175.7	0	0	0	0	0	115.1	L330 N331 R332	L330-G334 PolarHBondContact O-N 2.95Å; N331-G334 PolarHBondContact O-N 3.03Å; N331-G334 VanDerWaalsContact O-N 3.12Å; R332-G334 VanDerWaalsContact C-N 3.33Å
335	F	95	Very high	82.3	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.314	C	S	.	.			trans	-85.8	158.4	174.7	-57.1	-66.9	0	0	0	112	L330 N331 M333 V365 I367 I374 D383	L330-F335 HydrophobicContact CB-CB 4.3Å; L330-F335 HydrophobicContact CB-CD2 4.2Å; L330-F335 HydrophobicContact CD2-CD2 3.75Å; L330-F335 HydrophobicContact CD2-CE2 4.13Å; L330-F335 WeakPolarHBondContact O-CD2 2.92Å; L330-F335 PolarHBondContact O-N 3.34Å; L330-F335 VanDerWaalsContact O-N 3.12Å; N331-F335 WeakPolarHBondContact CA-O 3.45Å; N331-F335 PolarHBondContact OD1-O 2.98Å; N331-F335 VanDerWaalsContact OD1-O 3.14Å; M333-F335 HydrophobicContact CB-CD2 3.95Å; M333-F335 HydrophobicContact CB-CE2 3.84Å; F335-V365 HydrophobicContact CB-CG1 3.74Å; F335-V365 HydrophobicContact CD1-CG1 3.9Å; F335-V365 HydrophobicContact CD2-CG1 4.44Å; F335-V365 HydrophobicContact CG-CG1 3.77Å; F335-I367 HydrophobicContact CD1-CG1 4.45Å; F335-I367 HydrophobicContact CE1-CG1 4.26Å; F335-I367 HydrophobicContact CE1-CG2 4.36Å; F335-I374 HydrophobicContact CE1-CG1 3.99Å; F335-I374 HydrophobicContact CZ-CD1 3.93Å; F335-I374 HydrophobicContact CZ-CG1 3.81Å; F335-D383 HydrophobicContact CE2-CB 3.88Å; F335-D383 WeakPolarHBondContact CE2-OD2 3.31Å; F335-D383 WeakPolarHBondContact CZ-OD2 3.45Å
336	T	91.8	Very high	79.9	Confident	72 Å²	72	60 Å²	60	44%	0.442	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	121.9	166	-60	0	0	0	0	108.4	S366	T336-S366 PolarHBondContact N-O 3.03Å; T336-S366 WeakPolarHBondContact O-CB 3.19Å; T336-S366 PolarHBondContact O-N 3.29Å
337	C	90.6	Very high	77.5	Confident	17 Å²	17	65.7 Å²	65.7	12%	0.115	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	143.2	-175.5	-53.6	0	0	0	0	111.7	I327 L330 S364	I327-C337 HydrophobicContact CB-CB 4.5Å; I327-C337 HydrophobicContact CG1-CB 3.96Å; I327-C337 HydrophobicContact CG2-CB 4.24Å; L330-C337 VanDerWaalsContact CB-SG 3.54Å; L330-C337 VanDerWaalsContact CD1-SG 3.55Å; C337-S364 CarbonylContact C-O 2.91Å; C337-S364 VanDerWaalsContact CA-O 3.3Å; C337-S364 WeakPolarHBondContact CA-O 3.06Å
338	T	85.9	Confident	75.2	Confident	95 Å²	95	68.7 Å²	68.7	58%	0.583	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129	138.7	172.8	-53.2	0	0	0	0	110.1	S364	T338-S364 PolarHBondContact N-O 3.39Å; T338-S364 PolarHBondContact O-N 2.8Å
339	S	82.6	Confident	72.9	Confident	71 Å²	71	68.5 Å²	68.5	50%	0.497	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	132	174.6	-168.3	0	0	0	0	110.7	E323	E323-S339 WeakPolarHBondContact OE1-CB 3.39Å; E323-S339 PolarHBondContact OE1-OG 3.18Å
340	V	77.6	Confident	70.4	Confident	28 Å²	28	69.6 Å²	69.6	17%	0.17	40%	0.399	C	S	.	.			trans	-104	118.6	178.3	-178.1	0	0	0	0	109.3	S342 Q344 L362	V340-S342 PolarHBondContact O-N 3.03Å; V340-Q344 HydrophobicContact CG1-CB 4.41Å; V340-L362 HydrophobicContact CB-CB 4.23Å; V340-L362 PolarHBondContact N-O 3.08Å
341	S	63.5	Low	67.9	Low	71 Å²	71	74.6 Å²	74.6	50%	0.497	43%	0.426	S	S	.	.			trans	-66.1	129.8	167.1	54.5	0	0	0	0	109.7	N343 Q344	S341-N343 PolarHBondContact O-N 3.02Å; S341-Q344 PolarHBondContact O-N 3.21Å
342	S	54.4	Low	65.7	Low	90 Å²	90	78.8 Å²	78.8	63%	0.629	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-48.9	-21.9	-175.9	47.9	0	0	0	0	115.9	V340 Q344	V340-S342 PolarHBondContact O-N 3.03Å; S342-Q344 VanDerWaalsContact C-N 3.32Å; S342-Q344 PolarHBondContact O-N 2.88Å
343	N	48.5	Very low	63.4	Low	147 Å²	147	79.8 Å²	79.8	79%	0.786	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-74.1	-12	178.9	-74.8	-11.5	0	0	0	115.3	S341	S341-N343 PolarHBondContact O-N 3.02Å
344	Q	47.3	Very low	61	Low	160 Å²	160	80.5 Å²	80.5	75%	0.748	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-91.4	-15.6	-178	-68.6	-159.7	38.7	0	0	114.6	V340 S341 S342 K346	V340-Q344 HydrophobicContact CG1-CB 4.41Å; S341-Q344 PolarHBondContact O-N 3.21Å; S342-Q344 VanDerWaalsContact C-N 3.32Å; S342-Q344 PolarHBondContact O-N 2.88Å; Q344-K346 PolarHBondContact O-N 3.15Å; Q344-K346 VanDerWaalsContact O-N 3.13Å
345	C	46	Very low	58.7	Low	42 Å²	42	83.1 Å²	83.1	28%	0.284	49%	0.488	S	S	.	.			trans	-86.9	83.4	177.2	-61.7	0	0	0	0	110.1	D347	C345-D347 VanDerWaalsContact C-N 3.28Å
346	K	43.9	Very low	56.1	Low	194 Å²	194	85.8 Å²	85.8	84%	0.843	52%	0.516	S	S	*	.			trans	-83.6	-5.8	166.7	-82.3	-174.1	177.5	178.1	0	113.2	Q344	Q344-K346 PolarHBondContact O-N 3.15Å; Q344-K346 VanDerWaalsContact O-N 3.13Å
347	D	43.1	Very low	53.8	Low	120 Å²	120	89.4 Å²	89.4	64%	0.642	53%	0.528	S	S	*	.	S	Bend	trans	-78.6	128.4	-178.1	-72.2	-25.1	0	0	0	111.2	C345 T349 S350	C345-D347 VanDerWaalsContact C-N 3.28Å; D347-T349 PolarHBondContact O-N 3.28Å; D347-S350 PolarHBondContact O-N 3.06Å; D347-S350 VanDerWaalsContact O-N 3.08Å; D347-S350 PolarHBondContact O-OG 3.25Å
348	S	44.8	Very low	51.6	Low	98 Å²	98	96.1 Å²	96.1	69%	0.685	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-1.7	176.5	-51.2	0	0	0	0	113.9	S350	S348-S350 VanDerWaalsContact C-N 3.29Å
349	T	45.3	Very low	49.9	Very low	85 Å²	85	92.6 Å²	92.6	52%	0.521	54%	0.543	S	S	.	.	H	α-helix	trans	-72.6	-22.4	170.9	48.9	0	0	0	0	112.5	D347 D351 I352 L353	D347-T349 PolarHBondContact O-N 3.28Å; T349-D351 VanDerWaalsContact C-N 3.33Å; T349-D351 PolarHBondContact O-N 3.03Å; T349-I352 PolarHBondContact O-N 2.94Å; T349-L353 PolarHBondContact O-N 3.34Å; T349-L353 VanDerWaalsContact O-N 3.1Å
350	S	43.3	Very low	49	Very low	36 Å²	36	93.7 Å²	93.7	25%	0.252	55%	0.547	S	S	.	.	H	α-helix	trans	-55.6	-47.6	171.6	54.2	0	0	0	0	111	D347 S348 I352 L353 T354	D347-S350 PolarHBondContact O-N 3.06Å; D347-S350 VanDerWaalsContact O-N 3.08Å; D347-S350 PolarHBondContact O-OG 3.25Å; S348-S350 VanDerWaalsContact C-N 3.29Å; S350-I352 VanDerWaalsContact C-N 3.26Å; S350-I352 PolarHBondContact O-N 3.19Å; S350-I352 VanDerWaalsContact O-N 3.16Å; S350-L353 PolarHBondContact O-N 3.04Å; S350-L353 VanDerWaalsContact O-N 3.13Å; S350-T354 VanDerWaalsContact O-CB 3.31Å; S350-T354 WeakPolarHBondContact O-CB 2.95Å; S350-T354 WeakPolarHBondContact O-CG2 3.4Å; S350-T354 PolarHBondContact O-N 2.99Å; S350-T354 PolarHBondContact O-OG1 3.29Å
351	D	43.6	Very low	49	Very low	104 Å²	104	93.7 Å²	93.7	56%	0.556	55%	0.552	S	S	*	*	H	α-helix	trans	-59.9	-32.9	-178.3	-72.8	-25.3	0	0	0	113.9	T349 G355 G356	T349-D351 VanDerWaalsContact C-N 3.33Å; T349-D351 PolarHBondContact O-N 3.03Å; D351-G355 PolarHBondContact O-N 3.46Å; D351-G355 VanDerWaalsContact O-N 3.12Å; D351-G356 PolarHBondContact O-N 2.86Å
352	I	47.4	Very low	50.2	Low	147 Å²	147	91.3 Å²	91.3	75%	0.754	53%	0.533	S	S	*	.	H	α-helix	trans	-77	-40.7	178.6	-57.1	177.5	0	0	0	110.8	T349 S350	T349-I352 PolarHBondContact O-N 2.94Å; S350-I352 VanDerWaalsContact C-N 3.26Å; S350-I352 PolarHBondContact O-N 3.19Å; S350-I352 VanDerWaalsContact O-N 3.16Å
353	L	47.1	Very low	52	Low	80 Å²	80	87 Å²	87	42%	0.419	50%	0.503	S	S	.	.	H	α-helix	trans	-75.3	-27.2	178.9	-69.5	170.5	0	0	0	112.5	T349 S350	T349-L353 PolarHBondContact O-N 3.34Å; T349-L353 VanDerWaalsContact O-N 3.1Å; S350-L353 PolarHBondContact O-N 3.04Å; S350-L353 VanDerWaalsContact O-N 3.13Å
354	T	46.3	Very low	54.1	Low	21 Å²	21	81 Å²	81	13%	0.129	47%	0.473	C	S	.	.	H	α-helix	trans	-105.9	-1.8	-173.2	73.1	0	0	0	0	113.9	S350 G356 Q357 A359	S350-T354 VanDerWaalsContact O-CB 3.31Å; S350-T354 WeakPolarHBondContact O-CB 2.95Å; S350-T354 WeakPolarHBondContact O-CG2 3.4Å; S350-T354 PolarHBondContact O-N 2.99Å; S350-T354 PolarHBondContact O-OG1 3.29Å; T354-G356 PolarHBondContact O-N 3.35Å; T354-Q357 VanDerWaalsContact CB-O 3.27Å; T354-Q357 WeakPolarHBondContact CB-O 3.5Å; T354-Q357 PolarHBondContact O-N 2.97Å; T354-Q357 PolarHBondContact OG1-O 3.03Å; T354-Q357 VanDerWaalsContact OG1-O 3.06Å; T354-A359 HydrophobicContact CG2-CB 3.41Å; T354-A359 VanDerWaalsContact CG2-CB 3.41Å
355	G	44.2	Very low	56.4	Low	68 Å²	68	73.4 Å²	73.4	70%	0.701	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	30.5	-178.4	0	0	0	0	0	112.8	D351 Q357	D351-G355 PolarHBondContact O-N 3.46Å; D351-G355 VanDerWaalsContact O-N 3.12Å; G355-Q357 VanDerWaalsContact C-N 3.31Å; G355-Q357 PolarHBondContact O-N 2.83Å
356	G	41.2	Very low	58.7	Low	56 Å²	56	72.6 Å²	72.6	58%	0.577	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	14.4	-176.9	0	0	0	0	0	115.3	D351 T354	D351-G356 PolarHBondContact O-N 2.86Å; T354-G356 PolarHBondContact O-N 3.35Å
357	Q	44.3	Very low	61.2	Low	148 Å²	148	63.4 Å²	63.4	69%	0.692	39%	0.393	S	S	*	.	S	Bend	trans	-95.6	144.5	172.2	-60.1	-163.9	5.3	0	0	111	T354 G355 A359	T354-Q357 VanDerWaalsContact CB-O 3.27Å; T354-Q357 WeakPolarHBondContact CB-O 3.5Å; T354-Q357 PolarHBondContact O-N 2.97Å; T354-Q357 PolarHBondContact OG1-O 3.03Å; T354-Q357 VanDerWaalsContact OG1-O 3.06Å; G355-Q357 VanDerWaalsContact C-N 3.31Å; G355-Q357 PolarHBondContact O-N 2.83Å; Q357-A359 PolarHBondContact O-N 3.09Å
358	N	43	Very low	63.7	Low	157 Å²	157	58.1 Å²	58.1	84%	0.84	37%	0.365	S	S	*	.			trans	-55.4	101.6	168.5	-79.1	-27.7	0	0	0	107.9	T360	N358-T360 PolarHBondContact O-N 3.19Å
359	A	51.6	Low	66.2	Low	21 Å²	21	53.7 Å²	53.7	17%	0.174	33%	0.334	C	S	.	.			trans	-69	98.9	176.1	0	0	0	0	0	108.8	T354 Q357 L362	T354-A359 HydrophobicContact CG2-CB 3.41Å; T354-A359 VanDerWaalsContact CG2-CB 3.41Å; Q357-A359 PolarHBondContact O-N 3.09Å; A359-L362 HydrophobicContact CB-CD1 4.22Å; A359-L362 HydrophobicContact CB-CD2 3.58Å; A359-L362 HydrophobicContact CB-CG 3.81Å
360	T	62.9	Low	68.5	Low	95 Å²	95	50.6 Å²	50.6	58%	0.583	32%	0.315	S	S	*	.	S	Bend	trans	-70.9	135.7	163.9	41.5	0	0	0	0	108.5	D311 N358	D311-T360 PolarHBondContact OD2-OG1 3.48Å; N358-T360 PolarHBondContact O-N 3.19Å
361	G	77.4	Confident	71	Confident	27 Å²	27	49 Å²	49	28%	0.278	30%	0.303	S	S	.	.	S	Bend	trans	72.4	54.3	175.4	0	0	0	0	0	114.6	I310	I310-G361 WeakPolarHBondContact CD1-O 3.39Å; I310-G361 VanDerWaalsContact CG1-O 3.3Å; I310-G361 WeakPolarHBondContact CG1-O 3.31Å; I310-G361 PolarHBondContact N-O 3.44Å; I310-G361 VanDerWaalsContact N-O 3.08Å
362	L	88.6	Confident	73.3	Confident	21 Å²	21	45.8 Å²	45.8	11%	0.11	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	130.5	169	-69.7	172.6	0	0	0	110.2	V307 V340 A359	V307-L362 HydrophobicContact CG1-CB 4.25Å; V307-L362 HydrophobicContact CG1-CD2 4.03Å; V340-L362 HydrophobicContact CB-CB 4.23Å; V340-L362 PolarHBondContact N-O 3.08Å; A359-L362 HydrophobicContact CB-CD1 4.22Å; A359-L362 HydrophobicContact CB-CD2 3.58Å; A359-L362 HydrophobicContact CB-CG 3.81Å
363	I	91.8	Very high	75.6	Confident	0 Å²	0	40 Å²	40	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	137	173	60.5	172.9	0	0	0	109.1	V307 V308 I310 I313 E323 V326 L330 V365	V307-I363 WeakPolarHBondContact CA-O 3.35Å; V308-I363 HydrophobicContact CG1-CD1 3.9Å; V308-I363 HydrophobicContact CG1-CG1 3.55Å; V308-I363 PolarHBondContact N-O 2.8Å; V308-I363 WeakPolarHBondContact O-CG1 3.46Å; V308-I363 PolarHBondContact O-N 3.16Å; I310-I363 HydrophobicContact CD1-CG2 4.32Å; I310-I363 HydrophobicContact CG1-CG2 4.44Å; I313-I363 HydrophobicContact CD1-CD1 4.37Å; E323-I363 HydrophobicContact CG-CG2 4.08Å; V326-I363 HydrophobicContact CG1-CD1 3.67Å; L330-I363 HydrophobicContact CD1-CD1 3.68Å; I363-V365 HydrophobicContact CD1-CG2 4.11Å; I363-V365 HydrophobicContact CG1-CG2 4.18Å
364	S	93.6	Very high	77.9	Confident	22 Å²	22	36.2 Å²	36.2	15%	0.154	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	123.4	168.2	-175.3	0	0	0	0	108.1	C337 T338	C337-S364 CarbonylContact C-O 2.91Å; C337-S364 VanDerWaalsContact CA-O 3.3Å; C337-S364 WeakPolarHBondContact CA-O 3.06Å; T338-S364 PolarHBondContact N-O 3.39Å; T338-S364 PolarHBondContact O-N 2.8Å
365	V	95.1	Very high	80.1	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	115.3	-178.7	-175.8	0	0	0	0	108	D305 E306 V308 L330 F335 I363 I367 I380	D305-V365 WeakPolarHBondContact CA-O 3.34Å; E306-V365 PolarHBondContact N-O 3.05Å; E306-V365 PolarHBondContact O-N 3.11Å; V308-V365 HydrophobicContact CG1-CG2 3.92Å; L330-V365 HydrophobicContact CD1-CG2 3.91Å; F335-V365 HydrophobicContact CB-CG1 3.74Å; F335-V365 HydrophobicContact CD1-CG1 3.9Å; F335-V365 HydrophobicContact CD2-CG1 4.44Å; F335-V365 HydrophobicContact CG-CG1 3.77Å; I363-V365 HydrophobicContact CD1-CG2 4.11Å; I363-V365 HydrophobicContact CG1-CG2 4.18Å; V365-I367 PolarHBondContact O-N 2.95Å; V365-I380 HydrophobicContact CB-CD1 4.04Å; V365-I380 HydrophobicContact CG1-CD1 4.25Å; V365-I380 HydrophobicContact CG2-CD1 4.22Å; V365-I380 HydrophobicContact CG2-CG2 4.21Å
366	S	95.3	Very high	82.4	Confident	25 Å²	25	42.3 Å²	42.3	18%	0.175	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	110.8	177	-153.8	0	0	0	0	109.7	D305 T336	D305-S366 WeakPolarHBondContact OD1-CA 3.46Å; D305-S366 WeakPolarHBondContact OD1-CB 3.46Å; D305-S366 PolarHBondContact OD1-OG 2.88Å; T336-S366 PolarHBondContact N-O 3.03Å; T336-S366 WeakPolarHBondContact O-CB 3.19Å; T336-S366 PolarHBondContact O-N 3.29Å
367	I	96.2	Very high	84.8	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	120.2	-176.3	-59.4	161.6	0	0	0	108.7	Y303 R304 E306 F335 V365 R371 I374	Y303-I367 WeakPolarHBondContact CA-O 3.47Å; R304-I367 HydrophobicContact CB-CB 4.35Å; R304-I367 HydrophobicContact CB-CD1 4.47Å; R304-I367 PolarHBondContact N-O 3.19Å; R304-I367 VanDerWaalsContact N-O 3.14Å; R304-I367 WeakPolarHBondContact O-CB 3.3Å; R304-I367 PolarHBondContact O-N 3.49Å; E306-I367 HydrophobicContact CB-CD1 3.94Å; E306-I367 HydrophobicContact CG-CD1 3.44Å; E306-I367 VanDerWaalsContact CG-CD1 3.44Å; F335-I367 HydrophobicContact CD1-CG1 4.45Å; F335-I367 HydrophobicContact CE1-CG1 4.26Å; F335-I367 HydrophobicContact CE1-CG2 4.36Å; V365-I367 PolarHBondContact O-N 2.95Å; I367-R371 HydrophobicContact CG2-CB 3.9Å; I367-R371 WeakPolarHBondContact CG2-O 3.27Å; I367-I374 HydrophobicContact CD1-CB 4.07Å; I367-I374 HydrophobicContact CD1-CG2 3.41Å; I367-I374 VanDerWaalsContact CD1-CG2 3.41Å; I367-I374 HydrophobicContact CG1-CB 4.46Å; I367-I374 HydrophobicContact CG1-CG2 4.01Å; I367-I374 HydrophobicContact CG2-CB 4.1Å; I367-I374 HydrophobicContact CG2-CG1 4.4Å
368	P	96	Very high	87.2	Confident	9 Å²	9	35.9 Å²	35.9	6%	0.058	21%	0.209	C	C	.	.			trans	-70.6	156.3	-179.9	30.4	-35.7	0	0	0	111.7	Y303 T370 R371	Y303-P368 HydrophobicContact CD1-CB 4.42Å; Y303-P368 HydrophobicContact CE1-CB 3.8Å; P368-T370 WeakPolarHBondContact CG-OG1 3.38Å; P368-T370 PolarHBondContact O-N 3.19Å; P368-R371 HydrophobicContact CG-CB 4.15Å; P368-R371 HydrophobicContact CG-CG 3.82Å; P368-R371 PolarHBondContact O-N 2.97Å
369	P	95.3	Very high	89.7	Confident	5 Å²	5	29.8 Å²	29.8	3%	0.032	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-9	177.1	26.9	-35.9	0	0	0	113.5	F96 T271 L301 Y303 R371 H372	F96-P369 HydrophobicContact CB-CG 3.97Å; F96-P369 HydrophobicContact CD2-CG 3.92Å; F96-P369 HydrophobicContact CG-CG 4.19Å; T271-P369 HydrophobicContact CG2-CB 4.41Å; T271-P369 HydrophobicContact CG2-CG 4.05Å; L301-P369 HydrophobicContact CB-CB 4.45Å; L301-P369 HydrophobicContact CB-CG 4.19Å; L301-P369 HydrophobicContact CD2-CB 4.2Å; L301-P369 HydrophobicContact CD2-CG 4.25Å; Y303-P369 HydrophobicContact CE2-CG 4.24Å; P369-R371 VanDerWaalsContact C-N 3.32Å; P369-H372 PolarHBondContact O-CD2 3.36Å; P369-H372 VanDerWaalsContact O-CD2 3.31Å; P369-H372 PolarHBondContact O-NE2 3.22Å
370	T	94.6	Very high	91.9	Very high	19 Å²	19	28.8 Å²	28.8	12%	0.117	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-19.5	171.1	53.4	0	0	0	0	113.3	F96 T271 M272 P368	F96-T370 HydrophobicContact CD2-CG2 4.41Å; F96-T370 HydrophobicContact CE2-CG2 3.55Å; F96-T370 HydrophobicContact CZ-CG2 3.77Å; T271-T370 VanDerWaalsContact CB-CG2 3.49Å; T271-T370 HydrophobicContact CG2-CG2 3.88Å; T271-T370 WeakPolarHBondContact OG1-CG2 3.49Å; M272-T370 HydrophobicContact CE-CG2 3.67Å; P368-T370 WeakPolarHBondContact CG-OG1 3.38Å; P368-T370 PolarHBondContact O-N 3.19Å
371	R	95.2	Very high	93.4	Very high	4 Å²	4	24.4 Å²	24.4	2%	0.015	14%	0.142	C	C	.	.			trans	-110.3	67.9	-171	-68.6	-62.3	-58.7	-83.3	7.3	111.8	R304 I367 P368 P369 D373 I374 D383	R304-R371 PolarHBondContact NH2-O 3.24Å; I367-R371 HydrophobicContact CG2-CB 3.9Å; I367-R371 WeakPolarHBondContact CG2-O 3.27Å; P368-R371 HydrophobicContact CG-CB 4.15Å; P368-R371 HydrophobicContact CG-CG 3.82Å; P368-R371 PolarHBondContact O-N 2.97Å; P369-R371 VanDerWaalsContact C-N 3.32Å; R371-D373 VanDerWaalsContact CA-OD1 3.3Å; R371-D373 WeakPolarHBondContact CA-OD1 3.19Å; R371-D373 WeakPolarHBondContact CD-OD1 3.37Å; R371-D373 IonicContact CZ-OD1 2.79Å; R371-D373 IonicContact CZ-OD2 3.19Å; R371-D373 IonicContact NE-OD1 3.25Å; R371-D373 PolarHBondContact NE-OD1 3.13Å; R371-D373 IonicContact NE-OD2 2.94Å; R371-D373 PolarHBondContact NE-OD2 3.16Å; R371-D373 VanDerWaalsContact NE-OD2 3.15Å; R371-D373 IonicContact NH2-OD1 3.7Å; R371-D373 IonicContact NH2-OD2 3.36Å; R371-D373 PolarHBondContact NH2-OD2 3.38Å; R371-D373 PolarHBondContact O-N 3Å; R371-I374 HydrophobicContact CB-CG1 4.24Å; R371-I374 VanDerWaalsContact NH2-CD1 3.34Å; R371-D383 IonicContact CZ-OD2 3.1Å; R371-D383 IonicContact NH1-OD2 2.68Å; R371-D383 PolarHBondContact NH1-OD2 3.45Å; R371-D383 IonicContact NH2-OD1 2.83Å; R371-D383 PolarHBondContact NH2-OD1 3.07Å; R371-D383 IonicContact NH2-OD2 3.91Å; R371-D383 PolarHBondContact NH2-OD2 2.91Å
372	H	92.8	Very high	94.3	Very high	35 Å²	35	27.5 Å²	27.5	16%	0.162	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-10.4	175	-65.7	-76.1	0	0	0	113.6	V264 D267 P369	V264-H372 HydrophobicContact CG1-CB 4.22Å; V264-H372 HydrophobicContact CG2-CB 4.16Å; D267-H372 IonicContact OD2-CE1 2.77Å; D267-H372 PolarHBondContact OD2-CE1 3.44Å; D267-H372 IonicContact OD2-NE2 2.73Å; P369-H372 PolarHBondContact O-CD2 3.36Å; P369-H372 VanDerWaalsContact O-CD2 3.31Å; P369-H372 PolarHBondContact O-NE2 3.22Å
373	D	94.8	Very high	94.7	Very high	26 Å²	26	26.7 Å²	26.7	14%	0.139	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-25.4	176.3	58.6	-55.9	0	0	0	113.6	N70 R71 R371 L375	N70-D373 HydrophobicContact CB-CB 3.9Å; R71-D373 VanDerWaalsContact CD-OD2 3.25Å; R71-D373 WeakPolarHBondContact CD-OD2 3.17Å; R371-D373 VanDerWaalsContact CA-OD1 3.3Å; R371-D373 WeakPolarHBondContact CA-OD1 3.19Å; R371-D373 WeakPolarHBondContact CD-OD1 3.37Å; R371-D373 IonicContact CZ-OD1 2.79Å; R371-D373 IonicContact CZ-OD2 3.19Å; R371-D373 IonicContact NE-OD1 3.25Å; R371-D373 PolarHBondContact NE-OD1 3.13Å; R371-D373 IonicContact NE-OD2 2.94Å; R371-D373 PolarHBondContact NE-OD2 3.16Å; R371-D373 VanDerWaalsContact NE-OD2 3.15Å; R371-D373 IonicContact NH2-OD1 3.7Å; R371-D373 IonicContact NH2-OD2 3.36Å; R371-D373 PolarHBondContact NH2-OD2 3.38Å; R371-D373 PolarHBondContact O-N 3Å; D373-L375 PolarHBondContact O-N 3.35Å
374	I	95.3	Very high	94.9	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	15%	0.145	C	C	.	.			trans	-76.2	112.8	176.5	-55.1	-61.2	0	0	0	109.1	R304 F335 I367 R371 D379 I380	R304-I374 PolarHBondContact NH1-O 3.06Å; R304-I374 PolarHBondContact NH2-O 2.86Å; F335-I374 HydrophobicContact CE1-CG1 3.99Å; F335-I374 HydrophobicContact CZ-CD1 3.93Å; F335-I374 HydrophobicContact CZ-CG1 3.81Å; I367-I374 HydrophobicContact CD1-CB 4.07Å; I367-I374 HydrophobicContact CD1-CG2 3.41Å; I367-I374 VanDerWaalsContact CD1-CG2 3.41Å; I367-I374 HydrophobicContact CG1-CB 4.46Å; I367-I374 HydrophobicContact CG1-CG2 4.01Å; I367-I374 HydrophobicContact CG2-CB 4.1Å; I367-I374 HydrophobicContact CG2-CG1 4.4Å; R371-I374 HydrophobicContact CB-CG1 4.24Å; R371-I374 VanDerWaalsContact NH2-CD1 3.34Å; I374-D379 HydrophobicContact CD1-CB 3.54Å; I374-D379 HydrophobicContact CG2-CB 4.3Å; I374-I380 HydrophobicContact CG2-CG1 3.99Å
375	L	92.5	Very high	95	Very high	97 Å²	97	25.7 Å²	25.7	51%	0.508	14%	0.138	S	C	.	.			trans	-114	-30.3	179.2	-57.7	-178.8	0	0	0	111.7	D373 D379	D373-L375 PolarHBondContact O-N 3.35Å; L375-D379 PolarHBondContact N-OD2 3.16Å
376	H	92.6	Very high	95	Very high	119 Å²	119	26.8 Å²	26.8	55%	0.551	14%	0.143	S	C	*	.	S	Bend	trans	-144.8	166.7	-169.7	-60.1	-44.2	0	0	0	112.7	C378 D379	H376-C378 PolarHBondContact O-N 3.44Å; H376-C378 VanDerWaalsContact O-N 3.16Å; H376-D379 PolarHBondContact N-OD2 2.81Å; H376-D379 PolarHBondContact O-N 2.96Å; H376-D379 VanDerWaalsContact O-N 3.08Å
377	A	92.6	Very high	95	Very high	13 Å²	13	25.7 Å²	25.7	11%	0.107	14%	0.136	C	C	.	.	H	α-helix	trans	-59.5	-24.7	176.2	0	0	0	0	0	114.1	V308 Y312 D379 I380 A381	V308-A377 HydrophobicContact CB-CB 4.32Å; V308-A377 HydrophobicContact CG2-CB 3.91Å; Y312-A377 HydrophobicContact CE1-CB 4.12Å; A377-D379 VanDerWaalsContact C-N 3.35Å; A377-I380 PolarHBondContact O-N 3.08Å; A377-A381 PolarHBondContact O-N 2.94Å; A377-A381 VanDerWaalsContact O-N 3.09Å
378	C	94.6	Very high	94.9	Very high	56 Å²	56	28.4 Å²	28.4	38%	0.378	15%	0.148	S	C	.	.	H	α-helix	trans	-67.4	-34.6	175.3	57.4	0	0	0	0	112.5	H376 I380 A381 E382	H376-C378 PolarHBondContact O-N 3.44Å; H376-C378 VanDerWaalsContact O-N 3.16Å; C378-I380 VanDerWaalsContact C-N 3.29Å; C378-I380 PolarHBondContact O-N 3.28Å; C378-A381 WeakPolarHBondContact O-CB 3.45Å; C378-A381 PolarHBondContact O-N 2.87Å; C378-E382 PolarHBondContact O-N 3.07Å
379	D	95.8	Very high	94.8	Very high	30 Å²	30	28.9 Å²	28.9	16%	0.16	15%	0.154	C	C	.	.	H	α-helix	trans	-70.9	-32	179.4	-43.6	-42.7	0	0	0	110.3	I374 L375 H376 A377 E382 D383	I374-D379 HydrophobicContact CD1-CB 3.54Å; I374-D379 HydrophobicContact CG2-CB 4.3Å; L375-D379 PolarHBondContact N-OD2 3.16Å; H376-D379 PolarHBondContact N-OD2 2.81Å; H376-D379 PolarHBondContact O-N 2.96Å; H376-D379 VanDerWaalsContact O-N 3.08Å; A377-D379 VanDerWaalsContact C-N 3.35Å; D379-E382 WeakPolarHBondContact O-CB 3.17Å; D379-E382 PolarHBondContact O-N 3.31Å; D379-D383 PolarHBondContact O-N 2.94Å
380	I	96.5	Very high	94.5	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66.7	-42.9	171.2	-60.1	174.4	0	0	0	110.3	E306 V308 L330 V365 I374 A377 C378 E382 D383 V384	E306-I380 HydrophobicContact CB-CD1 3.87Å; V308-I380 HydrophobicContact CG1-CD1 4.49Å; V308-I380 HydrophobicContact CG1-CG2 4.14Å; L330-I380 HydrophobicContact CD1-CG2 4.03Å; L330-I380 HydrophobicContact CD2-CG2 3.6Å; L330-I380 HydrophobicContact CG-CG2 4.49Å; V365-I380 HydrophobicContact CB-CD1 4.04Å; V365-I380 HydrophobicContact CG1-CD1 4.25Å; V365-I380 HydrophobicContact CG2-CD1 4.22Å; V365-I380 HydrophobicContact CG2-CG2 4.21Å; I374-I380 HydrophobicContact CG2-CG1 3.99Å; A377-I380 PolarHBondContact O-N 3.08Å; C378-I380 VanDerWaalsContact C-N 3.29Å; C378-I380 PolarHBondContact O-N 3.28Å; I380-E382 VanDerWaalsContact C-N 3.34Å; I380-D383 PolarHBondContact O-N 2.87Å; I380-V384 WeakPolarHBondContact O-CG2 3.23Å; I380-V384 PolarHBondContact O-N 3.02Å
381	A	95.9	Very high	94.2	Very high	3 Å²	3	39.9 Å²	39.9	3%	0.025	20%	0.204	C	C	.	.	H	α-helix	trans	-65.3	-37.7	176	0	0	0	0	0	112	Y312 I313 Q316 A377 C378 V384 G385	Y312-A381 HydrophobicContact CE1-CB 4.33Å; I313-A381 HydrophobicContact CG1-CB 4.2Å; I313-A381 HydrophobicContact CG2-CB 4.48Å; Q316-A381 HydrophobicContact CB-CB 4.49Å; A377-A381 PolarHBondContact O-N 2.94Å; A377-A381 VanDerWaalsContact O-N 3.09Å; C378-A381 WeakPolarHBondContact O-CB 3.45Å; C378-A381 PolarHBondContact O-N 2.87Å; A381-V384 PolarHBondContact O-N 3.41Å; A381-G385 PolarHBondContact O-N 2.92Å
382	E	95.7	Very high	94.1	Very high	91 Å²	91	44.9 Å²	44.9	43%	0.425	23%	0.231	S	C	.	.	H	α-helix	trans	-56.8	-50.3	171.8	-175.1	-175.4	162.7	0	0	110.7	C378 D379 I380 V384 G385 I386 Y390	C378-E382 PolarHBondContact O-N 3.07Å; D379-E382 WeakPolarHBondContact O-CB 3.17Å; D379-E382 PolarHBondContact O-N 3.31Å; I380-E382 VanDerWaalsContact C-N 3.34Å; E382-V384 VanDerWaalsContact C-N 3.32Å; E382-V384 PolarHBondContact O-N 3.5Å; E382-G385 CarbonylContact O-C 3.44Å; E382-G385 WeakPolarHBondContact O-CA 3.44Å; E382-G385 PolarHBondContact O-N 3.11Å; E382-I386 HydrophobicContact CG-CD1 4.14Å; E382-I386 WeakPolarHBondContact O-CG1 3.28Å; E382-I386 PolarHBondContact O-N 2.95Å; E382-Y390 WeakPolarHBondContact CG-OH 3.28Å
383	D	95.9	Very high	94	Very high	5 Å²	5	45 Å²	45	3%	0.027	23%	0.232	C	C	.	.	H	α-helix	trans	-63.5	-33	178.7	-90.4	7.7	0	0	0	113.2	M333 F335 R371 D379 I380 G385 I386 A387	M333-D383 HydrophobicContact CB-CB 4.14Å; M333-D383 HydrophobicContact CE-CB 4.36Å; M333-D383 HydrophobicContact CG-CB 3.94Å; M333-D383 WeakPolarHBondContact CG-O 3.27Å; F335-D383 HydrophobicContact CE2-CB 3.88Å; F335-D383 WeakPolarHBondContact CE2-OD2 3.31Å; F335-D383 WeakPolarHBondContact CZ-OD2 3.45Å; R371-D383 IonicContact CZ-OD2 3.1Å; R371-D383 IonicContact NH1-OD2 2.68Å; R371-D383 PolarHBondContact NH1-OD2 3.45Å; R371-D383 IonicContact NH2-OD1 2.83Å; R371-D383 PolarHBondContact NH2-OD1 3.07Å; R371-D383 IonicContact NH2-OD2 3.91Å; R371-D383 PolarHBondContact NH2-OD2 2.91Å; D379-D383 PolarHBondContact O-N 2.94Å; I380-D383 PolarHBondContact O-N 2.87Å; D383-G385 VanDerWaalsContact C-N 3.34Å; D383-I386 PolarHBondContact O-N 3.07Å; D383-A387 WeakPolarHBondContact O-CB 3.43Å; D383-A387 PolarHBondContact O-N 2.99Å
384	V	96.8	Very high	93.5	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.8	-43.6	169.5	175.4	0	0	0	0	110.7	I313 L317 F321 V326 L329 L330 I380 A381 E382 A387 F388	I313-V384 HydrophobicContact CD1-CG2 4.43Å; I313-V384 HydrophobicContact CG2-CB 4.11Å; I313-V384 HydrophobicContact CG2-CG1 3.94Å; I313-V384 HydrophobicContact CG2-CG2 4.14Å; L317-V384 HydrophobicContact CD1-CB 3.99Å; L317-V384 HydrophobicContact CD1-CG1 3.66Å; F321-V384 HydrophobicContact CD2-CG1 4.27Å; F321-V384 HydrophobicContact CE2-CG1 4.25Å; V326-V384 HydrophobicContact CG1-CG2 4.15Å; L329-V384 HydrophobicContact CB-CG1 4.36Å; L329-V384 HydrophobicContact CD1-CG1 3.8Å; L330-V384 HydrophobicContact CD1-CG2 4.36Å; L330-V384 HydrophobicContact CD2-CG2 3.51Å; L330-V384 HydrophobicContact CG-CG2 3.73Å; I380-V384 WeakPolarHBondContact O-CG2 3.23Å; I380-V384 PolarHBondContact O-N 3.02Å; A381-V384 PolarHBondContact O-N 3.41Å; E382-V384 VanDerWaalsContact C-N 3.32Å; E382-V384 PolarHBondContact O-N 3.5Å; V384-A387 PolarHBondContact O-N 2.64Å; V384-F388 VanDerWaalsContact O-CB 3.29Å; V384-F388 WeakPolarHBondContact O-CB 3.25Å; V384-F388 PolarHBondContact O-N 3.09Å
385	G	95.2	Very high	93.2	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-60.1	-46.2	175.9	0	0	0	0	0	112.3	A381 E382 D383 F388 G389	A381-G385 PolarHBondContact O-N 2.92Å; E382-G385 CarbonylContact O-C 3.44Å; E382-G385 WeakPolarHBondContact O-CA 3.44Å; E382-G385 PolarHBondContact O-N 3.11Å; D383-G385 VanDerWaalsContact C-N 3.34Å; G385-F388 PolarHBondContact O-N 3.45Å; G385-G389 CarbonylContact O-C 3.59Å; G385-G389 PolarHBondContact O-N 3.38Å
386	I	94.4	Very high	92.6	Very high	23 Å²	23	57.3 Å²	57.3	12%	0.118	30%	0.304	C	S	.	.	H	α-helix	trans	-60.7	-50	175.9	-65.6	168.8	0	0	0	110.6	Y31 M333 E382 D383 F388 G389 Y390	Y31-I386 WeakPolarHBondContact O-CG2 3.23Å; M333-I386 HydrophobicContact CE-CB 4.2Å; M333-I386 HydrophobicContact CE-CG2 3.8Å; M333-I386 HydrophobicContact SD-CG2 4.12Å; E382-I386 HydrophobicContact CG-CD1 4.14Å; E382-I386 WeakPolarHBondContact O-CG1 3.28Å; E382-I386 PolarHBondContact O-N 2.95Å; D383-I386 PolarHBondContact O-N 3.07Å; I386-F388 VanDerWaalsContact C-N 3.26Å; I386-F388 PolarHBondContact O-N 3.27Å; I386-G389 PolarHBondContact O-N 2.81Å; I386-Y390 HydrophobicContact CG1-CE2 3.79Å
387	A	95.5	Very high	92	Very high	2 Å²	2	59 Å²	59	2%	0.017	32%	0.317	C	S	.	.	H	α-helix	trans	-60.7	-35.9	179.8	0	0	0	0	0	113.6	L329 R332 M333 D383 V384	L329-A387 HydrophobicContact CB-CB 3.89Å; L329-A387 HydrophobicContact CD2-CB 3.86Å; L329-A387 HydrophobicContact CG-CB 4.47Å; L329-A387 WeakPolarHBondContact O-CB 3.28Å; R332-A387 PolarHBondContact NH1-O 2.95Å; M333-A387 HydrophobicContact CG-CB 3.8Å; M333-A387 HydrophobicContact SD-CB 4.13Å; D383-A387 WeakPolarHBondContact O-CB 3.43Å; D383-A387 PolarHBondContact O-N 2.99Å; V384-A387 PolarHBondContact O-N 2.64Å
388	F	95.1	Very high	91.2	Very high	58 Å²	58	62.7 Å²	62.7	25%	0.254	34%	0.34	S	S	.	.	H	α-helix	trans	-75.5	-31.1	176.5	-177.3	-115	0	0	0	111.9	F321 L329 V384 G385 I386 N392 I393	F321-F388 AromaticContact CE1-CD2 3.73Å; F321-F388 HydrophobicContact CE1-CD2 3.73Å; F321-F388 HydrophobicContact CE1-CE1 4.39Å; F321-F388 AromaticContact CE1-CE2 3.57Å; F321-F388 HydrophobicContact CE1-CE2 3.57Å; F321-F388 HydrophobicContact CE1-CG 4.24Å; F321-F388 AromaticContact CE1-CZ 3.92Å; F321-F388 HydrophobicContact CE1-CZ 3.92Å; F321-F388 HydrophobicContact CE2-CD1 4.49Å; F321-F388 HydrophobicContact CE2-CG 4.34Å; F321-F388 HydrophobicContact CZ-CB 4.23Å; F321-F388 AromaticContact CZ-CD1 3.68Å; F321-F388 HydrophobicContact CZ-CD1 3.68Å; F321-F388 AromaticContact CZ-CD2 3.5Å; F321-F388 HydrophobicContact CZ-CD2 3.5Å; F321-F388 VanDerWaalsContact CZ-CD2 3.5Å; F321-F388 AromaticContact CZ-CE1 3.76Å; F321-F388 HydrophobicContact CZ-CE1 3.76Å; F321-F388 AromaticContact CZ-CE2 3.64Å; F321-F388 HydrophobicContact CZ-CE2 3.64Å; F321-F388 AromaticContact CZ-CG 3.52Å; F321-F388 HydrophobicContact CZ-CG 3.52Å; F321-F388 AromaticContact CZ-CZ 3.76Å; F321-F388 HydrophobicContact CZ-CZ 3.76Å; L329-F388 HydrophobicContact CD1-CB 4.11Å; L329-F388 HydrophobicContact CD1-CD2 4.45Å; L329-F388 HydrophobicContact CD2-CB 4.2Å; V384-F388 VanDerWaalsContact O-CB 3.29Å; V384-F388 WeakPolarHBondContact O-CB 3.25Å; V384-F388 PolarHBondContact O-N 3.09Å; G385-F388 PolarHBondContact O-N 3.45Å; I386-F388 VanDerWaalsContact C-N 3.26Å; I386-F388 PolarHBondContact O-N 3.27Å; F388-N392 HydrophobicContact CD1-CB 3.89Å; F388-N392 VanDerWaalsContact CE1-C 3.4Å; F388-N392 HydrophobicContact CE1-CB 3.44Å; F388-N392 VanDerWaalsContact CE1-CB 3.44Å; F388-N392 VanDerWaalsContact CE1-O 3.3Å; F388-N392 WeakPolarHBondContact CE1-O 3.18Å; F388-N392 HydrophobicContact CE2-CB 4.34Å; F388-N392 HydrophobicContact CZ-CB 3.68Å; F388-N392 PolarHBondContact O-ND2 3.21Å; F388-I393 HydrophobicContact CD1-CG1 3.81Å; F388-I393 HydrophobicContact CE1-CG1 4.02Å
389	G	93	Very high	90.1	Very high	19 Å²	19	68.7 Å²	68.7	20%	0.196	36%	0.362	C	S	.	.			trans	89.9	120.2	-171.6	0	0	0	0	0	110.4	G385 I386 D391 N392	G385-G389 CarbonylContact O-C 3.59Å; G385-G389 PolarHBondContact O-N 3.38Å; I386-G389 PolarHBondContact O-N 2.81Å; G389-D391 PolarHBondContact O-N 3.1Å; G389-N392 WeakPolarHBondContact O-CB 3.19Å; G389-N392 PolarHBondContact O-N 3.12Å
390	Y	89.1	Confident	89	Confident	123 Å²	123	72.2 Å²	72.2	48%	0.482	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-57.9	-36.4	-179	-72.7	-66.5	0	0	0	112.7	E382 I386 N392 I393	E382-Y390 WeakPolarHBondContact CG-OH 3.28Å; I386-Y390 HydrophobicContact CG1-CE2 3.79Å; Y390-N392 PolarHBondContact O-N 3.06Å; Y390-I393 HydrophobicContact CD1-CD1 3.86Å; Y390-I393 WeakPolarHBondContact O-CB 3.3Å; Y390-I393 PolarHBondContact O-N 3.13Å
391	D	89.9	Confident	87.6	Confident	133 Å²	133	82.5 Å²	82.5	71%	0.711	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-66.3	-17.8	178.5	-63.2	-29.7	0	0	0	113.4	F29 G389	F29-D391 WeakPolarHBondContact CE1-OD2 3.27Å; G389-D391 PolarHBondContact O-N 3.1Å
392	N	91.7	Very high	86.4	Confident	108 Å²	108	87.5 Å²	87.5	58%	0.578	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-85.7	-11.5	175.7	-64	-45.3	0	0	0	112.4	F388 G389 Y390	F388-N392 HydrophobicContact CD1-CB 3.89Å; F388-N392 VanDerWaalsContact CE1-C 3.4Å; F388-N392 HydrophobicContact CE1-CB 3.44Å; F388-N392 VanDerWaalsContact CE1-CB 3.44Å; F388-N392 VanDerWaalsContact CE1-O 3.3Å; F388-N392 WeakPolarHBondContact CE1-O 3.18Å; F388-N392 HydrophobicContact CE2-CB 4.34Å; F388-N392 HydrophobicContact CZ-CB 3.68Å; F388-N392 PolarHBondContact O-ND2 3.21Å; G389-N392 WeakPolarHBondContact O-CB 3.19Å; G389-N392 PolarHBondContact O-N 3.12Å; Y390-N392 PolarHBondContact O-N 3.06Å
393	I	90.3	Very high	85.4	Confident	38 Å²	38	90.3 Å²	90.3	20%	0.195	48%	0.481	C	S	.	.	S	Bend	trans	-73.5	124.5	-179.7	-60	179.7	0	0	0	108.8	L317 T319 F388 Y390 E395	L317-I393 HydrophobicContact CD2-CD1 4.23Å; L317-I393 WeakPolarHBondContact O-CG2 3.36Å; T319-I393 HydrophobicContact CG2-CG2 4.31Å; F388-I393 HydrophobicContact CD1-CG1 3.81Å; F388-I393 HydrophobicContact CE1-CG1 4.02Å; Y390-I393 HydrophobicContact CD1-CD1 3.86Å; Y390-I393 WeakPolarHBondContact O-CB 3.3Å; Y390-I393 PolarHBondContact O-N 3.13Å; I393-E395 PolarHBondContact O-N 3.45Å
394	P	86.1	Confident	84.5	Confident	81 Å²	81	94.8 Å²	94.8	53%	0.526	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-66.8	123.9	-176.7	26.4	-33.7	0	0	0	111.3	S396	P394-S396 PolarHBondContact O-N 3.28Å
395	E	87.4	Confident	83.8	Confident	202 Å²	202	98 Å²	98	94%	0.944	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-61.8	130.3	170.2	-65.2	-175.5	179.5	0	0	110.2	I393	I393-E395 PolarHBondContact O-N 3.45Å
396	S	80.2	Confident	83.4	Confident	99 Å²	99	103.6 Å²	103.6	69%	0.692	58%	0.582	S	S	*	*			trans	-133.9	146.8	175.1	62.2	0	0	0	0	110.4	P394	P394-S396 PolarHBondContact O-N 3.28Å
397	L	79.7	Confident	83.3	Confident	155 Å²	155	108.9 Å²	108.9	81%	0.812	61%	0.606	S	S	*	*			trans	-71.1	136.7	172.1	-69.5	173.7	0	0	0	109.1	Q399	L397-Q399 PolarHBondContact O-N 3.32Å
398	P	76.4	Confident	83.2	Confident	91 Å²	91	113.4 Å²	113.4	59%	0.591	64%	0.635	S	S	*	*			trans	-59.1	132.2	176.6	24.2	-32.9	0	0	0	110	T400	P398-T400 PolarHBondContact O-N 3.2Å
399	Q	72.6	Confident	83.2	Confident	182 Å²	182	111.6 Å²	111.6	85%	0.85	63%	0.628	S	S	*	*	S	Bend	trans	-67.4	-16.1	179.5	-66.4	-170.3	-6	0	0	113.1	L397 Y401	L397-Q399 PolarHBondContact O-N 3.32Å; Q399-Y401 WeakPolarHBondContact O-CD2 3.39Å; Q399-Y401 PolarHBondContact O-N 3.05Å
400	T	71.7	Confident	83.2	Confident	103 Å²	103	112.6 Å²	112.6	63%	0.632	63%	0.632	S	S	*	*			trans	-74.5	92.9	172.2	53.9	0	0	0	0	109.6	P398 C402	P398-T400 PolarHBondContact O-N 3.2Å; T400-C402 PolarHBondContact O-N 2.88Å
401	Y	67.6	Low	83.5	Confident	217 Å²	217	114.9 Å²	114.9	85%	0.851	64%	0.64	S	S	*	*			trans	-69.7	82.6	165.9	-64.8	-84.4	0	0	0	109.4	Q399	Q399-Y401 WeakPolarHBondContact O-CD2 3.39Å; Q399-Y401 PolarHBondContact O-N 3.05Å
402	C	70.6	Confident	83.7	Confident	108 Å²	108	109.8 Å²	109.8	73%	0.73	61%	0.613	S	S	*	*			trans	-81.5	124.4	166.5	-67.3	0	0	0	0	108.1	T400 A404	T400-C402 PolarHBondContact O-N 2.88Å; C402-A404 PolarHBondContact O-N 3.49Å
403	V	74.3	Confident	83.9	Confident	149 Å²	149	104.7 Å²	104.7	90%	0.903	59%	0.585	S	S	*	*			trans	-72.4	98.1	166.5	-178.5	0	0	0	0	106.6	G405	V403-G405 PolarHBondContact O-N 3.42Å
404	A	76.8	Confident	84.2	Confident	99 Å²	99	106.5 Å²	106.5	82%	0.818	60%	0.596	S	S	*	*			trans	-61.7	133.9	173.4	0	0	0	0	0	109.2	C402	C402-A404 PolarHBondContact O-N 3.49Å
405	G	82.8	Confident	84.6	Confident	67 Å²	67	107.6 Å²	107.6	69%	0.691	60%	0.596	S	S	*	*			trans	-128.3	142.1	176.4	0	0	0	0	0	110	V403 Q407	V403-G405 PolarHBondContact O-N 3.42Å; G405-Q407 PolarHBondContact O-N 3Å
406	N	85.8	Confident	85	Confident	119 Å²	119	98 Å²	98	64%	0.636	55%	0.551	S	S	*	*			trans	-67.5	134.2	173.5	-66.3	-1.2	0	0	0	108.9	R411	N406-R411 HydrophobicContact CB-CB 4.41Å
407	Q	91.9	Very high	85.8	Confident	133 Å²	133	95.4 Å²	95.4	62%	0.621	53%	0.526	S	S	*	.			trans	-58.2	142.1	167	-66.7	-175.2	-12.2	0	0	109	G405 I409 S410 R411	G405-Q407 PolarHBondContact O-N 3Å; Q407-I409 HydrophobicContact CB-CG2 4.14Å; Q407-I409 PolarHBondContact O-N 3.44Å; Q407-I409 VanDerWaalsContact O-N 3.12Å; Q407-S410 PolarHBondContact O-N 3.43Å; Q407-R411 PolarHBondContact O-N 3.02Å; Q407-R411 VanDerWaalsContact O-N 3.09Å
408	P	94.2	Very high	86.6	Confident	97 Å²	97	90.3 Å²	90.3	63%	0.63	51%	0.507	S	S	*	.	H	α-helix	trans	-50.5	-39.8	179.8	-30.7	36.6	0	0	0	113.1	R411 L412 L612	P408-R411 PolarHBondContact O-N 3.03Å; P408-L412 WeakPolarHBondContact O-CB 3.29Å; P408-L412 PolarHBondContact O-N 2.89Å; P408-L612 HydrophobicContact CB-CD2 4.09Å
409	I	94.9	Very high	87.5	Confident	21 Å²	21	86.9 Å²	86.9	11%	0.108	48%	0.483	C	S	.	.	H	α-helix	trans	-64.4	-40.6	176.6	-168.1	46.4	0	0	0	113.9	Q407 L412 T413 R511 L608 E609 L612	Q407-I409 HydrophobicContact CB-CG2 4.14Å; Q407-I409 PolarHBondContact O-N 3.44Å; Q407-I409 VanDerWaalsContact O-N 3.12Å; I409-L412 PolarHBondContact O-N 2.95Å; I409-T413 VanDerWaalsContact O-CB 3.25Å; I409-T413 WeakPolarHBondContact O-CB 3.45Å; I409-T413 PolarHBondContact O-N 3.31Å; I409-T413 PolarHBondContact O-OG1 2.84Å; I409-R511 HydrophobicContact CD1-CB 3.8Å; I409-R511 HydrophobicContact CD1-CG 3.72Å; I409-R511 HydrophobicContact CG1-CB 3.84Å; I409-R511 HydrophobicContact CG1-CG 3.96Å; I409-L608 HydrophobicContact CD1-CD2 4.33Å; I409-L608 HydrophobicContact CD1-CG 4.14Å; I409-E609 HydrophobicContact CD1-CG 4.23Å; I409-E609 HydrophobicContact CG1-CG 4.44Å; I409-L612 HydrophobicContact CB-CD1 3.71Å; I409-L612 HydrophobicContact CB-CD2 4.16Å; I409-L612 HydrophobicContact CB-CG 4.49Å; I409-L612 HydrophobicContact CD1-CD1 3.87Å; I409-L612 HydrophobicContact CD1-CD2 4.15Å; I409-L612 HydrophobicContact CD1-CG 4.16Å; I409-L612 HydrophobicContact CG1-CD1 4.05Å
410	S	94.2	Very high	88.7	Confident	39 Å²	39	78.2 Å²	78.2	27%	0.273	44%	0.442	S	S	.	.	H	α-helix	trans	-65	-43.4	176.3	-54.9	0	0	0	0	110.7	Q407 L412 T413 D414	Q407-S410 PolarHBondContact O-N 3.43Å; S410-L412 PolarHBondContact O-N 3.42Å; S410-T413 WeakPolarHBondContact O-CB 3.44Å; S410-T413 PolarHBondContact O-N 2.95Å; S410-D414 PolarHBondContact O-N 2.99Å
411	R	94.1	Very high	89.9	Confident	171 Å²	171	75.6 Å²	75.6	65%	0.645	43%	0.431	S	S	*	.	H	α-helix	trans	-62.2	-45.4	176.9	-172.7	178.9	-174.6	170.8	1.9	111.8	N406 Q407 P408 T413 D414 L415	N406-R411 HydrophobicContact CB-CB 4.41Å; Q407-R411 PolarHBondContact O-N 3.02Å; Q407-R411 VanDerWaalsContact O-N 3.09Å; P408-R411 PolarHBondContact O-N 3.03Å; R411-T413 VanDerWaalsContact C-N 3.33Å; R411-D414 PolarHBondContact O-N 3.16Å; R411-L415 WeakPolarHBondContact O-CG 3.26Å; R411-L415 PolarHBondContact O-N 2.95Å
412	L	95	Very high	91.3	Very high	27 Å²	27	72.2 Å²	72.2	14%	0.141	42%	0.423	C	S	.	.	H	α-helix	trans	-61.9	-43.7	176.3	179.7	58.8	0	0	0	111.2	P408 I409 S410 D414 L415 V416 L538 L608 F611 L612	P408-L412 WeakPolarHBondContact O-CB 3.29Å; P408-L412 PolarHBondContact O-N 2.89Å; I409-L412 PolarHBondContact O-N 2.95Å; S410-L412 PolarHBondContact O-N 3.42Å; L412-D414 PolarHBondContact O-N 3.25Å; L412-L415 PolarHBondContact O-N 3.32Å; L412-V416 HydrophobicContact CD1-CG2 4.25Å; L412-V416 WeakPolarHBondContact O-CG2 3.36Å; L412-V416 PolarHBondContact O-N 2.73Å; L412-L538 HydrophobicContact CD1-CD2 3.77Å; L412-L608 HydrophobicContact CD2-CD1 3.66Å; L412-L608 HydrophobicContact CD2-CG 3.96Å; L412-L608 HydrophobicContact CG-CD1 3.91Å; L412-L608 HydrophobicContact CG-CD2 4.32Å; L412-L608 HydrophobicContact CG-CG 4.23Å; L412-F611 HydrophobicContact CD2-CB 4.32Å; L412-L612 HydrophobicContact CB-CD2 4.29Å; L412-L612 HydrophobicContact CD2-CD2 3.77Å; L412-L612 HydrophobicContact CD2-CG 4.34Å
413	T	95.9	Very high	92.5	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-56.9	-48.1	177.2	-60	0	0	0	0	111.2	I409 S410 R411 L415 V416 R417 V493	I409-T413 VanDerWaalsContact O-CB 3.25Å; I409-T413 WeakPolarHBondContact O-CB 3.45Å; I409-T413 PolarHBondContact O-N 3.31Å; I409-T413 PolarHBondContact O-OG1 2.84Å; S410-T413 WeakPolarHBondContact O-CB 3.44Å; S410-T413 PolarHBondContact O-N 2.95Å; R411-T413 VanDerWaalsContact C-N 3.33Å; T413-L415 PolarHBondContact O-N 3.47Å; T413-V416 PolarHBondContact O-N 3.39Å; T413-R417 HydrophobicContact CG2-CG 4.42Å; T413-R417 VanDerWaalsContact CG2-NH2 3.29Å; T413-R417 WeakPolarHBondContact O-CG 3.29Å; T413-R417 PolarHBondContact O-N 2.99Å; T413-V493 HydrophobicContact CG2-CB 4.07Å; T413-V493 HydrophobicContact CG2-CG1 3.6Å
414	D	95.1	Very high	93.5	Very high	77 Å²	77	64.9 Å²	64.9	41%	0.412	38%	0.382	S	S	.	.	H	α-helix	trans	-64.6	-39.4	-178.7	-67.1	-24	0	0	0	112.5	S410 R411 L412 R417 A418	S410-D414 PolarHBondContact O-N 2.99Å; R411-D414 PolarHBondContact O-N 3.16Å; L412-D414 PolarHBondContact O-N 3.25Å; D414-R417 PolarHBondContact O-N 3.3Å; D414-R417 IonicContact OD1-NH1 2.84Å; D414-R417 PolarHBondContact OD1-NH1 3.49Å; D414-A418 WeakPolarHBondContact O-CB 3.49Å; D414-A418 PolarHBondContact O-N 2.9Å; D414-A418 VanDerWaalsContact O-N 3.1Å
415	L	94.6	Very high	94.5	Very high	103 Å²	103	60.6 Å²	60.6	54%	0.539	34%	0.344	S	S	.	.	H	α-helix	trans	-62.6	-45.3	174.9	-68.9	172.4	0	0	0	111.4	R411 L412 T413 A418 E419	R411-L415 WeakPolarHBondContact O-CG 3.26Å; R411-L415 PolarHBondContact O-N 2.95Å; L412-L415 PolarHBondContact O-N 3.32Å; T413-L415 PolarHBondContact O-N 3.47Å; L415-A418 PolarHBondContact O-N 3.45Å; L415-E419 PolarHBondContact O-N 3.24Å
416	V	95.8	Very high	95.3	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-64.5	-45.2	178.3	167.8	0	0	0	0	111.2	L412 T413 A418 E419 I420 V493 I513 L534 L537 L608	L412-V416 HydrophobicContact CD1-CG2 4.25Å; L412-V416 WeakPolarHBondContact O-CG2 3.36Å; L412-V416 PolarHBondContact O-N 2.73Å; T413-V416 PolarHBondContact O-N 3.39Å; V416-A418 VanDerWaalsContact C-N 3.34Å; V416-A418 PolarHBondContact O-N 3.15Å; V416-E419 PolarHBondContact O-N 2.98Å; V416-I420 HydrophobicContact CG1-CD1 3.55Å; V416-I420 HydrophobicContact CG1-CG1 4.13Å; V416-I420 VanDerWaalsContact O-CG1 3.3Å; V416-I420 WeakPolarHBondContact O-CG1 3.24Å; V416-I420 PolarHBondContact O-N 3.49Å; V416-V493 HydrophobicContact CG1-CG2 4.3Å; V416-I513 HydrophobicContact CG1-CD1 3.69Å; V416-I513 HydrophobicContact CG1-CG1 4.02Å; V416-L534 HydrophobicContact CG1-CD2 3.86Å; V416-L537 HydrophobicContact CG2-CD2 4.26Å; V416-L608 HydrophobicContact CG2-CD1 4.18Å; V416-L608 HydrophobicContact CG2-CD2 4.42Å
417	R	97.1	Very high	95.9	Very high	45 Å²	45	60.4 Å²	60.4	17%	0.17	33%	0.328	C	S	.	.	H	α-helix	trans	-56.2	-48.6	177.5	-75.4	175.9	-179.3	129.9	-0.6	112.1	T413 D414 E419 I420 A421 E427 F491 V493	T413-R417 HydrophobicContact CG2-CG 4.42Å; T413-R417 VanDerWaalsContact CG2-NH2 3.29Å; T413-R417 WeakPolarHBondContact O-CG 3.29Å; T413-R417 PolarHBondContact O-N 2.99Å; D414-R417 PolarHBondContact O-N 3.3Å; D414-R417 IonicContact OD1-NH1 2.84Å; D414-R417 PolarHBondContact OD1-NH1 3.49Å; R417-E419 PolarHBondContact O-N 3.4Å; R417-I420 PolarHBondContact O-N 3.41Å; R417-A421 WeakPolarHBondContact O-CB 3.45Å; R417-A421 PolarHBondContact O-N 2.99Å; R417-E427 WeakPolarHBondContact CD-OE1 3.34Å; R417-E427 WeakPolarHBondContact CG-OE1 3.29Å; R417-E427 IonicContact NE-OE1 3.59Å; R417-E427 PolarHBondContact NE-OE1 2.59Å; R417-F491 HydrophobicContact CB-CE2 4.33Å; R417-F491 HydrophobicContact CG-CE2 4.22Å; R417-V493 HydrophobicContact CG-CB 3.94Å; R417-V493 HydrophobicContact CG-CG2 3.87Å; R417-V493 PolarHBondContact NH2-O 3.48Å
418	A	96.9	Very high	96.1	Very high	48 Å²	48	54.7 Å²	54.7	40%	0.397	30%	0.304	S	S	.	.	H	α-helix	trans	-60	-37.7	-179.8	0	0	0	0	0	111.8	D414 L415 V416 Q422	D414-A418 WeakPolarHBondContact O-CB 3.49Å; D414-A418 PolarHBondContact O-N 2.9Å; D414-A418 VanDerWaalsContact O-N 3.1Å; L415-A418 PolarHBondContact O-N 3.45Å; V416-A418 VanDerWaalsContact C-N 3.34Å; V416-A418 PolarHBondContact O-N 3.15Å; A418-Q422 VanDerWaalsContact O-CG 3.26Å; A418-Q422 WeakPolarHBondContact O-CG 3.38Å; A418-Q422 PolarHBondContact O-N 2.8Å; A418-Q422 VanDerWaalsContact O-N 3.13Å; A418-Q422 PolarHBondContact O-NE2 3.43Å
419	E	95.4	Very high	96.2	Very high	19 Å²	19	57.4 Å²	57.4	9%	0.089	31%	0.312	C	S	.	.	H	α-helix	trans	-69.5	-48.4	176.8	-176.6	61.1	-131.8	0	0	112	L415 V416 R417 A421 Q422 M423 R533 L537	L415-E419 PolarHBondContact O-N 3.24Å; V416-E419 PolarHBondContact O-N 2.98Å; R417-E419 PolarHBondContact O-N 3.4Å; E419-A421 PolarHBondContact O-N 3.35Å; E419-Q422 WeakPolarHBondContact O-CB 3.33Å; E419-Q422 PolarHBondContact O-N 3.29Å; E419-M423 WeakPolarHBondContact O-CG 3.16Å; E419-M423 PolarHBondContact O-N 2.76Å; E419-M423 VanDerWaalsContact O-N 3.09Å; E419-R533 VanDerWaalsContact CD-CZ 3.47Å; E419-R533 HydrophobicContact CG-CG 4.26Å; E419-R533 IonicContact OE1-CZ 3.01Å; E419-R533 IonicContact OE1-NE 2.95Å; E419-R533 PolarHBondContact OE1-NE 2.77Å; E419-R533 IonicContact OE1-NH1 3.65Å; E419-R533 IonicContact OE1-NH2 3.13Å; E419-R533 PolarHBondContact OE1-NH2 2.69Å; E419-R533 IonicContact OE2-CZ 3.89Å; E419-R533 IonicContact OE2-NE 2.78Å; E419-R533 IonicContact OE2-NH2 3.81Å; E419-R533 PolarHBondContact OE2-NH2 3.18Å; E419-L537 HydrophobicContact CB-CD1 3.75Å; E419-L537 HydrophobicContact CG-CD1 3.68Å
420	I	98.1	Very high	96.2	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-60.6	-39.4	179.8	-59.7	170.7	0	0	0	110.6	V416 R417 M423 F425 F491 V493 I513 L530 L534	V416-I420 HydrophobicContact CG1-CD1 3.55Å; V416-I420 HydrophobicContact CG1-CG1 4.13Å; V416-I420 VanDerWaalsContact O-CG1 3.3Å; V416-I420 WeakPolarHBondContact O-CG1 3.24Å; V416-I420 PolarHBondContact O-N 3.49Å; R417-I420 PolarHBondContact O-N 3.41Å; I420-M423 WeakPolarHBondContact O-CB 3.33Å; I420-M423 PolarHBondContact O-N 3.02Å; I420-F425 HydrophobicContact CG2-CB 3.75Å; I420-F425 HydrophobicContact CG2-CD2 4.27Å; I420-F425 HydrophobicContact CG2-CG 4.04Å; I420-F425 PolarHBondContact O-N 3.32Å; I420-F491 HydrophobicContact CB-CD1 4.4Å; I420-F491 HydrophobicContact CB-CD2 3.91Å; I420-F491 HydrophobicContact CB-CE1 4.24Å; I420-F491 HydrophobicContact CB-CE2 3.79Å; I420-F491 HydrophobicContact CB-CG 4.21Å; I420-F491 HydrophobicContact CB-CZ 3.94Å; I420-F491 HydrophobicContact CD1-CD2 3.75Å; I420-F491 HydrophobicContact CD1-CE2 4.02Å; I420-F491 HydrophobicContact CG1-CD2 4.45Å; I420-F491 HydrophobicContact CG1-CE2 4.49Å; I420-F491 HydrophobicContact CG2-CB 3.83Å; I420-F491 HydrophobicContact CG2-CD1 3.54Å; I420-F491 HydrophobicContact CG2-CD2 3.54Å; I420-F491 HydrophobicContact CG2-CE1 3.83Å; I420-F491 HydrophobicContact CG2-CE2 3.87Å; I420-F491 HydrophobicContact CG2-CG 3.34Å; I420-F491 HydrophobicContact CG2-CZ 3.99Å; I420-V493 HydrophobicContact CD1-CG2 3.95Å; I420-I513 HydrophobicContact CD1-CG2 3.67Å; I420-L530 HydrophobicContact CG1-CD1 4.12Å; I420-L530 HydrophobicContact CG2-CD1 4.16Å; I420-L530 HydrophobicContact CG2-CD2 4.48Å; I420-L534 HydrophobicContact CD1-CD2 4.22Å; I420-L534 HydrophobicContact CG1-CD2 3.89Å
421	A	97.8	Very high	96.3	Very high	49 Å²	49	63 Å²	63	41%	0.405	33%	0.333	S	S	.	.	H	α-helix	trans	-61.8	-42.5	174.1	0	0	0	0	0	112.5	R417 E419 M423 G424 F425 F491	R417-A421 WeakPolarHBondContact O-CB 3.45Å; R417-A421 PolarHBondContact O-N 2.99Å; E419-A421 PolarHBondContact O-N 3.35Å; A421-M423 PolarHBondContact O-N 3.31Å; A421-G424 WeakPolarHBondContact O-CA 3.28Å; A421-G424 PolarHBondContact O-N 3.27Å; A421-F425 WeakPolarHBondContact CA-O 3.31Å; A421-F491 HydrophobicContact CB-CE1 4.36Å; A421-F491 HydrophobicContact CB-CZ 4.35Å
422	Q	96	Very high	96.3	Very high	145 Å²	145	58.1 Å²	58.1	68%	0.678	33%	0.326	S	S	*	.	H	α-helix	trans	-64.5	-24.7	176.1	-76.2	169.5	68.3	0	0	113.2	A418 E419 G424	A418-Q422 VanDerWaalsContact O-CG 3.26Å; A418-Q422 WeakPolarHBondContact O-CG 3.38Å; A418-Q422 PolarHBondContact O-N 2.8Å; A418-Q422 VanDerWaalsContact O-N 3.13Å; A418-Q422 PolarHBondContact O-NE2 3.43Å; E419-Q422 WeakPolarHBondContact O-CB 3.33Å; E419-Q422 PolarHBondContact O-N 3.29Å; Q422-G424 PolarHBondContact O-N 3.18Å
423	M	95.1	Very high	96.5	Very high	56 Å²	56	59.6 Å²	59.6	28%	0.276	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	2.8	171.1	-61.9	-174.1	71.9	0	0	113.8	E419 I420 A421 F425 L530 R533	E419-M423 WeakPolarHBondContact O-CG 3.16Å; E419-M423 PolarHBondContact O-N 2.76Å; E419-M423 VanDerWaalsContact O-N 3.09Å; I420-M423 WeakPolarHBondContact O-CB 3.33Å; I420-M423 PolarHBondContact O-N 3.02Å; A421-M423 PolarHBondContact O-N 3.31Å; M423-F425 HydrophobicContact CB-CD2 4.26Å; M423-L530 HydrophobicContact CE-CB 4.36Å; M423-L530 HydrophobicContact CE-CD1 4.06Å; M423-L530 HydrophobicContact SD-CD1 3.38Å; M423-L530 WeakPolarHBondContact SD-CD1 3.47Å; M423-R533 HydrophobicContact CE-CB 3.73Å; M423-R533 HydrophobicContact CE-CG 4.1Å; M423-R533 HydrophobicContact SD-CB 3.62Å; M423-R533 HydrophobicContact SD-CG 3.48Å; M423-R533 WeakPolarHBondContact SD-CG 3.46Å
424	G	96.5	Very high	96.5	Very high	47 Å²	47	60.2 Å²	60.2	49%	0.485	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.3	19.7	175.1	0	0	0	0	0	114.4	A421 Q422	A421-G424 WeakPolarHBondContact O-CA 3.28Å; A421-G424 PolarHBondContact O-N 3.27Å; Q422-G424 PolarHBondContact O-N 3.18Å
425	F	98.2	Very high	96.6	Very high	9 Å²	9	57 Å²	57	4%	0.039	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-88.2	147.7	167.7	-71.3	-107.4	0	0	0	110.1	I420 A421 M423 K489 F491 A515 I526 I527 L530	I420-F425 HydrophobicContact CG2-CB 3.75Å; I420-F425 HydrophobicContact CG2-CD2 4.27Å; I420-F425 HydrophobicContact CG2-CG 4.04Å; I420-F425 PolarHBondContact O-N 3.32Å; A421-F425 WeakPolarHBondContact CA-O 3.31Å; M423-F425 HydrophobicContact CB-CD2 4.26Å; F425-K489 HydrophobicContact CB-CB 4.31Å; F425-K489 HydrophobicContact CD1-CB 3.67Å; F425-K489 HydrophobicContact CD1-CG 4.46Å; F425-K489 HydrophobicContact CD2-CB 4.47Å; F425-K489 HydrophobicContact CD2-CD 4.25Å; F425-K489 HydrophobicContact CE1-CB 4.03Å; F425-K489 HydrophobicContact CE1-CG 4.39Å; F425-K489 HydrophobicContact CE2-CD 4.17Å; F425-K489 HydrophobicContact CG-CB 3.89Å; F425-K489 HydrophobicContact CG-CD 4.48Å; F425-K489 HydrophobicContact CZ-CD 4.33Å; F425-F491 HydrophobicContact CB-CB 4.37Å; F425-F491 HydrophobicContact CB-CD1 3.52Å; F425-F491 HydrophobicContact CB-CE1 4.15Å; F425-F491 HydrophobicContact CB-CG 4.27Å; F425-F491 HydrophobicContact CD1-CB 4.43Å; F425-A515 HydrophobicContact CD1-CB 4.25Å; F425-A515 HydrophobicContact CE1-CB 4.04Å; F425-I526 HydrophobicContact CE2-CG2 4.43Å; F425-I526 HydrophobicContact CZ-CG2 4.1Å; F425-I527 HydrophobicContact CE1-CD1 3.99Å; F425-I527 HydrophobicContact CZ-CD1 4.03Å; F425-L530 HydrophobicContact CD2-CD2 4.49Å; F425-L530 HydrophobicContact CE1-CD2 4.15Å; F425-L530 HydrophobicContact CE2-CB 4.44Å; F425-L530 HydrophobicContact CE2-CD1 4.38Å; F425-L530 HydrophobicContact CE2-CD2 3.99Å; F425-L530 HydrophobicContact CZ-CD2 3.8Å
426	T	98.1	Very high	96.7	Very high	93 Å²	93	56.7 Å²	56.7	57%	0.571	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	128	174.9	-56.9	0	0	0	0	109.4	K489 L490 F491	T426-K489 PolarHBondContact N-O 3.33Å; T426-L490 CarbonylContact O-C 3.56Å; T426-L490 VanDerWaalsContact O-CA 3.31Å; T426-L490 WeakPolarHBondContact O-CA 3.48Å; T426-F491 VanDerWaalsContact C-CD1 3.46Å; T426-F491 WeakPolarHBondContact O-CD1 3.25Å; T426-F491 PolarHBondContact O-N 2.79Å
427	E	98.3	Very high	96.7	Very high	89 Å²	89	62.2 Å²	62.2	42%	0.416	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	135.2	177.3	-163.5	169.5	-165.2	0	0	109.9	R417 F491	R417-E427 WeakPolarHBondContact CD-OE1 3.34Å; R417-E427 WeakPolarHBondContact CG-OE1 3.29Å; R417-E427 IonicContact NE-OE1 3.59Å; R417-E427 PolarHBondContact NE-OE1 2.59Å; E427-F491 CarbonylContact C-O 3.57Å; E427-F491 VanDerWaalsContact CA-CE1 3.45Å; E427-F491 VanDerWaalsContact CA-O 3.29Å; E427-F491 WeakPolarHBondContact CA-O 3.44Å; E427-F491 HydrophobicContact CB-CD1 4.11Å; E427-F491 HydrophobicContact CB-CE1 3.53Å; E427-F491 HydrophobicContact CB-CE2 4.12Å; E427-F491 HydrophobicContact CB-CZ 3.53Å; E427-F491 HydrophobicContact CG-CD2 4.38Å; E427-F491 HydrophobicContact CG-CE1 4.2Å; E427-F491 HydrophobicContact CG-CE2 3.9Å; E427-F491 HydrophobicContact CG-CZ 3.83Å
428	A	96.7	Very high	96.7	Very high	13 Å²	13	60.6 Å²	60.6	11%	0.107	33%	0.333	C	S	.	.			trans	-111.9	148.1	171.8	0	0	0	0	0	109.8	L474 T477 F491 E492	A428-L474 HydrophobicContact CB-CD2 3.74Å; A428-T477 HydrophobicContact CB-CG2 4.45Å; A428-F491 PolarHBondContact N-O 3.4Å; A428-E492 WeakPolarHBondContact O-CG 3.5Å
429	L	96.2	Very high	96.7	Very high	155 Å²	155	58.4 Å²	58.4	81%	0.812	32%	0.315	S	S	*	.			trans	-116.3	96.7	172.8	-177.1	64.6	0	0	0	108.4
430	S	95.4	Very high	96.8	Very high	16 Å²	16	57.6 Å²	57.6	11%	0.112	31%	0.311	C	S	.	.			trans	-87.6	161.8	-179.8	67.4	0	0	0	0	112.3	R467 E492	S430-R467 PolarHBondContact O-NH1 2.71Å; S430-R467 PolarHBondContact OG-NH1 3.29Å; S430-E492 WeakPolarHBondContact CB-OE2 3.49Å; S430-E492 PolarHBondContact N-OE2 3.41Å; S430-E492 PolarHBondContact OG-OE1 3.37Å; S430-E492 PolarHBondContact OG-OE2 3.5Å
431	F	95.2	Very high	96.7	Very high	160 Å²	160	61.5 Å²	61.5	70%	0.702	34%	0.335	S	S	*	.			trans	-61.6	140.3	174.3	-66.2	-68.1	0	0	0	111.2	L433 F463	F431-L433 VanDerWaalsContact C-N 3.3Å; F431-L433 WeakPolarHBondContact CB-O 3.41Å; F431-F463 HydrophobicContact CB-CE1 4.18Å; F431-F463 HydrophobicContact CD1-CE1 4.48Å; F431-F463 HydrophobicContact CD2-CE1 4.2Å; F431-F463 HydrophobicContact CD2-CZ 4.45Å; F431-F463 HydrophobicContact CG-CE1 4.04Å
432	S	95.8	Very high	96.7	Very high	70 Å²	70	61.3 Å²	61.3	49%	0.49	33%	0.325	S	S	.	.	S	Bend	trans	-73.1	-25.6	173.7	56.1	0	0	0	0	112.6	R467	S432-R467 WeakPolarHBondContact O-CG 3.49Å; S432-R467 PolarHBondContact O-N 3.46Å
433	L	97.5	Very high	96.7	Very high	57 Å²	57	54.6 Å²	54.6	30%	0.298	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	141.3	173.7	-60.9	179.7	0	0	0	110.2	F431 I455 F463 V465 V466	F431-L433 VanDerWaalsContact C-N 3.3Å; F431-L433 WeakPolarHBondContact CB-O 3.41Å; L433-I455 HydrophobicContact CD1-CD1 3.63Å; L433-I455 HydrophobicContact CD2-CD1 3.74Å; L433-I455 HydrophobicContact CG-CD1 4.27Å; L433-F463 HydrophobicContact CB-CB 4.04Å; L433-F463 HydrophobicContact CB-CD1 3.62Å; L433-F463 HydrophobicContact CB-CG 4.24Å; L433-F463 HydrophobicContact CD1-CB 4.31Å; L433-F463 WeakPolarHBondContact O-CD1 3.44Å; L433-V465 CarbonylContact C-O 3.51Å; L433-V465 WeakPolarHBondContact CA-O 3.37Å; L433-V466 HydrophobicContact CD2-CB 4.39Å; L433-V466 HydrophobicContact CD2-CG2 3.86Å
434	C	96.1	Very high	96.8	Very high	14 Å²	14	56.5 Å²	56.5	10%	0.095	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	175.9	179.4	54.8	0	0	0	0	111.1	D438 I439 D462 Q464 V465	C434-D438 HydrophobicContact CB-CB 4.19Å; C434-I439 WeakPolarHBondContact SG-CG2 3.43Å; C434-D462 CarbonylContact C-O 3.57Å; C434-D462 WeakPolarHBondContact CA-O 3.28Å; C434-Q464 PolarHBondContact O-N 3.05Å; C434-V465 PolarHBondContact N-O 3.19Å; C434-V465 WeakPolarHBondContact O-CG2 3.45Å; C434-V465 PolarHBondContact O-N 2.94Å
435	S	97	Very high	96.7	Very high	9 Å²	9	57.2 Å²	57.2	6%	0.063	29%	0.289	C	S	.	.			trans	-75.5	157.2	177.4	70.1	0	0	0	0	110.6	E437 D438 L461 D462 V465	S435-E437 PolarHBondContact O-N 3.44Å; S435-D438 WeakPolarHBondContact CB-OD2 3.41Å; S435-D438 PolarHBondContact N-OD2 3.03Å; S435-D438 PolarHBondContact O-N 2.94Å; S435-D438 WeakPolarHBondContact OG-CB 3.35Å; S435-D438 PolarHBondContact OG-N 3.04Å; S435-D438 PolarHBondContact OG-OD1 2.95Å; S435-D438 PolarHBondContact OG-OD2 2.92Å; S435-L461 WeakPolarHBondContact CB-O 3.41Å; S435-D462 PolarHBondContact N-O 3.39Å; S435-V465 WeakPolarHBondContact O-CG2 3.37Å
436	R	97.2	Very high	96.5	Very high	97 Å²	97	64.1 Å²	64.1	37%	0.366	32%	0.319	S	S	.	.	H	α-helix	trans	-59.2	-34	171.2	-71.7	170.3	-171.5	-169.8	1.7	111.4	I439 S440 L447 Q464 V465	R436-I439 WeakPolarHBondContact O-CG1 3.46Å; R436-S440 WeakPolarHBondContact O-CB 3.39Å; R436-S440 PolarHBondContact O-N 3.04Å; R436-S440 PolarHBondContact O-OG 3.1Å; R436-L447 HydrophobicContact CB-CD1 4.3Å; R436-L447 HydrophobicContact CB-CD2 4.01Å; R436-L447 HydrophobicContact CG-CD2 4.09Å; R436-Q464 HydrophobicContact CG-CB 3.96Å; R436-Q464 VanDerWaalsContact CG-OE1 3.28Å; R436-V465 HydrophobicContact CG-CG1 3.74Å
437	E	96.9	Very high	96.3	Very high	116 Å²	116	61.8 Å²	61.8	54%	0.542	30%	0.303	S	S	.	.	H	α-helix	trans	-67.4	-40.5	-179.4	-62.6	-177.5	-178.4	0	0	112.1	S435 I439 S440 T441 K442	S435-E437 PolarHBondContact O-N 3.44Å; E437-I439 VanDerWaalsContact C-N 3.31Å; E437-I439 PolarHBondContact O-N 3.02Å; E437-S440 CarbonylContact O-C 3.57Å; E437-S440 PolarHBondContact O-N 2.88Å; E437-S440 VanDerWaalsContact O-N 3.16Å; E437-T441 WeakPolarHBondContact CA-OG1 3.46Å; E437-T441 WeakPolarHBondContact CB-OG1 3.44Å; E437-T441 PolarHBondContact O-N 2.75Å; E437-T441 PolarHBondContact O-OG1 2.77Å; E437-K442 HydrophobicContact CB-CG 4.23Å; E437-K442 WeakPolarHBondContact O-CB 3.34Å; E437-K442 PolarHBondContact O-N 3.36Å
438	D	97.2	Very high	96.1	Very high	11 Å²	11	65 Å²	65	6%	0.059	32%	0.323	C	S	.	.	H	α-helix	trans	-58	-42.1	-179.1	-71.6	-36.4	0	0	0	112.5	C434 S435 K442 L443 P472	C434-D438 HydrophobicContact CB-CB 4.19Å; S435-D438 WeakPolarHBondContact CB-OD2 3.41Å; S435-D438 PolarHBondContact N-OD2 3.03Å; S435-D438 PolarHBondContact O-N 2.94Å; S435-D438 WeakPolarHBondContact OG-CB 3.35Å; S435-D438 PolarHBondContact OG-N 3.04Å; S435-D438 PolarHBondContact OG-OD1 2.95Å; S435-D438 PolarHBondContact OG-OD2 2.92Å; D438-K442 WeakPolarHBondContact OD1-CD 3.35Å; D438-K442 WeakPolarHBondContact OD1-CE 2.86Å; D438-K442 IonicContact OD1-NZ 2.65Å; D438-K442 PolarHBondContact OD1-NZ 2.96Å; D438-L443 WeakPolarHBondContact O-CG 3.45Å; D438-P472 HydrophobicContact CB-CB 3.93Å; D438-P472 WeakPolarHBondContact O-CG 3.31Å
439	I	96	Very high	95.9	Very high	1 Å²	1	70.2 Å²	70.2	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-84.9	-15.9	-179.5	63.6	164.6	0	0	0	113.4	C434 R436 E437 L447 I450 A452 V465 T468	C434-I439 WeakPolarHBondContact SG-CG2 3.43Å; R436-I439 WeakPolarHBondContact O-CG1 3.46Å; E437-I439 VanDerWaalsContact C-N 3.31Å; E437-I439 PolarHBondContact O-N 3.02Å; I439-L447 HydrophobicContact CD1-CD1 4.08Å; I439-L447 HydrophobicContact CG1-CD1 4.28Å; I439-I450 HydrophobicContact CD1-CG2 4.29Å; I439-I450 WeakPolarHBondContact O-CD1 3.46Å; I439-A452 HydrophobicContact CD1-CB 3.54Å; I439-V465 HydrophobicContact CD1-CB 4.25Å; I439-V465 HydrophobicContact CD1-CG2 3.68Å; I439-V465 HydrophobicContact CG1-CG2 4.05Å; I439-T468 HydrophobicContact CD1-CG2 4.14Å
440	S	96.6	Very high	95.8	Very high	3 Å²	3	63.8 Å²	63.8	2%	0.021	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	-91.3	-171.3	67.3	0	0	0	0	112.7	R436 E437 K442 L443 R444 Q445	R436-S440 WeakPolarHBondContact O-CB 3.39Å; R436-S440 PolarHBondContact O-N 3.04Å; R436-S440 PolarHBondContact O-OG 3.1Å; E437-S440 CarbonylContact O-C 3.57Å; E437-S440 PolarHBondContact O-N 2.88Å; E437-S440 VanDerWaalsContact O-N 3.16Å; S440-K442 VanDerWaalsContact C-N 3.33Å; S440-K442 PolarHBondContact O-N 3.4Å; S440-L443 CarbonylContact O-C 3.58Å; S440-L443 WeakPolarHBondContact O-CA 3.42Å; S440-L443 PolarHBondContact O-N 2.77Å; S440-R444 PolarHBondContact O-N 2.79Å; S440-R444 VanDerWaalsContact O-N 3.08Å; S440-Q445 CarbonylContact C-O 3.52Å; S440-Q445 WeakPolarHBondContact CA-O 3.45Å; S440-Q445 WeakPolarHBondContact CB-O 3.35Å; S440-Q445 PolarHBondContact O-N 2.83Å
441	T	96.7	Very high	95.9	Very high	82 Å²	82	66 Å²	66	50%	0.503	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-58.7	-40	-170.8	53.4	0	0	0	0	112.6	E437 L443 R444 Q445	E437-T441 WeakPolarHBondContact CA-OG1 3.46Å; E437-T441 WeakPolarHBondContact CB-OG1 3.44Å; E437-T441 PolarHBondContact O-N 2.75Å; E437-T441 PolarHBondContact O-OG1 2.77Å; T441-L443 VanDerWaalsContact C-N 3.27Å; T441-L443 PolarHBondContact O-N 2.9Å; T441-R444 PolarHBondContact O-N 3.12Å; T441-Q445 PolarHBondContact N-O 2.68Å
442	K	97.7	Very high	95.9	Very high	44 Å²	44	58.3 Å²	58.3	19%	0.191	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-65.2	-32	177.4	-66.1	-169.4	-173.7	166.5	0	112.4	E437 D438 S440 R444 N594 F595	E437-K442 HydrophobicContact CB-CG 4.23Å; E437-K442 WeakPolarHBondContact O-CB 3.34Å; E437-K442 PolarHBondContact O-N 3.36Å; D438-K442 WeakPolarHBondContact OD1-CD 3.35Å; D438-K442 WeakPolarHBondContact OD1-CE 2.86Å; D438-K442 IonicContact OD1-NZ 2.65Å; D438-K442 PolarHBondContact OD1-NZ 2.96Å; S440-K442 VanDerWaalsContact C-N 3.33Å; S440-K442 PolarHBondContact O-N 3.4Å; K442-R444 VanDerWaalsContact C-N 3.33Å; K442-N594 HydrophobicContact CB-CB 3.95Å; K442-N594 HydrophobicContact CG-CB 4.11Å; K442-N594 PolarHBondContact O-ND2 3.12Å; K442-F595 HydrophobicContact CB-CD2 4.21Å; K442-F595 HydrophobicContact CB-CE1 4.46Å; K442-F595 HydrophobicContact CB-CE2 3.5Å; K442-F595 VanDerWaalsContact CB-CE2 3.5Å; K442-F595 HydrophobicContact CB-CZ 3.65Å; K442-F595 HydrophobicContact CD-CD1 4.29Å; K442-F595 HydrophobicContact CD-CE1 3.93Å; K442-F595 HydrophobicContact CD-CE2 4.33Å; K442-F595 HydrophobicContact CD-CZ 3.95Å; K442-F595 HydrophobicContact CG-CZ 4.48Å
443	L	97.1	Very high	96	Very high	4 Å²	4	56.8 Å²	56.8	2%	0.021	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-88.1	6.9	172.7	-62	-178.8	0	0	0	113.8	D438 S440 T441 Q445 L471 P472 L475 T563 V591 F595	D438-L443 WeakPolarHBondContact O-CG 3.45Å; S440-L443 CarbonylContact O-C 3.58Å; S440-L443 WeakPolarHBondContact O-CA 3.42Å; S440-L443 PolarHBondContact O-N 2.77Å; T441-L443 VanDerWaalsContact C-N 3.27Å; T441-L443 PolarHBondContact O-N 2.9Å; L443-Q445 VanDerWaalsContact C-N 3.26Å; L443-Q445 HydrophobicContact CB-CG 4.48Å; L443-Q445 PolarHBondContact O-N 3.37Å; L443-L471 HydrophobicContact CD2-CD2 4.02Å; L443-L471 HydrophobicContact CD2-CG 4.41Å; L443-P472 HydrophobicContact CD1-CG 3.76Å; L443-P472 HydrophobicContact CD2-CG 4.37Å; L443-P472 HydrophobicContact CG-CG 4.23Å; L443-L475 HydrophobicContact CD2-CD1 4.4Å; L443-T563 HydrophobicContact CB-CG2 4.19Å; L443-T563 HydrophobicContact CD2-CG2 3.8Å; L443-T563 HydrophobicContact CG-CG2 4.48Å; L443-T563 WeakPolarHBondContact O-CA 3.12Å; L443-T563 PolarHBondContact O-OG1 2.85Å; L443-T563 VanDerWaalsContact O-OG1 3.09Å; L443-V591 HydrophobicContact CD2-CG1 4.01Å; L443-F595 HydrophobicContact CD2-CE2 3.79Å; L443-F595 HydrophobicContact CD2-CZ 4.2Å; L443-F595 HydrophobicContact CG-CE2 4.44Å
444	R	96.3	Very high	95.9	Very high	96 Å²	96	57.3 Å²	57.3	36%	0.362	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	30.2	-176.3	-53.2	177.6	70.7	-127.4	1.6	114	S440 T441 K442 P562 D590 V591	S440-R444 PolarHBondContact O-N 2.79Å; S440-R444 VanDerWaalsContact O-N 3.08Å; T441-R444 PolarHBondContact O-N 3.12Å; K442-R444 VanDerWaalsContact C-N 3.33Å; R444-P562 HydrophobicContact CB-CB 4.07Å; R444-P562 WeakPolarHBondContact CD-O 3.35Å; R444-P562 PolarHBondContact NH1-O 3.47Å; R444-P562 VanDerWaalsContact O-CG 3.23Å; R444-P562 WeakPolarHBondContact O-CG 3.21Å; R444-D590 IonicContact NE-OD2 3.59Å; R444-V591 HydrophobicContact CG-CG2 3.86Å
445	Q	94.4	Very high	95.9	Very high	63 Å²	63	59.3 Å²	59.3	29%	0.294	29%	0.293	S	S	.	.			trans	-109.5	151.6	175	-62.9	-177.1	45.5	0	0	110.6	S440 T441 L443 I450 P562 T563	S440-Q445 CarbonylContact C-O 3.52Å; S440-Q445 WeakPolarHBondContact CA-O 3.45Å; S440-Q445 WeakPolarHBondContact CB-O 3.35Å; S440-Q445 PolarHBondContact O-N 2.83Å; T441-Q445 PolarHBondContact N-O 2.68Å; L443-Q445 VanDerWaalsContact C-N 3.26Å; L443-Q445 HydrophobicContact CB-CG 4.48Å; L443-Q445 PolarHBondContact O-N 3.37Å; Q445-I450 HydrophobicContact CB-CD1 4.09Å; Q445-P562 HydrophobicContact CG-CG 4.37Å; Q445-T563 PolarHBondContact NE2-OG1 2.78Å
446	K	94.4	Very high	95.7	Very high	153 Å²	153	64.9 Å²	64.9	67%	0.665	33%	0.332	S	S	*	.			trans	-80.7	133.7	172.8	-64.3	179.9	-177	172.7	0	109	D448 D449	K446-D448 VanDerWaalsContact C-N 3.28Å; K446-D448 PolarHBondContact O-N 3.27Å; K446-D449 HydrophobicContact CB-CB 4.45Å; K446-D449 WeakPolarHBondContact CB-OD2 3.37Å; K446-D449 PolarHBondContact O-N 3.06Å
447	L	93.1	Very high	95.4	Very high	44 Å²	44	66.4 Å²	66.4	23%	0.23	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-59.8	-39.2	-179	-176.7	63.9	0	0	0	112.4	R436 I439 D449 I450	R436-L447 HydrophobicContact CB-CD1 4.3Å; R436-L447 HydrophobicContact CB-CD2 4.01Å; R436-L447 HydrophobicContact CG-CD2 4.09Å; I439-L447 HydrophobicContact CD1-CD1 4.08Å; I439-L447 HydrophobicContact CG1-CD1 4.28Å; L447-D449 PolarHBondContact O-N 3.35Å; L447-I450 PolarHBondContact O-N 3.09Å; L447-I450 VanDerWaalsContact O-N 3.08Å
448	D	94.1	Very high	95.1	Very high	156 Å²	156	62.5 Å²	62.5	83%	0.834	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-66.2	-23.3	-177.5	-61.9	-30.3	0	0	0	113.4	K446 I450	K446-D448 VanDerWaalsContact C-N 3.28Å; K446-D448 PolarHBondContact O-N 3.27Å; D448-I450 VanDerWaalsContact C-N 3.27Å
449	D	93.6	Very high	94.8	Very high	124 Å²	124	71.5 Å²	71.5	66%	0.663	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-82.8	-8.4	178.1	-62.5	-24.5	0	0	0	111.9	K446 L447	K446-D449 HydrophobicContact CB-CB 4.45Å; K446-D449 WeakPolarHBondContact CB-OD2 3.37Å; K446-D449 PolarHBondContact O-N 3.06Å; L447-D449 PolarHBondContact O-N 3.35Å
450	I	94.6	Very high	94.6	Very high	19 Å²	19	74.4 Å²	74.4	10%	0.097	39%	0.389	C	S	.	.	S	Bend	trans	-100.7	124.8	-176.8	-57.4	169.2	0	0	0	108.9	I439 Q445 L447 D448 A452 T468	I439-I450 HydrophobicContact CD1-CG2 4.29Å; I439-I450 WeakPolarHBondContact O-CD1 3.46Å; Q445-I450 HydrophobicContact CB-CD1 4.09Å; L447-I450 PolarHBondContact O-N 3.09Å; L447-I450 VanDerWaalsContact O-N 3.08Å; D448-I450 VanDerWaalsContact C-N 3.27Å; I450-A452 HydrophobicContact CG2-CB 4.13Å; I450-A452 PolarHBondContact O-N 3.49Å; I450-T468 HydrophobicContact CG2-CG2 3.73Å
451	P	95.6	Very high	94.4	Very high	62 Å²	62	80.4 Å²	80.4	40%	0.403	42%	0.42	S	S	.	.			trans	-75.6	62.9	176.3	31.8	-34.3	0	0	0	110.9	L498 K499	P451-L498 HydrophobicContact CG-CB 4.37Å; P451-L498 HydrophobicContact CG-CD2 4.17Å; P451-L498 CarbonylContact O-C 3.54Å; P451-L498 WeakPolarHBondContact O-CA 3.26Å; P451-K499 HydrophobicContact CB-CB 4.04Å; P451-K499 PolarHBondContact O-N 3.2Å
452	A	97	Very high	94.2	Very high	0 Å²	0	81.5 Å²	81.5	0%	0	42%	0.423	C	S	.	.			trans	-85.6	141.4	-176	0	0	0	0	0	112.5	I439 I450 H454 T468 K499	I439-A452 HydrophobicContact CD1-CB 3.54Å; I450-A452 HydrophobicContact CG2-CB 4.13Å; I450-A452 PolarHBondContact O-N 3.49Å; A452-H454 PolarHBondContact O-CD2 3.11Å; A452-T468 HydrophobicContact CB-CG2 3.82Å; A452-K499 WeakPolarHBondContact O-CD 3.46Å; A452-K499 WeakPolarHBondContact O-CE 3.38Å; A452-K499 WeakPolarHBondContact O-CG 3.33Å; A452-K499 PolarHBondContact O-NZ 2.97Å
453	V	97	Very high	94	Very high	38 Å²	38	83 Å²	83	23%	0.23	43%	0.429	C	S	.	.			trans	-88	126.2	171.7	-179.9	0	0	0	0	109	V465 V466 V497 K499 A507	V453-V465 VanDerWaalsContact O-CA 3.28Å; V453-V465 WeakPolarHBondContact O-CA 3.49Å; V453-V466 HydrophobicContact CB-CB 4.36Å; V453-V466 HydrophobicContact CB-CG2 4.06Å; V453-V466 HydrophobicContact CG1-CG2 4.16Å; V453-V466 PolarHBondContact O-N 3.09Å; V453-V497 HydrophobicContact CG2-CG1 3.93Å; V453-K499 HydrophobicContact CG2-CG 3.85Å; V453-A507 HydrophobicContact CG2-CB 3.85Å
454	H	96.2	Very high	94	Very high	68 Å²	68	84.1 Å²	84.1	32%	0.315	43%	0.434	S	S	.	.	B	Isolated β-bridge	trans	-107.9	140.9	-175.4	-62.7	-102.7	0	0	0	111.6	A452 V465	A452-H454 PolarHBondContact O-CD2 3.11Å; H454-V465 HydrophobicContact CB-CG1 4.43Å; H454-V465 WeakPolarHBondContact ND1-CG1 3.38Å
455	I	95.2	Very high	94.1	Very high	56 Å²	56	79.6 Å²	79.6	29%	0.287	42%	0.417	S	S	.	.			trans	-76.8	131.3	166.8	-62.8	169.5	0	0	0	107.9	L433 P458 F463 Q464	L433-I455 HydrophobicContact CD1-CD1 3.63Å; L433-I455 HydrophobicContact CD2-CD1 3.74Å; L433-I455 HydrophobicContact CG-CD1 4.27Å; I455-P458 HydrophobicContact CB-CB 4.31Å; I455-P458 HydrophobicContact CG2-CB 4.12Å; I455-F463 WeakPolarHBondContact CD1-O 3.43Å; I455-Q464 PolarHBondContact N-O 3.19Å
456	S	92.8	Very high	94.2	Very high	126 Å²	126	77.9 Å²	77.9	88%	0.881	41%	0.411	S	S	*	.	S	Bend	trans	-68.4	-39.5	-176	56.1	0	0	0	0	113
457	N	91.9	Very high	94.4	Very high	128 Å²	128	71.3 Å²	71.3	68%	0.684	38%	0.382	S	S	*	.	S	Bend	trans	-135.1	70.6	-179.1	-169.5	25.4	0	0	0	111.2
458	P	90.6	Very high	94.5	Very high	35 Å²	35	70.1 Å²	70.1	23%	0.227	38%	0.377	C	S	.	.			trans	-68.1	139.7	-178	29.7	-33.9	0	0	0	110.8	I455 F463 Q464	I455-P458 HydrophobicContact CB-CB 4.31Å; I455-P458 HydrophobicContact CG2-CB 4.12Å; P458-F463 VanDerWaalsContact CB-O 3.26Å; P458-F463 WeakPolarHBondContact CB-O 3.36Å; P458-Q464 HydrophobicContact CB-CG 4.31Å; P458-Q464 HydrophobicContact CG-CG 4.05Å
459	K	89.2	Confident	94.7	Very high	200 Å²	200	63.5 Å²	63.5	87%	0.87	34%	0.342	S	S	*	.	S	Bend	trans	-72.8	-32.4	179.8	-69.9	-68.2	-174	176.7	0	112.9
460	T	92.8	Very high	94.9	Very high	62 Å²	62	57.6 Å²	57.6	38%	0.38	31%	0.311	S	S	.	.	S	Bend	trans	-133.3	159.2	178.7	66.2	0	0	0	0	110.2	D462 F463	T460-D462 PolarHBondContact O-N 3.06Å; T460-F463 PolarHBondContact O-N 2.66Å; T460-F463 VanDerWaalsContact OG1-CD2 3.29Å; T460-F463 WeakPolarHBondContact OG1-CD2 3.49Å
461	L	91.7	Very high	95	Very high	128 Å²	128	56.9 Å²	56.9	67%	0.67	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-18.4	178.2	-61.3	177.4	0	0	0	112.7	S435 F463 Q464	S435-L461 WeakPolarHBondContact CB-O 3.41Å; L461-F463 VanDerWaalsContact C-N 3.28Å; L461-F463 PolarHBondContact O-N 3.37Å; L461-Q464 VanDerWaalsContact CD2-NE2 3.31Å; L461-Q464 VanDerWaalsContact O-CG 3.29Å; L461-Q464 WeakPolarHBondContact O-CG 3.33Å; L461-Q464 PolarHBondContact O-OE1 2.87Å
462	D	92.2	Very high	95.2	Very high	106 Å²	106	54.1 Å²	54.1	57%	0.567	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-17	179	-54.7	-42.9	0	0	0	113.1	C434 S435 T460	C434-D462 CarbonylContact C-O 3.57Å; C434-D462 WeakPolarHBondContact CA-O 3.28Å; S435-D462 PolarHBondContact N-O 3.39Å; T460-D462 PolarHBondContact O-N 3.06Å
463	F	94.9	Very high	95.2	Very high	76 Å²	76	54.9 Å²	54.9	33%	0.333	30%	0.297	S	S	.	.	S	Bend	trans	-129.8	64.8	-175.7	-57.7	-59.1	0	0	0	111.2	F431 L433 I455 P458 T460 L461	F431-F463 HydrophobicContact CB-CE1 4.18Å; F431-F463 HydrophobicContact CD1-CE1 4.48Å; F431-F463 HydrophobicContact CD2-CE1 4.2Å; F431-F463 HydrophobicContact CD2-CZ 4.45Å; F431-F463 HydrophobicContact CG-CE1 4.04Å; L433-F463 HydrophobicContact CB-CB 4.04Å; L433-F463 HydrophobicContact CB-CD1 3.62Å; L433-F463 HydrophobicContact CB-CG 4.24Å; L433-F463 HydrophobicContact CD1-CB 4.31Å; L433-F463 WeakPolarHBondContact O-CD1 3.44Å; I455-F463 WeakPolarHBondContact CD1-O 3.43Å; P458-F463 VanDerWaalsContact CB-O 3.26Å; P458-F463 WeakPolarHBondContact CB-O 3.36Å; T460-F463 PolarHBondContact O-N 2.66Å; T460-F463 VanDerWaalsContact OG1-CD2 3.29Å; T460-F463 WeakPolarHBondContact OG1-CD2 3.49Å; L461-F463 VanDerWaalsContact C-N 3.28Å; L461-F463 PolarHBondContact O-N 3.37Å
464	Q	96.6	Very high	95.3	Very high	27 Å²	27	53 Å²	53	13%	0.126	29%	0.286	C	S	.	.	S	Bend	trans	-100.8	-27.7	-176.5	-69.2	177.6	-40	0	0	113.8	C434 R436 I455 P458 L461	C434-Q464 PolarHBondContact O-N 3.05Å; R436-Q464 HydrophobicContact CG-CB 3.96Å; R436-Q464 VanDerWaalsContact CG-OE1 3.28Å; I455-Q464 PolarHBondContact N-O 3.19Å; P458-Q464 HydrophobicContact CB-CG 4.31Å; P458-Q464 HydrophobicContact CG-CG 4.05Å; L461-Q464 VanDerWaalsContact CD2-NE2 3.31Å; L461-Q464 VanDerWaalsContact O-CG 3.29Å; L461-Q464 WeakPolarHBondContact O-CG 3.33Å; L461-Q464 PolarHBondContact O-OE1 2.87Å
465	V	97.3	Very high	95.4	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	152.7	-173.1	-67	0	0	0	0	110.8	L433 C434 S435 R436 I439 V453 H454	L433-V465 CarbonylContact C-O 3.51Å; L433-V465 WeakPolarHBondContact CA-O 3.37Å; C434-V465 PolarHBondContact N-O 3.19Å; C434-V465 WeakPolarHBondContact O-CG2 3.45Å; C434-V465 PolarHBondContact O-N 2.94Å; S435-V465 WeakPolarHBondContact O-CG2 3.37Å; R436-V465 HydrophobicContact CG-CG1 3.74Å; I439-V465 HydrophobicContact CD1-CB 4.25Å; I439-V465 HydrophobicContact CD1-CG2 3.68Å; I439-V465 HydrophobicContact CG1-CG2 4.05Å; V453-V465 VanDerWaalsContact O-CA 3.28Å; V453-V465 WeakPolarHBondContact O-CA 3.49Å; H454-V465 HydrophobicContact CB-CG1 4.43Å; H454-V465 WeakPolarHBondContact ND1-CG1 3.38Å
466	V	97.8	Very high	95.5	Very high	28 Å²	28	49.7 Å²	49.7	17%	0.17	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	136.8	166.6	-165.6	0	0	0	0	108.4	L433 V453 T468 V497	L433-V466 HydrophobicContact CD2-CB 4.39Å; L433-V466 HydrophobicContact CD2-CG2 3.86Å; V453-V466 HydrophobicContact CB-CB 4.36Å; V453-V466 HydrophobicContact CB-CG2 4.06Å; V453-V466 HydrophobicContact CG1-CG2 4.16Å; V453-V466 PolarHBondContact O-N 3.09Å; V466-T468 PolarHBondContact O-N 3.3Å; V466-V497 HydrophobicContact CB-CB 4.16Å; V466-V497 HydrophobicContact CG1-CB 3.61Å; V466-V497 HydrophobicContact CG1-CG1 4.49Å; V466-V497 HydrophobicContact CG1-CG2 3.49Å; V466-V497 VanDerWaalsContact CG1-CG2 3.49Å
467	R	97.4	Very high	95.7	Very high	15 Å²	15	45.6 Å²	45.6	6%	0.057	24%	0.241	C	C	.	.			trans	-58.5	133.4	-176.9	68.4	-174.5	179.5	-177.3	7.2	112	S430 S432 L470 E492 D495 V497	S430-R467 PolarHBondContact O-NH1 2.71Å; S430-R467 PolarHBondContact OG-NH1 3.29Å; S432-R467 WeakPolarHBondContact O-CG 3.49Å; S432-R467 PolarHBondContact O-N 3.46Å; R467-L470 VanDerWaalsContact CZ-CD2 3.42Å; R467-E492 IonicContact CZ-OE1 4Å; R467-E492 IonicContact NH1-OE1 2.74Å; R467-E492 PolarHBondContact NH1-OE1 2.87Å; R467-E492 IonicContact NH1-OE2 3.36Å; R467-E492 IonicContact NH2-OE1 3.1Å; R467-E492 PolarHBondContact NH2-OE1 3.1Å; R467-D495 PolarHBondContact NE-O 2.83Å; R467-D495 PolarHBondContact NH2-O 3.45Å; R467-V497 PolarHBondContact O-N 2.84Å
468	T	97	Very high	96	Very high	19 Å²	19	39.5 Å²	39.5	12%	0.117	21%	0.208	C	C	.	.	S	Bend	trans	-105	-5.7	176.3	58.6	0	0	0	0	112.6	I439 I450 A452 V466 I496 L498	I439-T468 HydrophobicContact CD1-CG2 4.14Å; I450-T468 HydrophobicContact CG2-CG2 3.73Å; A452-T468 HydrophobicContact CB-CG2 3.82Å; V466-T468 PolarHBondContact O-N 3.3Å; T468-I496 WeakPolarHBondContact O-CD1 3.43Å; T468-L498 HydrophobicContact CG2-CD2 3.93Å
469	S	96.5	Very high	96.3	Very high	16 Å²	16	38.5 Å²	38.5	11%	0.112	20%	0.203	C	C	.	.			trans	-148.1	151	170.6	177.2	0	0	0	0	108.2	L471 D605	S469-L471 VanDerWaalsContact C-N 3.33Å; S469-L471 PolarHBondContact OG-N 3.14Å; S469-D605 PolarHBondContact OG-OD2 3.39Å
470	L	98.2	Very high	96.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.196	C	C	.	.	S	Bend	trans	-79.7	-19.6	173.6	-61.7	178.3	0	0	0	112.2	R467 G473 L474 E492 Q494 I496 R512 C514	R467-L470 VanDerWaalsContact CZ-CD2 3.42Å; L470-G473 PolarHBondContact O-N 3.27Å; L470-L474 PolarHBondContact O-N 2.88Å; L470-E492 HydrophobicContact CD1-CB 4.31Å; L470-E492 HydrophobicContact CD1-CG 4.2Å; L470-E492 WeakPolarHBondContact CD1-O 3.4Å; L470-E492 HydrophobicContact CD2-CG 4.32Å; L470-Q494 HydrophobicContact CD2-CB 4.3Å; L470-I496 HydrophobicContact CD2-CG2 4.01Å; L470-I496 HydrophobicContact CG-CG2 3.99Å; L470-R512 HydrophobicContact CD1-CB 3.75Å; L470-R512 WeakPolarHBondContact CD1-O 3.5Å; L470-R512 HydrophobicContact CG-CB 4.2Å; L470-C514 HydrophobicContact CB-CB 3.55Å; L470-C514 HydrophobicContact CD1-CB 4.03Å; L470-C514 HydrophobicContact CG-CB 4.38Å
471	L	98.2	Very high	96.8	Very high	4 Å²	4	33.8 Å²	33.8	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-57.1	-47.4	-172.7	178.4	63.1	0	0	0	113.6	L443 S469 G473 L474 L475 V516 T563 L587 A603	L443-L471 HydrophobicContact CD2-CD2 4.02Å; L443-L471 HydrophobicContact CD2-CG 4.41Å; S469-L471 VanDerWaalsContact C-N 3.33Å; S469-L471 PolarHBondContact OG-N 3.14Å; L471-G473 VanDerWaalsContact C-N 3.27Å; L471-G473 PolarHBondContact O-N 2.89Å; L471-L474 PolarHBondContact O-N 2.92Å; L471-L474 VanDerWaalsContact O-N 3.15Å; L471-L475 HydrophobicContact CD1-CD1 4.16Å; L471-L475 HydrophobicContact CD1-CD2 4.25Å; L471-L475 HydrophobicContact CD1-CG 3.98Å; L471-L475 HydrophobicContact CG-CD1 3.99Å; L471-L475 HydrophobicContact CG-CG 4.22Å; L471-L475 WeakPolarHBondContact O-CG 3.15Å; L471-L475 PolarHBondContact O-N 3.28Å; L471-V516 HydrophobicContact CD1-CG1 3.67Å; L471-T563 HydrophobicContact CD2-CG2 3.86Å; L471-L587 HydrophobicContact CD1-CD1 4.35Å; L471-L587 HydrophobicContact CD2-CD2 3.96Å; L471-A603 HydrophobicContact CD1-CB 3.83Å
472	P	98.1	Very high	96.8	Very high	4 Å²	4	32.5 Å²	32.5	3%	0.026	18%	0.179	C	C	.	.	H	α-helix	trans	-58.2	-37.6	179	-26	36.4	0	0	0	113.6	D438 L443 L475 N476 F595	D438-P472 HydrophobicContact CB-CB 3.93Å; D438-P472 WeakPolarHBondContact O-CG 3.31Å; L443-P472 HydrophobicContact CD1-CG 3.76Å; L443-P472 HydrophobicContact CD2-CG 4.37Å; L443-P472 HydrophobicContact CG-CG 4.23Å; P472-L475 PolarHBondContact O-N 3.34Å; P472-N476 WeakPolarHBondContact O-CB 3.43Å; P472-N476 PolarHBondContact O-N 3.16Å; P472-N476 PolarHBondContact O-ND2 3.48Å; P472-F595 HydrophobicContact CB-CE1 3.95Å; P472-F595 HydrophobicContact CB-CZ 3.8Å; P472-F595 HydrophobicContact CG-CZ 4.34Å
473	G	97.8	Very high	96.8	Very high	16 Å²	16	32.9 Å²	32.9	17%	0.165	19%	0.19	C	C	.	.	H	α-helix	trans	-61.8	-44.2	177.1	0	0	0	0	0	111.9	L470 L471 T477	L470-G473 PolarHBondContact O-N 3.27Å; L471-G473 VanDerWaalsContact C-N 3.27Å; L471-G473 PolarHBondContact O-N 2.89Å; G473-T477 WeakPolarHBondContact O-CB 3.42Å; G473-T477 PolarHBondContact O-N 3.26Å; G473-T477 PolarHBondContact O-OG1 2.9Å
474	L	98.4	Very high	96.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65.7	-40.5	175.1	-65.1	-177.7	0	0	0	112.2	A428 L470 L471 T477 L478 L490 E492 C514 V516	A428-L474 HydrophobicContact CB-CD2 3.74Å; L470-L474 PolarHBondContact O-N 2.88Å; L471-L474 PolarHBondContact O-N 2.92Å; L471-L474 VanDerWaalsContact O-N 3.15Å; L474-T477 WeakPolarHBondContact O-CB 3.29Å; L474-T477 PolarHBondContact O-N 3.46Å; L474-L478 WeakPolarHBondContact O-CG 3.33Å; L474-L478 PolarHBondContact O-N 3.08Å; L474-L490 HydrophobicContact CD2-CB 4.19Å; L474-E492 HydrophobicContact CD2-CB 3.99Å; L474-E492 HydrophobicContact CG-CB 4.48Å; L474-C514 HydrophobicContact CD1-CB 3.95Å; L474-V516 HydrophobicContact CB-CG1 4.21Å; L474-V516 HydrophobicContact CB-CG2 4.06Å; L474-V516 HydrophobicContact CD1-CG1 4.09Å; L474-V516 HydrophobicContact CD1-CG2 4.26Å
475	L	98.4	Very high	96.7	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-67.4	-41.9	178.4	-64.5	-178.9	0	0	0	112.4	L443 L471 P472 T477 L478 A479 L587 V591 F595 L597	L443-L475 HydrophobicContact CD2-CD1 4.4Å; L471-L475 HydrophobicContact CD1-CD1 4.16Å; L471-L475 HydrophobicContact CD1-CD2 4.25Å; L471-L475 HydrophobicContact CD1-CG 3.98Å; L471-L475 HydrophobicContact CG-CD1 3.99Å; L471-L475 HydrophobicContact CG-CG 4.22Å; L471-L475 WeakPolarHBondContact O-CG 3.15Å; L471-L475 PolarHBondContact O-N 3.28Å; P472-L475 PolarHBondContact O-N 3.34Å; L475-T477 VanDerWaalsContact C-N 3.27Å; L475-T477 PolarHBondContact O-N 2.58Å; L475-L478 HydrophobicContact CD2-CD1 4.17Å; L475-L478 WeakPolarHBondContact O-CB 3.47Å; L475-L478 PolarHBondContact O-N 2.99Å; L475-A479 WeakPolarHBondContact O-CB 3.13Å; L475-A479 PolarHBondContact O-N 2.84Å; L475-L587 HydrophobicContact CD1-CD1 3.94Å; L475-L587 HydrophobicContact CD2-CD1 3.67Å; L475-L587 HydrophobicContact CG-CD1 4.39Å; L475-V591 HydrophobicContact CD1-CG1 4.05Å; L475-F595 HydrophobicContact CB-CB 4.03Å; L475-F595 HydrophobicContact CB-CD1 3.66Å; L475-F595 HydrophobicContact CB-CD2 4.11Å; L475-F595 HydrophobicContact CB-CE1 4.12Å; L475-F595 HydrophobicContact CB-CG 3.65Å; L475-F595 HydrophobicContact CD1-CD1 4.47Å; L475-F595 HydrophobicContact CD1-CD2 3.48Å; L475-F595 VanDerWaalsContact CD1-CD2 3.48Å; L475-F595 HydrophobicContact CD1-CE2 3.63Å; L475-F595 HydrophobicContact CD1-CG 3.94Å; L475-F595 HydrophobicContact CD1-CZ 4.21Å; L475-F595 HydrophobicContact CG-CD2 4.44Å; L475-F595 HydrophobicContact CG-CG 4.45Å; L475-L597 HydrophobicContact CD2-CD1 4.02Å
476	N	97.6	Very high	96.6	Very high	54 Å²	54	39.5 Å²	39.5	29%	0.289	24%	0.235	S	C	.	.	H	α-helix	trans	-62.9	-35.8	172.1	-78.4	-33.7	0	0	0	111.6	P472 A479 S480 F595	P472-N476 WeakPolarHBondContact O-CB 3.43Å; P472-N476 PolarHBondContact O-N 3.16Å; P472-N476 PolarHBondContact O-ND2 3.48Å; N476-A479 WeakPolarHBondContact O-CB 3.16Å; N476-A479 PolarHBondContact O-N 2.95Å; N476-S480 PolarHBondContact O-N 3.34Å; N476-S480 PolarHBondContact O-OG 3.24Å; N476-F595 WeakPolarHBondContact OD1-CD1 3.04Å
477	T	97.8	Very high	96.5	Very high	40 Å²	40	41.2 Å²	41.2	25%	0.245	25%	0.247	C	C	.	.	H	α-helix	trans	-65	-45	174.3	-56.7	0	0	0	0	111.2	A428 G473 L474 L475 A479 S480 N481 L490	A428-T477 HydrophobicContact CB-CG2 4.45Å; G473-T477 WeakPolarHBondContact O-CB 3.42Å; G473-T477 PolarHBondContact O-N 3.26Å; G473-T477 PolarHBondContact O-OG1 2.9Å; L474-T477 WeakPolarHBondContact O-CB 3.29Å; L474-T477 PolarHBondContact O-N 3.46Å; L475-T477 VanDerWaalsContact C-N 3.27Å; L475-T477 PolarHBondContact O-N 2.58Å; T477-A479 VanDerWaalsContact C-N 3.3Å; T477-A479 PolarHBondContact O-N 3.3Å; T477-S480 PolarHBondContact O-N 3.08Å; T477-N481 WeakPolarHBondContact O-CB 3.39Å; T477-N481 PolarHBondContact O-N 2.97Å; T477-N481 PolarHBondContact O-ND2 3.16Å; T477-L490 HydrophobicContact CG2-CD1 3.74Å
478	L	97.5	Very high	96.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-59.8	-42.5	172.1	-70.3	175	0	0	0	111.5	L474 L475 S480 N481 R482 L488 L490 V516 Y518 L597	L474-L478 WeakPolarHBondContact O-CG 3.33Å; L474-L478 PolarHBondContact O-N 3.08Å; L475-L478 HydrophobicContact CD2-CD1 4.17Å; L475-L478 WeakPolarHBondContact O-CB 3.47Å; L475-L478 PolarHBondContact O-N 2.99Å; L478-S480 VanDerWaalsContact C-N 3.31Å; L478-S480 PolarHBondContact O-N 3.28Å; L478-N481 CarbonylContact O-C 3.52Å; L478-N481 PolarHBondContact O-N 2.82Å; L478-R482 PolarHBondContact O-N 3.13Å; L478-L488 HydrophobicContact CD2-CB 3.66Å; L478-L488 HydrophobicContact CD2-CD1 3.77Å; L478-L488 HydrophobicContact CD2-CG 4.38Å; L478-L490 HydrophobicContact CD2-CD1 3.59Å; L478-L490 HydrophobicContact CD2-CG 4.04Å; L478-L490 HydrophobicContact CG-CD1 3.9Å; L478-V516 HydrophobicContact CD1-CB 4.44Å; L478-V516 HydrophobicContact CD1-CG2 3.86Å; L478-V516 HydrophobicContact CG-CG2 4.39Å; L478-Y518 HydrophobicContact CD1-CD2 4.44Å; L478-Y518 HydrophobicContact CD1-CG 4.13Å; L478-Y518 HydrophobicContact CD2-CD1 4.48Å; L478-Y518 HydrophobicContact CD2-CG 4.46Å; L478-L597 HydrophobicContact CB-CD1 4.14Å; L478-L597 HydrophobicContact CB-CD2 3.98Å; L478-L597 HydrophobicContact CD1-CD1 4.22Å
479	A	96.8	Very high	96.6	Very high	14 Å²	14	43.3 Å²	43.3	12%	0.116	26%	0.256	C	S	.	.	H	α-helix	trans	-62	-39.6	-178	0	0	0	0	0	111.8	L475 N476 T477 N481 R482 F595 L597	L475-A479 WeakPolarHBondContact O-CB 3.13Å; L475-A479 PolarHBondContact O-N 2.84Å; N476-A479 WeakPolarHBondContact O-CB 3.16Å; N476-A479 PolarHBondContact O-N 2.95Å; T477-A479 VanDerWaalsContact C-N 3.3Å; T477-A479 PolarHBondContact O-N 3.3Å; A479-N481 PolarHBondContact O-N 3.22Å; A479-R482 WeakPolarHBondContact O-CG 3.26Å; A479-R482 PolarHBondContact O-NE 3.15Å; A479-R482 PolarHBondContact O-NH2 3.31Å; A479-F595 VanDerWaalsContact CB-O 3.29Å; A479-F595 WeakPolarHBondContact CB-O 3.37Å; A479-L597 HydrophobicContact CB-CD2 4.24Å
480	S	96.2	Very high	96.6	Very high	102 Å²	102	43.5 Å²	43.5	71%	0.713	26%	0.256	S	S	*	.	H	α-helix	trans	-71.4	-15	174.5	-62.1	0	0	0	0	113.7	N476 T477 L478	N476-S480 PolarHBondContact O-N 3.34Å; N476-S480 PolarHBondContact O-OG 3.24Å; T477-S480 PolarHBondContact O-N 3.08Å; L478-S480 VanDerWaalsContact C-N 3.31Å; L478-S480 PolarHBondContact O-N 3.28Å
481	N	96.1	Very high	96.7	Very high	61 Å²	61	43.6 Å²	43.6	33%	0.326	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.6	23	-174	-72.5	-78.6	0	0	0	113.6	T477 L478 A479 S483 L484	T477-N481 WeakPolarHBondContact O-CB 3.39Å; T477-N481 PolarHBondContact O-N 2.97Å; T477-N481 PolarHBondContact O-ND2 3.16Å; L478-N481 CarbonylContact O-C 3.52Å; L478-N481 PolarHBondContact O-N 2.82Å; A479-N481 PolarHBondContact O-N 3.22Å; N481-S483 PolarHBondContact O-N 2.97Å; N481-L484 HydrophobicContact CB-CD1 3.88Å; N481-L484 HydrophobicContact CB-CG 4.23Å; N481-L484 WeakPolarHBondContact O-CB 3.26Å; N481-L484 PolarHBondContact O-N 2.95Å
482	R	91.2	Very high	96.7	Very high	100 Å²	100	43.4 Å²	43.4	38%	0.377	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-20.4	-178.9	-73.5	178.3	-120.3	165.1	8.2	114.6	L478 A479 L484 E596 L597	L478-R482 PolarHBondContact O-N 3.13Å; A479-R482 WeakPolarHBondContact O-CG 3.26Å; A479-R482 PolarHBondContact O-NE 3.15Å; A479-R482 PolarHBondContact O-NH2 3.31Å; R482-L484 VanDerWaalsContact C-N 3.32Å; R482-E596 VanDerWaalsContact CZ-CB 3.45Å; R482-E596 IonicContact CZ-OE2 3.15Å; R482-E596 PolarHBondContact NE-O 2.92Å; R482-E596 VanDerWaalsContact NH1-CB 3.29Å; R482-E596 PolarHBondContact NH1-O 3.25Å; R482-E596 IonicContact NH1-OE2 2.74Å; R482-E596 IonicContact NH2-OE2 3.92Å; R482-E596 PolarHBondContact NH2-OE2 3.13Å; R482-L597 HydrophobicContact CG-CD2 3.99Å
483	S	92.3	Very high	96.7	Very high	115 Å²	115	43.2 Å²	43.2	80%	0.804	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-13.9	178.2	55.5	0	0	0	0	113.9	N481	N481-S483 PolarHBondContact O-N 2.97Å
484	L	94.8	Very high	96.6	Very high	80 Å²	80	44.8 Å²	44.8	42%	0.419	26%	0.257	S	S	.	.	S	Bend	trans	-73.7	151.4	-179.3	-67	-175	0	0	0	112.1	N481 R482 L488	N481-L484 HydrophobicContact CB-CD1 3.88Å; N481-L484 HydrophobicContact CB-CG 4.23Å; N481-L484 WeakPolarHBondContact O-CB 3.26Å; N481-L484 PolarHBondContact O-N 2.95Å; R482-L484 VanDerWaalsContact C-N 3.32Å; L484-L488 HydrophobicContact CB-CD1 4.5Å; L484-L488 HydrophobicContact CB-CD2 4.02Å; L484-L488 HydrophobicContact CD1-CD2 4.29Å
485	P	95.4	Very high	96.6	Very high	110 Å²	110	46.5 Å²	46.5	71%	0.714	27%	0.266	S	S	*	.	P	Polyproline II helix	trans	-64.4	138.1	175.7	27.3	-34.4	0	0	0	111.3
486	L	95.3	Very high	96.6	Very high	52 Å²	52	46.7 Å²	46.7	27%	0.272	27%	0.267	S	S	.	.	S	Bend	trans	-85.2	155.6	177	-57.9	170.8	0	0	0	111.4	L488 Y518 K520 M599	L486-L488 HydrophobicContact CD2-CG 4.25Å; L486-Y518 HydrophobicContact CD2-CD1 3.72Å; L486-Y518 HydrophobicContact CD2-CE1 4.01Å; L486-K520 HydrophobicContact CD1-CG 4.11Å; L486-M599 HydrophobicContact CD1-CE 3.24Å; L486-M599 HydrophobicContact CD1-SD 3.33Å; L486-M599 WeakPolarHBondContact CD1-SD 3.41Å; L486-M599 HydrophobicContact CD2-CE 3.8Å; L486-M599 HydrophobicContact CG-CE 4.06Å
487	P	95.9	Very high	96.6	Very high	64 Å²	64	45.2 Å²	45.2	42%	0.416	26%	0.26	S	S	.	.	P	Polyproline II helix	cis	-79.3	148	1.2	31.8	-35.3	0	0	0	113.6	Y517 Y518 N519	P487-Y517 HydrophobicContact CB-CE2 3.69Å; P487-Y517 HydrophobicContact CG-CE2 4.27Å; P487-Y518 WeakPolarHBondContact CA-O 3.47Å; P487-N519 HydrophobicContact CB-CB 3.93Å
488	L	97.4	Very high	96.5	Very high	22 Å²	22	45.2 Å²	45.2	12%	0.115	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	126.2	169.2	-65.3	176.2	0	0	0	110.1	L478 L484 L486 Y518	L478-L488 HydrophobicContact CD2-CB 3.66Å; L478-L488 HydrophobicContact CD2-CD1 3.77Å; L478-L488 HydrophobicContact CD2-CG 4.38Å; L484-L488 HydrophobicContact CB-CD1 4.5Å; L484-L488 HydrophobicContact CB-CD2 4.02Å; L484-L488 HydrophobicContact CD1-CD2 4.29Å; L486-L488 HydrophobicContact CD2-CG 4.25Å; L488-Y518 HydrophobicContact CD1-CD1 4.42Å; L488-Y518 PolarHBondContact N-O 2.9Å; L488-Y518 PolarHBondContact O-N 3.3Å
489	K	97.9	Very high	96.5	Very high	55 Å²	55	50.2 Å²	50.2	24%	0.239	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	103.6	178.4	-67.9	-171	-176.9	-179.3	0	109	F425 T426 V516 Y517	F425-K489 HydrophobicContact CB-CB 4.31Å; F425-K489 HydrophobicContact CD1-CB 3.67Å; F425-K489 HydrophobicContact CD1-CG 4.46Å; F425-K489 HydrophobicContact CD2-CB 4.47Å; F425-K489 HydrophobicContact CD2-CD 4.25Å; F425-K489 HydrophobicContact CE1-CB 4.03Å; F425-K489 HydrophobicContact CE1-CG 4.39Å; F425-K489 HydrophobicContact CE2-CD 4.17Å; F425-K489 HydrophobicContact CG-CB 3.89Å; F425-K489 HydrophobicContact CG-CD 4.48Å; F425-K489 HydrophobicContact CZ-CD 4.33Å; T426-K489 PolarHBondContact N-O 3.33Å; K489-V516 WeakPolarHBondContact CA-O 3.33Å; K489-Y517 HydrophobicContact CD-CD2 4.34Å; K489-Y517 HydrophobicContact CG-CD2 3.78Å; K489-Y517 HydrophobicContact CG-CE2 4.21Å
490	L	98.5	Very high	96.4	Very high	21 Å²	21	51.4 Å²	51.4	11%	0.11	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	149	-179.9	-56.2	-178	0	0	0	110.6	T426 L474 T477 L478 A515 V516	T426-L490 CarbonylContact O-C 3.56Å; T426-L490 VanDerWaalsContact O-CA 3.31Å; T426-L490 WeakPolarHBondContact O-CA 3.48Å; L474-L490 HydrophobicContact CD2-CB 4.19Å; T477-L490 HydrophobicContact CG2-CD1 3.74Å; L478-L490 HydrophobicContact CD2-CD1 3.59Å; L478-L490 HydrophobicContact CD2-CG 4.04Å; L478-L490 HydrophobicContact CG-CD1 3.9Å; L490-A515 CarbonylContact O-C 3.55Å; L490-A515 WeakPolarHBondContact O-CA 3.34Å; L490-V516 HydrophobicContact CB-CG2 3.78Å; L490-V516 PolarHBondContact N-O 3.19Å; L490-V516 VanDerWaalsContact N-O 3.08Å; L490-V516 PolarHBondContact O-N 3.12Å
491	F	98.6	Very high	96.3	Very high	1 Å²	1	52.6 Å²	52.6	0%	0.004	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	162.4	170.4	81	-77.2	0	0	0	111.1	R417 I420 A421 F425 T426 E427 A428 V493 C514 A515	R417-F491 HydrophobicContact CB-CE2 4.33Å; R417-F491 HydrophobicContact CG-CE2 4.22Å; I420-F491 HydrophobicContact CB-CD1 4.4Å; I420-F491 HydrophobicContact CB-CD2 3.91Å; I420-F491 HydrophobicContact CB-CE1 4.24Å; I420-F491 HydrophobicContact CB-CE2 3.79Å; I420-F491 HydrophobicContact CB-CG 4.21Å; I420-F491 HydrophobicContact CB-CZ 3.94Å; I420-F491 HydrophobicContact CD1-CD2 3.75Å; I420-F491 HydrophobicContact CD1-CE2 4.02Å; I420-F491 HydrophobicContact CG1-CD2 4.45Å; I420-F491 HydrophobicContact CG1-CE2 4.49Å; I420-F491 HydrophobicContact CG2-CB 3.83Å; I420-F491 HydrophobicContact CG2-CD1 3.54Å; I420-F491 HydrophobicContact CG2-CD2 3.54Å; I420-F491 HydrophobicContact CG2-CE1 3.83Å; I420-F491 HydrophobicContact CG2-CE2 3.87Å; I420-F491 HydrophobicContact CG2-CG 3.34Å; I420-F491 HydrophobicContact CG2-CZ 3.99Å; A421-F491 HydrophobicContact CB-CE1 4.36Å; A421-F491 HydrophobicContact CB-CZ 4.35Å; F425-F491 HydrophobicContact CB-CB 4.37Å; F425-F491 HydrophobicContact CB-CD1 3.52Å; F425-F491 HydrophobicContact CB-CE1 4.15Å; F425-F491 HydrophobicContact CB-CG 4.27Å; F425-F491 HydrophobicContact CD1-CB 4.43Å; T426-F491 VanDerWaalsContact C-CD1 3.46Å; T426-F491 WeakPolarHBondContact O-CD1 3.25Å; T426-F491 PolarHBondContact O-N 2.79Å; E427-F491 CarbonylContact C-O 3.57Å; E427-F491 VanDerWaalsContact CA-CE1 3.45Å; E427-F491 VanDerWaalsContact CA-O 3.29Å; E427-F491 WeakPolarHBondContact CA-O 3.44Å; E427-F491 HydrophobicContact CB-CD1 4.11Å; E427-F491 HydrophobicContact CB-CE1 3.53Å; E427-F491 HydrophobicContact CB-CE2 4.12Å; E427-F491 HydrophobicContact CB-CZ 3.53Å; E427-F491 HydrophobicContact CG-CD2 4.38Å; E427-F491 HydrophobicContact CG-CE1 4.2Å; E427-F491 HydrophobicContact CG-CE2 3.9Å; E427-F491 HydrophobicContact CG-CZ 3.83Å; A428-F491 PolarHBondContact N-O 3.4Å; F491-V493 HydrophobicContact CD2-CG2 3.86Å; F491-V493 HydrophobicContact CE2-CG2 3.88Å; F491-C514 CarbonylContact C-O 3.49Å; F491-C514 WeakPolarHBondContact CA-O 3.42Å; F491-C514 WeakPolarHBondContact CB-O 3.5Å; F491-A515 HydrophobicContact CB-CB 3.9Å
492	E	98.4	Very high	96.3	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	135.4	169.9	-178.7	169.8	174.1	0	0	108.1	A428 S430 R467 L470 L474 Q494 C514	A428-E492 WeakPolarHBondContact O-CG 3.5Å; S430-E492 WeakPolarHBondContact CB-OE2 3.49Å; S430-E492 PolarHBondContact N-OE2 3.41Å; S430-E492 PolarHBondContact OG-OE1 3.37Å; S430-E492 PolarHBondContact OG-OE2 3.5Å; R467-E492 IonicContact CZ-OE1 4Å; R467-E492 IonicContact NH1-OE1 2.74Å; R467-E492 PolarHBondContact NH1-OE1 2.87Å; R467-E492 IonicContact NH1-OE2 3.36Å; R467-E492 IonicContact NH2-OE1 3.1Å; R467-E492 PolarHBondContact NH2-OE1 3.1Å; L470-E492 HydrophobicContact CD1-CB 4.31Å; L470-E492 HydrophobicContact CD1-CG 4.2Å; L470-E492 WeakPolarHBondContact CD1-O 3.4Å; L470-E492 HydrophobicContact CD2-CG 4.32Å; L474-E492 HydrophobicContact CD2-CB 3.99Å; L474-E492 HydrophobicContact CG-CB 4.48Å; E492-Q494 HydrophobicContact CG-CB 4.12Å; E492-C514 PolarHBondContact N-O 3.01Å; E492-C514 PolarHBondContact O-N 2.88Å
493	V	98	Very high	96.3	Very high	0 Å²	0	55 Å²	55	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	99.9	169.8	-166	0	0	0	0	109	T413 V416 R417 I420 F491 R512 I513 L608	T413-V493 HydrophobicContact CG2-CB 4.07Å; T413-V493 HydrophobicContact CG2-CG1 3.6Å; V416-V493 HydrophobicContact CG1-CG2 4.3Å; R417-V493 HydrophobicContact CG-CB 3.94Å; R417-V493 HydrophobicContact CG-CG2 3.87Å; R417-V493 PolarHBondContact NH2-O 3.48Å; I420-V493 HydrophobicContact CD1-CG2 3.95Å; F491-V493 HydrophobicContact CD2-CG2 3.86Å; F491-V493 HydrophobicContact CE2-CG2 3.88Å; V493-R512 CarbonylContact C-O 3.5Å; V493-R512 VanDerWaalsContact CA-O 3.26Å; V493-R512 WeakPolarHBondContact CA-O 3.46Å; V493-R512 WeakPolarHBondContact CG1-O 3.32Å; V493-I513 HydrophobicContact CB-CG1 4.5Å; V493-I513 HydrophobicContact CG1-CG1 3.73Å; V493-I513 HydrophobicContact CG2-CB 4.48Å; V493-I513 HydrophobicContact CG2-CG1 4.05Å; V493-I513 HydrophobicContact CG2-CG2 4.28Å; V493-L608 HydrophobicContact CG1-CD2 3.94Å
494	Q	97	Very high	96.3	Very high	49 Å²	49	57 Å²	57	23%	0.229	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	175.3	-176.7	-97.1	-53	96.5	0	0	112.7	L470 E492 R512	L470-Q494 HydrophobicContact CD2-CB 4.3Å; E492-Q494 HydrophobicContact CG-CB 4.12Å; Q494-R512 PolarHBondContact N-O 3.31Å; Q494-R512 PolarHBondContact O-N 3.33Å
495	D	97.4	Very high	96.2	Very high	36 Å²	36	58.6 Å²	58.6	19%	0.193	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	140.7	-179.9	-59	-33.9	0	0	0	112.5	R467 N509 H510 R511	R467-D495 PolarHBondContact NE-O 2.83Å; R467-D495 PolarHBondContact NH2-O 3.45Å; D495-N509 HydrophobicContact CB-CB 4.24Å; D495-H510 WeakPolarHBondContact CA-O 3.36Å; D495-R511 VanDerWaalsContact CG-NH2 3.27Å; D495-R511 WeakPolarHBondContact OD1-CA 3.42Å; D495-R511 IonicContact OD1-CZ 2.75Å; D495-R511 VanDerWaalsContact OD1-CZ 3.25Å; D495-R511 IonicContact OD1-NE 3.95Å; D495-R511 PolarHBondContact OD1-NE 3.49Å; D495-R511 IonicContact OD1-NH2 3.7Å; D495-R511 PolarHBondContact OD1-NH2 3.11Å; D495-R511 VanDerWaalsContact OD1-NH2 3.1Å; D495-R511 IonicContact OD2-CZ 3.49Å; D495-R511 IonicContact OD2-NE 3.48Å; D495-R511 IonicContact OD2-NH2 3.39Å; D495-R511 PolarHBondContact OD2-NH2 2.83Å
496	I	97.6	Very high	96.2	Very high	4 Å²	4	54.9 Å²	54.9	2%	0.021	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	160.9	157.1	65.9	169.9	0	0	0	108.6	T468 L470 L498 N509 H510 R512	T468-I496 WeakPolarHBondContact O-CD1 3.43Å; L470-I496 HydrophobicContact CD2-CG2 4.01Å; L470-I496 HydrophobicContact CG-CG2 3.99Å; I496-L498 HydrophobicContact CD1-CD1 4.32Å; I496-L498 HydrophobicContact CD1-CD2 4.24Å; I496-L498 HydrophobicContact CD1-CG 4.26Å; I496-N509 CarbonylContact O-C 3.57Å; I496-N509 WeakPolarHBondContact O-CA 3.42Å; I496-H510 HydrophobicContact CD1-CB 4.39Å; I496-H510 HydrophobicContact CG1-CB 3.89Å; I496-H510 PolarHBondContact N-O 2.87Å; I496-H510 PolarHBondContact O-N 2.98Å; I496-R512 HydrophobicContact CB-CG 4.31Å; I496-R512 HydrophobicContact CD1-CG 3.7Å; I496-R512 HydrophobicContact CG1-CG 3.64Å; I496-R512 HydrophobicContact CG2-CB 4.47Å; I496-R512 HydrophobicContact CG2-CG 3.8Å
497	V	98.1	Very high	96.2	Very high	23 Å²	23	53.3 Å²	53.3	14%	0.139	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	127.7	177.9	-174.2	0	0	0	0	109.9	V453 V466 R467 A507 N509	V453-V497 HydrophobicContact CG2-CG1 3.93Å; V466-V497 HydrophobicContact CB-CB 4.16Å; V466-V497 HydrophobicContact CG1-CB 3.61Å; V466-V497 HydrophobicContact CG1-CG1 4.49Å; V466-V497 HydrophobicContact CG1-CG2 3.49Å; V466-V497 VanDerWaalsContact CG1-CG2 3.49Å; R467-V497 PolarHBondContact O-N 2.84Å; V497-A507 HydrophobicContact CG1-CB 3.95Å; V497-N509 WeakPolarHBondContact CG2-OD1 3.33Å
498	L	97.1	Very high	96.2	Very high	41 Å²	41	51.1 Å²	51.1	22%	0.215	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	141.5	176.4	-56.2	178.5	0	0	0	109.5	P451 T468 I496 N500 A507 S508	P451-L498 HydrophobicContact CG-CB 4.37Å; P451-L498 HydrophobicContact CG-CD2 4.17Å; P451-L498 CarbonylContact O-C 3.54Å; P451-L498 WeakPolarHBondContact O-CA 3.26Å; T468-L498 HydrophobicContact CG2-CD2 3.93Å; I496-L498 HydrophobicContact CD1-CD1 4.32Å; I496-L498 HydrophobicContact CD1-CD2 4.24Å; I496-L498 HydrophobicContact CD1-CG 4.26Å; L498-N500 PolarHBondContact O-N 3.33Å; L498-A507 CarbonylContact O-C 3.54Å; L498-A507 WeakPolarHBondContact O-CA 3.37Å; L498-S508 PolarHBondContact N-O 3.27Å; L498-S508 PolarHBondContact O-N 2.91Å
499	K	96.8	Very high	96.1	Very high	104 Å²	104	54.5 Å²	54.5	45%	0.452	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	130.6	168.6	-84.2	178	170.1	151.3	0	109.2	P451 A452 V453	P451-K499 HydrophobicContact CB-CB 4.04Å; P451-K499 PolarHBondContact O-N 3.2Å; A452-K499 WeakPolarHBondContact O-CD 3.46Å; A452-K499 WeakPolarHBondContact O-CE 3.38Å; A452-K499 WeakPolarHBondContact O-CG 3.33Å; A452-K499 PolarHBondContact O-NZ 2.97Å; V453-K499 HydrophobicContact CG2-CG 3.85Å
500	N	95.5	Very high	96	Very high	39 Å²	39	54 Å²	54	21%	0.209	31%	0.306	C	S	.	.			trans	-144.7	95.1	-179.2	-170.6	-13.4	0	0	0	109.9	L498 S502 K503 G506 S508	L498-N500 PolarHBondContact O-N 3.33Å; N500-S502 PolarHBondContact O-N 3.44Å; N500-S502 WeakPolarHBondContact OD1-CB 3.49Å; N500-S502 PolarHBondContact OD1-N 2.64Å; N500-S502 VanDerWaalsContact OD1-N 3.11Å; N500-S502 PolarHBondContact OD1-OG 3.41Å; N500-K503 HydrophobicContact CB-CG 4.31Å; N500-K503 PolarHBondContact O-N 2.97Å; N500-K503 VanDerWaalsContact O-N 3.12Å; N500-G506 CarbonylContact C-O 3.55Å; N500-G506 PolarHBondContact N-O 3.46Å; N500-G506 CarbonylContact O-C 3.55Å; N500-G506 VanDerWaalsContact O-CA 3.31Å; N500-G506 WeakPolarHBondContact O-CA 3.19Å; N500-S508 PolarHBondContact ND2-OG 2.59Å
501	P	94.1	Very high	96	Very high	128 Å²	128	54.1 Å²	54.1	83%	0.831	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-14.9	179.8	-22.7	33.5	0	0	0	114.5	K503	P501-K503 VanDerWaalsContact C-N 3.31Å
502	S	94.8	Very high	95.9	Very high	98 Å²	98	56 Å²	56	69%	0.685	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-14.2	178	72.5	0	0	0	0	113.7	N500	N500-S502 PolarHBondContact O-N 3.44Å; N500-S502 WeakPolarHBondContact OD1-CB 3.49Å; N500-S502 PolarHBondContact OD1-N 2.64Å; N500-S502 VanDerWaalsContact OD1-N 3.11Å; N500-S502 PolarHBondContact OD1-OG 3.41Å
503	K	92.5	Very high	95.9	Very high	112 Å²	112	56 Å²	56	49%	0.487	31%	0.312	S	S	.	.	S	Bend	trans	-92.9	147.1	175.4	-64.5	-64.6	-173.4	175	0	109.9	N500 P501 V505 G506 A507	N500-K503 HydrophobicContact CB-CG 4.31Å; N500-K503 PolarHBondContact O-N 2.97Å; N500-K503 VanDerWaalsContact O-N 3.12Å; P501-K503 VanDerWaalsContact C-N 3.31Å; K503-V505 VanDerWaalsContact C-N 3.25Å; K503-V505 HydrophobicContact CB-CG2 4.46Å; K503-V505 PolarHBondContact O-N 2.93Å; K503-G506 PolarHBondContact O-N 2.82Å; K503-A507 WeakPolarHBondContact CB-O 3.41Å
504	D	91.2	Very high	95.9	Very high	159 Å²	159	56 Å²	56	85%	0.85	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-39.7	176	58.8	-21.6	0	0	0	113	G506	D504-G506 VanDerWaalsContact C-N 3.3Å; D504-G506 PolarHBondContact O-N 2.85Å
505	V	93	Very high	96	Very high	112 Å²	112	53.6 Å²	53.6	68%	0.679	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-1.8	176.9	-60.3	0	0	0	0	113.8	K503 A507	K503-V505 VanDerWaalsContact C-N 3.25Å; K503-V505 HydrophobicContact CB-CG2 4.46Å; K503-V505 PolarHBondContact O-N 2.93Å; V505-A507 WeakPolarHBondContact CG2-O 3.47Å; V505-A507 PolarHBondContact O-N 3.42Å
506	G	94.7	Very high	96	Very high	32 Å²	32	51.9 Å²	51.9	33%	0.33	29%	0.292	S	S	.	.	S	Bend	trans	70.6	9.3	179.8	0	0	0	0	0	115.4	N500 K503 D504	N500-G506 CarbonylContact C-O 3.55Å; N500-G506 PolarHBondContact N-O 3.46Å; N500-G506 CarbonylContact O-C 3.55Å; N500-G506 VanDerWaalsContact O-CA 3.31Å; N500-G506 WeakPolarHBondContact O-CA 3.19Å; K503-G506 PolarHBondContact O-N 2.82Å; D504-G506 VanDerWaalsContact C-N 3.3Å; D504-G506 PolarHBondContact O-N 2.85Å
507	A	96.5	Very high	96.1	Very high	20 Å²	20	52.6 Å²	52.6	17%	0.165	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	162.5	-179.4	0	0	0	0	0	111.4	V453 V497 L498 K503 V505	V453-A507 HydrophobicContact CG2-CB 3.85Å; V497-A507 HydrophobicContact CG1-CB 3.95Å; L498-A507 CarbonylContact O-C 3.54Å; L498-A507 WeakPolarHBondContact O-CA 3.37Å; K503-A507 WeakPolarHBondContact CB-O 3.41Å; V505-A507 WeakPolarHBondContact CG2-O 3.47Å; V505-A507 PolarHBondContact O-N 3.42Å
508	S	95.4	Very high	96.1	Very high	17 Å²	17	51.5 Å²	51.5	12%	0.119	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	141.4	175.5	56.4	0	0	0	0	111.1	L498 N500 H510	L498-S508 PolarHBondContact N-O 3.27Å; L498-S508 PolarHBondContact O-N 2.91Å; N500-S508 PolarHBondContact ND2-OG 2.59Å; S508-H510 PolarHBondContact O-CD2 3.12Å; S508-H510 PolarHBondContact OG-NE2 3.14Å
509	N	95.6	Very high	96.1	Very high	93 Å²	93	50.8 Å²	50.8	50%	0.497	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	146.4	171.3	-64.5	-2.3	0	0	0	110	D495 I496 V497	D495-N509 HydrophobicContact CB-CB 4.24Å; I496-N509 CarbonylContact O-C 3.57Å; I496-N509 WeakPolarHBondContact O-CA 3.42Å; V497-N509 WeakPolarHBondContact CG2-OD1 3.33Å
510	H	95.5	Very high	96	Very high	44 Å²	44	54 Å²	54	20%	0.204	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	119.7	173.8	-62	-101.7	0	0	0	108.9	D495 I496 S508 R512 E609	D495-H510 WeakPolarHBondContact CA-O 3.36Å; I496-H510 HydrophobicContact CD1-CB 4.39Å; I496-H510 HydrophobicContact CG1-CB 3.89Å; I496-H510 PolarHBondContact N-O 2.87Å; I496-H510 PolarHBondContact O-N 2.98Å; S508-H510 PolarHBondContact O-CD2 3.12Å; S508-H510 PolarHBondContact OG-NE2 3.14Å; H510-R512 PolarHBondContact O-N 2.96Å; H510-E609 WeakPolarHBondContact CA-OE1 3.35Å
511	R	97.4	Very high	96	Very high	24 Å²	24	56.5 Å²	56.5	9%	0.091	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	117.9	176.8	-173.7	62	52.1	139.2	-8.3	110.9	I409 D495 L608 E609	I409-R511 HydrophobicContact CD1-CB 3.8Å; I409-R511 HydrophobicContact CD1-CG 3.72Å; I409-R511 HydrophobicContact CG1-CB 3.84Å; I409-R511 HydrophobicContact CG1-CG 3.96Å; D495-R511 VanDerWaalsContact CG-NH2 3.27Å; D495-R511 WeakPolarHBondContact OD1-CA 3.42Å; D495-R511 IonicContact OD1-CZ 2.75Å; D495-R511 VanDerWaalsContact OD1-CZ 3.25Å; D495-R511 IonicContact OD1-NE 3.95Å; D495-R511 PolarHBondContact OD1-NE 3.49Å; D495-R511 IonicContact OD1-NH2 3.7Å; D495-R511 PolarHBondContact OD1-NH2 3.11Å; D495-R511 VanDerWaalsContact OD1-NH2 3.1Å; D495-R511 IonicContact OD2-CZ 3.49Å; D495-R511 IonicContact OD2-NE 3.48Å; D495-R511 IonicContact OD2-NH2 3.39Å; D495-R511 PolarHBondContact OD2-NH2 2.83Å; R511-L608 HydrophobicContact CB-CB 4.49Å; R511-L608 HydrophobicContact CG-CB 4.11Å; R511-L608 HydrophobicContact CG-CD2 3.98Å; R511-L608 HydrophobicContact CG-CG 4.43Å; R511-L608 WeakPolarHBondContact O-CB 3.46Å; R511-L608 PolarHBondContact O-N 3.24Å; R511-E609 HydrophobicContact CB-CG 3.71Å; R511-E609 PolarHBondContact N-OE1 2.74Å
512	R	97.5	Very high	95.9	Very high	40 Å²	40	52 Å²	52	15%	0.151	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	153.1	-179.5	-54.3	-63.2	-70.3	-145.9	-4.3	111.4	L470 V493 Q494 I496 H510 D605 L606 D607	L470-R512 HydrophobicContact CD1-CB 3.75Å; L470-R512 WeakPolarHBondContact CD1-O 3.5Å; L470-R512 HydrophobicContact CG-CB 4.2Å; V493-R512 CarbonylContact C-O 3.5Å; V493-R512 VanDerWaalsContact CA-O 3.26Å; V493-R512 WeakPolarHBondContact CA-O 3.46Å; V493-R512 WeakPolarHBondContact CG1-O 3.32Å; Q494-R512 PolarHBondContact N-O 3.31Å; Q494-R512 PolarHBondContact O-N 3.33Å; I496-R512 HydrophobicContact CB-CG 4.31Å; I496-R512 HydrophobicContact CD1-CG 3.7Å; I496-R512 HydrophobicContact CG1-CG 3.64Å; I496-R512 HydrophobicContact CG2-CB 4.47Å; I496-R512 HydrophobicContact CG2-CG 3.8Å; H510-R512 PolarHBondContact O-N 2.96Å; R512-D605 IonicContact CZ-OD1 2.79Å; R512-D605 IonicContact NE-OD1 3.49Å; R512-D605 PolarHBondContact NE-OD1 2.89Å; R512-D605 VanDerWaalsContact NE-OD1 3.1Å; R512-D605 IonicContact NH2-OD1 3.15Å; R512-D605 PolarHBondContact NH2-OD1 2.84Å; R512-D605 IonicContact NH2-OD2 3.67Å; R512-L606 CarbonylContact C-O 3.54Å; R512-L606 WeakPolarHBondContact CA-O 3.36Å; R512-D607 IonicContact NH1-OD2 3.87Å
513	I	97.9	Very high	95.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	128.4	162.5	-60.3	156.3	0	0	0	106.7	V416 I420 V493 L534 D605 L606 L608	V416-I513 HydrophobicContact CG1-CD1 3.69Å; V416-I513 HydrophobicContact CG1-CG1 4.02Å; I420-I513 HydrophobicContact CD1-CG2 3.67Å; V493-I513 HydrophobicContact CB-CG1 4.5Å; V493-I513 HydrophobicContact CG1-CG1 3.73Å; V493-I513 HydrophobicContact CG2-CB 4.48Å; V493-I513 HydrophobicContact CG2-CG1 4.05Å; V493-I513 HydrophobicContact CG2-CG2 4.28Å; I513-L534 HydrophobicContact CD1-CD1 4.43Å; I513-L534 HydrophobicContact CG2-CD1 4.34Å; I513-D605 CarbonylContact O-C 3.46Å; I513-D605 WeakPolarHBondContact O-CA 3.36Å; I513-L606 HydrophobicContact CB-CB 4.39Å; I513-L606 HydrophobicContact CD1-CD2 4.19Å; I513-L606 PolarHBondContact N-O 2.77Å; I513-L606 PolarHBondContact O-N 2.72Å; I513-L608 HydrophobicContact CD1-CB 4.14Å; I513-L608 HydrophobicContact CD1-CD1 3.85Å; I513-L608 HydrophobicContact CD1-CD2 4.19Å; I513-L608 HydrophobicContact CD1-CG 4.27Å; I513-L608 HydrophobicContact CG1-CB 4.24Å; I513-L608 HydrophobicContact CG1-CD2 4.19Å
514	C	98.6	Very high	95.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	138.3	167.5	-169.7	0	0	0	0	110.3	L470 L474 F491 E492 L604	L470-C514 HydrophobicContact CB-CB 3.55Å; L470-C514 HydrophobicContact CD1-CB 4.03Å; L470-C514 HydrophobicContact CG-CB 4.38Å; L474-C514 HydrophobicContact CD1-CB 3.95Å; F491-C514 CarbonylContact C-O 3.49Å; F491-C514 WeakPolarHBondContact CA-O 3.42Å; F491-C514 WeakPolarHBondContact CB-O 3.5Å; E492-C514 PolarHBondContact N-O 3.01Å; E492-C514 PolarHBondContact O-N 2.88Å; C514-L604 CarbonylContact C-O 3.53Å; C514-L604 WeakPolarHBondContact CA-O 3.3Å; C514-L604 PolarHBondContact SG-O 2.98Å
515	A	98.6	Very high	96	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	144.9	178	0	0	0	0	0	110.4	F425 L490 F491 I527 L530 A603 L604	F425-A515 HydrophobicContact CD1-CB 4.25Å; F425-A515 HydrophobicContact CE1-CB 4.04Å; L490-A515 CarbonylContact O-C 3.55Å; L490-A515 WeakPolarHBondContact O-CA 3.34Å; F491-A515 HydrophobicContact CB-CB 3.9Å; A515-I527 HydrophobicContact CB-CD1 4.25Å; A515-L530 HydrophobicContact CB-CD2 3.36Å; A515-A603 CarbonylContact O-C 3.54Å; A515-A603 WeakPolarHBondContact O-CA 3.33Å; A515-L604 PolarHBondContact N-O 2.91Å; A515-L604 PolarHBondContact O-N 3.46Å
516	V	98.5	Very high	96.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	140.6	-179.7	-63.3	0	0	0	0	111.3	L471 L474 L478 K489 L490 S602 A603	L471-V516 HydrophobicContact CD1-CG1 3.67Å; L474-V516 HydrophobicContact CB-CG1 4.21Å; L474-V516 HydrophobicContact CB-CG2 4.06Å; L474-V516 HydrophobicContact CD1-CG1 4.09Å; L474-V516 HydrophobicContact CD1-CG2 4.26Å; L478-V516 HydrophobicContact CD1-CB 4.44Å; L478-V516 HydrophobicContact CD1-CG2 3.86Å; L478-V516 HydrophobicContact CG-CG2 4.39Å; K489-V516 WeakPolarHBondContact CA-O 3.33Å; L490-V516 HydrophobicContact CB-CG2 3.78Å; L490-V516 PolarHBondContact N-O 3.19Å; L490-V516 VanDerWaalsContact N-O 3.08Å; L490-V516 PolarHBondContact O-N 3.12Å; V516-S602 CarbonylContact C-O 3.58Å; V516-S602 VanDerWaalsContact CA-O 3.27Å; V516-S602 WeakPolarHBondContact CA-O 3.48Å; V516-A603 HydrophobicContact CG1-CB 3.98Å
517	Y	98.4	Very high	96.2	Very high	18 Å²	18	40 Å²	40	7%	0.071	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	114.2	172.2	178.3	-90.8	0	0	0	108.7	P487 K489 N519 S522 I526 C601 S602	P487-Y517 HydrophobicContact CB-CE2 3.69Å; P487-Y517 HydrophobicContact CG-CE2 4.27Å; K489-Y517 HydrophobicContact CD-CD2 4.34Å; K489-Y517 HydrophobicContact CG-CD2 3.78Å; K489-Y517 HydrophobicContact CG-CE2 4.21Å; Y517-N519 HydrophobicContact CD1-CB 4.34Å; Y517-N519 HydrophobicContact CE1-CB 3.52Å; Y517-N519 PolarHBondContact OH-ND2 3Å; Y517-S522 WeakPolarHBondContact CD1-O 3.47Å; Y517-I526 HydrophobicContact CD2-CB 4.08Å; Y517-I526 HydrophobicContact CD2-CG1 4.18Å; Y517-I526 HydrophobicContact CD2-CG2 3.76Å; Y517-I526 HydrophobicContact CE2-CB 4.44Å; Y517-I526 HydrophobicContact CE2-CG1 4.02Å; Y517-I526 HydrophobicContact CE2-CG2 4.24Å; Y517-I526 HydrophobicContact CG-CB 4.31Å; Y517-I526 HydrophobicContact CG-CG2 4.35Å; Y517-C601 CarbonylContact O-C 3.42Å; Y517-C601 VanDerWaalsContact O-CA 3.28Å; Y517-C601 WeakPolarHBondContact O-CA 3.41Å; Y517-S602 PolarHBondContact N-O 3.23Å; Y517-S602 PolarHBondContact O-N 3.03Å
518	Y	98.2	Very high	96.1	Very high	1 Å²	1	41.7 Å²	41.7	0%	0.004	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	118.3	-176.8	-176	-111	0	0	0	110.8	L478 L486 P487 L488 L597 T598 M599 P600 C601	L478-Y518 HydrophobicContact CD1-CD2 4.44Å; L478-Y518 HydrophobicContact CD1-CG 4.13Å; L478-Y518 HydrophobicContact CD2-CD1 4.48Å; L478-Y518 HydrophobicContact CD2-CG 4.46Å; L486-Y518 HydrophobicContact CD2-CD1 3.72Å; L486-Y518 HydrophobicContact CD2-CE1 4.01Å; P487-Y518 WeakPolarHBondContact CA-O 3.47Å; L488-Y518 HydrophobicContact CD1-CD1 4.42Å; L488-Y518 PolarHBondContact N-O 2.9Å; L488-Y518 PolarHBondContact O-N 3.3Å; Y518-L597 HydrophobicContact CD2-CD1 4.5Å; Y518-L597 HydrophobicContact CE1-CD2 4.34Å; Y518-L597 HydrophobicContact CE2-CB 3.92Å; Y518-L597 HydrophobicContact CE2-CD1 4.14Å; Y518-L597 HydrophobicContact CE2-CD2 4.23Å; Y518-L597 HydrophobicContact CE2-CG 4.32Å; Y518-T598 PolarHBondContact OH-N 2.82Å; Y518-T598 VanDerWaalsContact OH-N 3.14Å; Y518-M599 HydrophobicContact CD1-CE 4.25Å; Y518-M599 HydrophobicContact CE1-CB 4.43Å; Y518-M599 HydrophobicContact CE1-CE 3.34Å; Y518-M599 HydrophobicContact CE2-CB 3.82Å; Y518-M599 WeakPolarHBondContact CE2-O 3.23Å; Y518-M599 PolarHBondContact OH-N 2.94Å; Y518-P600 WeakPolarHBondContact CD2-O 3.49Å; Y518-C601 HydrophobicContact CD2-CB 3.88Å
519	N	97.3	Very high	96.1	Very high	25 Å²	25	42.2 Å²	42.2	13%	0.134	21%	0.211	C	C	.	.	S	Bend	trans	-159.8	176.4	-177	-164.2	11	0	0	0	111.4	P487 Y517 N521 P600	P487-N519 HydrophobicContact CB-CB 3.93Å; Y517-N519 HydrophobicContact CD1-CB 4.34Å; Y517-N519 HydrophobicContact CE1-CB 3.52Å; Y517-N519 PolarHBondContact OH-ND2 3Å; N519-N521 CarbonylContact C-O 3.37Å; N519-N521 PolarHBondContact ND2-OD1 3.09Å; N519-N521 VanDerWaalsContact ND2-OD1 3.16Å; N519-N521 PolarHBondContact O-N 2.89Å; N519-P600 PolarHBondContact N-O 3.34Å; N519-P600 WeakPolarHBondContact O-CD 3.42Å
520	K	95.5	Very high	96.1	Very high	171 Å²	171	37.8 Å²	37.8	74%	0.743	19%	0.188	S	C	*	.	S	Bend	trans	-57.5	-28.8	173.5	-62.2	-178.6	-178.9	178.2	0	113.3	L486 M599	L486-K520 HydrophobicContact CD1-CG 4.11Å; K520-M599 HydrophobicContact CG-SD 4.23Å
521	N	95.5	Very high	96.1	Very high	93 Å²	93	36.3 Å²	36.3	50%	0.497	18%	0.181	S	C	.	.	S	Bend	trans	-114	160.9	170.8	61.9	2.5	0	0	0	110.2	N519 G523	N519-N521 CarbonylContact C-O 3.37Å; N519-N521 PolarHBondContact ND2-OD1 3.09Å; N519-N521 VanDerWaalsContact ND2-OD1 3.16Å; N519-N521 PolarHBondContact O-N 2.89Å; N521-G523 VanDerWaalsContact C-N 3.34Å; N521-G523 PolarHBondContact O-N 3.38Å
522	S	91.6	Very high	95.9	Very high	33 Å²	33	37.6 Å²	37.6	23%	0.231	19%	0.19	C	C	.	.			trans	-67	-32.3	-176	55.8	0	0	0	0	113.8	Y517 F524 I586 S602	Y517-S522 WeakPolarHBondContact CD1-O 3.47Å; S522-F524 PolarHBondContact O-N 3.37Å; S522-I586 VanDerWaalsContact CB-CD1 3.5Å; S522-I586 WeakPolarHBondContact OG-CD1 3.35Å; S522-S602 WeakPolarHBondContact O-CB 3.27Å; S522-S602 PolarHBondContact O-OG 2.84Å
523	G	91.5	Very high	95.7	Very high	5 Å²	5	40.5 Å²	40.5	5%	0.052	20%	0.201	C	C	.	.			trans	52.8	40.3	-178.2	0	0	0	0	0	113.2	N521 E525 I526	N521-G523 VanDerWaalsContact C-N 3.34Å; N521-G523 PolarHBondContact O-N 3.38Å; G523-E525 PolarHBondContact O-N 3Å; G523-E525 VanDerWaalsContact O-N 3.16Å; G523-I526 VanDerWaalsContact O-CB 3.29Å; G523-I526 WeakPolarHBondContact O-CB 3.47Å; G523-I526 PolarHBondContact O-N 2.93Å
524	F	93.6	Very high	95.5	Very high	55 Å²	55	40.5 Å²	40.5	24%	0.241	20%	0.201	C	C	.	.	H	α-helix	trans	-54.2	-35.5	-179	174.5	-97.1	0	0	0	111.7	S522 I526 I527 H528 L584 I586	S522-F524 PolarHBondContact O-N 3.37Å; F524-I526 PolarHBondContact O-N 3.3Å; F524-I527 PolarHBondContact O-N 3.08Å; F524-H528 HydrophobicContact CE1-CB 4.31Å; F524-H528 PolarHBondContact O-N 2.79Å; F524-L584 HydrophobicContact CE2-CD1 4.24Å; F524-L584 HydrophobicContact CE2-CG 4.25Å; F524-L584 HydrophobicContact CZ-CD1 4.11Å; F524-L584 HydrophobicContact CZ-CG 4.36Å; F524-I586 HydrophobicContact CB-CD1 4.43Å; F524-I586 HydrophobicContact CB-CG1 4.26Å; F524-I586 HydrophobicContact CD2-CG1 4.22Å
525	E	95.3	Very high	95.3	Very high	137 Å²	137	41.1 Å²	41.1	64%	0.64	20%	0.204	S	C	*	.	H	α-helix	trans	-62.5	-27.2	178.5	-52.6	76.6	-166.3	0	0	112.4	G523 G529	G523-E525 PolarHBondContact O-N 3Å; G523-E525 VanDerWaalsContact O-N 3.16Å; E525-G529 PolarHBondContact O-N 2.68Å
526	I	96.5	Very high	94.9	Very high	63 Å²	63	47.8 Å²	47.8	32%	0.323	24%	0.235	S	C	.	.	H	α-helix	trans	-70.9	-44.6	177.4	-56.8	-62.2	0	0	0	110.5	F425 Y517 G523 F524 G529 L530	F425-I526 HydrophobicContact CE2-CG2 4.43Å; F425-I526 HydrophobicContact CZ-CG2 4.1Å; Y517-I526 HydrophobicContact CD2-CB 4.08Å; Y517-I526 HydrophobicContact CD2-CG1 4.18Å; Y517-I526 HydrophobicContact CD2-CG2 3.76Å; Y517-I526 HydrophobicContact CE2-CB 4.44Å; Y517-I526 HydrophobicContact CE2-CG1 4.02Å; Y517-I526 HydrophobicContact CE2-CG2 4.24Å; Y517-I526 HydrophobicContact CG-CB 4.31Å; Y517-I526 HydrophobicContact CG-CG2 4.35Å; G523-I526 VanDerWaalsContact O-CB 3.29Å; G523-I526 WeakPolarHBondContact O-CB 3.47Å; G523-I526 PolarHBondContact O-N 2.93Å; F524-I526 PolarHBondContact O-N 3.3Å; I526-G529 PolarHBondContact O-N 3.29Å; I526-L530 PolarHBondContact O-N 2.91Å
527	I	95.6	Very high	94.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-72.3	-37.9	178	-68.8	-65	0	0	0	110.9	F425 A515 F524 L530 L531 L584 L604	F425-I527 HydrophobicContact CE1-CD1 3.99Å; F425-I527 HydrophobicContact CZ-CD1 4.03Å; A515-I527 HydrophobicContact CB-CD1 4.25Å; F524-I527 PolarHBondContact O-N 3.08Å; I527-L530 WeakPolarHBondContact O-CB 3.47Å; I527-L530 PolarHBondContact O-N 3.2Å; I527-L531 PolarHBondContact O-N 3.42Å; I527-L584 HydrophobicContact CG2-CB 4.17Å; I527-L584 HydrophobicContact CG2-CD1 4.47Å; I527-L604 HydrophobicContact CG2-CB 3.47Å; I527-L604 VanDerWaalsContact CG2-CB 3.47Å
528	H	94.6	Very high	94.2	Very high	56 Å²	56	51.3 Å²	51.3	26%	0.259	25%	0.254	S	S	.	.	H	α-helix	trans	-61.6	-45.2	171.8	-171.8	-81.2	0	0	0	111.6	F524 L530 L531 D532 L584	F524-H528 HydrophobicContact CE1-CB 4.31Å; F524-H528 PolarHBondContact O-N 2.79Å; H528-L530 VanDerWaalsContact C-N 3.29Å; H528-L530 PolarHBondContact O-N 2.83Å; H528-L531 WeakPolarHBondContact O-CB 3.4Å; H528-L531 PolarHBondContact O-N 2.95Å; H528-L531 VanDerWaalsContact O-N 3.13Å; H528-D532 IonicContact CE1-OD1 3.68Å; H528-D532 IonicContact CE1-OD2 3.69Å; H528-D532 PolarHBondContact CE1-OD2 2.87Å; H528-D532 IonicContact ND1-OD2 2.84Å; H528-D532 PolarHBondContact ND1-OD2 3.2Å; H528-D532 PolarHBondContact O-N 2.74Å; H528-L584 HydrophobicContact CB-CD1 4.18Å
529	G	95.3	Very high	93.8	Very high	29 Å²	29	59.9 Å²	59.9	30%	0.299	30%	0.295	S	S	.	.	H	α-helix	trans	-63.4	-33.4	176.1	0	0	0	0	0	113.3	E525 I526 R533	E525-G529 PolarHBondContact O-N 2.68Å; I526-G529 PolarHBondContact O-N 3.29Å; G529-R533 PolarHBondContact O-N 2.84Å
530	L	96	Very high	93.3	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-62.1	-48.2	170.3	176.9	62.3	0	0	0	111.2	I420 M423 F425 A515 I526 I527 H528 D532 R533 L534 L604	I420-L530 HydrophobicContact CG1-CD1 4.12Å; I420-L530 HydrophobicContact CG2-CD1 4.16Å; I420-L530 HydrophobicContact CG2-CD2 4.48Å; M423-L530 HydrophobicContact CE-CB 4.36Å; M423-L530 HydrophobicContact CE-CD1 4.06Å; M423-L530 HydrophobicContact SD-CD1 3.38Å; M423-L530 WeakPolarHBondContact SD-CD1 3.47Å; F425-L530 HydrophobicContact CD2-CD2 4.49Å; F425-L530 HydrophobicContact CE1-CD2 4.15Å; F425-L530 HydrophobicContact CE2-CB 4.44Å; F425-L530 HydrophobicContact CE2-CD1 4.38Å; F425-L530 HydrophobicContact CE2-CD2 3.99Å; F425-L530 HydrophobicContact CZ-CD2 3.8Å; A515-L530 HydrophobicContact CB-CD2 3.36Å; I526-L530 PolarHBondContact O-N 2.91Å; I527-L530 WeakPolarHBondContact O-CB 3.47Å; I527-L530 PolarHBondContact O-N 3.2Å; H528-L530 VanDerWaalsContact C-N 3.29Å; H528-L530 PolarHBondContact O-N 2.83Å; L530-D532 PolarHBondContact O-N 3.09Å; L530-R533 PolarHBondContact O-N 3.06Å; L530-L534 HydrophobicContact CD1-CD1 4.38Å; L530-L534 HydrophobicContact CD1-CG 4.32Å; L530-L534 HydrophobicContact CG-CD1 4.21Å; L530-L534 WeakPolarHBondContact O-CG 3.36Å; L530-L534 PolarHBondContact O-N 3.3Å; L530-L604 HydrophobicContact CD2-CD2 4.11Å; L530-L604 HydrophobicContact CG-CD2 4.22Å
531	L	95.2	Very high	92.6	Very high	13 Å²	13	60.5 Å²	60.5	7%	0.068	30%	0.302	C	S	.	.	H	α-helix	trans	-58.6	-47.1	176.3	177.2	62.1	0	0	0	111.5	I527 H528 R533 L534 M535 I572 L584 L604 L606	I527-L531 PolarHBondContact O-N 3.42Å; H528-L531 WeakPolarHBondContact O-CB 3.4Å; H528-L531 PolarHBondContact O-N 2.95Å; H528-L531 VanDerWaalsContact O-N 3.13Å; L531-R533 VanDerWaalsContact C-N 3.31Å; L531-R533 PolarHBondContact O-N 3.18Å; L531-L534 PolarHBondContact O-N 2.82Å; L531-M535 HydrophobicContact CD1-CE 3.76Å; L531-M535 HydrophobicContact CD1-CG 4.14Å; L531-M535 HydrophobicContact CD1-SD 4.46Å; L531-M535 HydrophobicContact CG-CG 4.41Å; L531-M535 WeakPolarHBondContact O-CG 3.18Å; L531-M535 PolarHBondContact O-N 2.83Å; L531-I572 HydrophobicContact CD1-CD1 3.75Å; L531-I572 HydrophobicContact CD2-CD1 3.62Å; L531-I572 HydrophobicContact CD2-CG1 3.87Å; L531-I572 HydrophobicContact CG-CD1 4.34Å; L531-L584 HydrophobicContact CD2-CD1 4Å; L531-L584 HydrophobicContact CD2-CD2 3.91Å; L531-L604 HydrophobicContact CB-CD1 4.49Å; L531-L604 HydrophobicContact CB-CD2 4.33Å; L531-L604 HydrophobicContact CD1-CD1 4.17Å; L531-L606 HydrophobicContact CD1-CD2 4.34Å
532	D	93.2	Very high	91.5	Very high	50 Å²	50	59.3 Å²	59.3	27%	0.267	30%	0.301	S	S	.	.	H	α-helix	trans	-58.5	-42.5	178.7	-73	-32.4	0	0	0	111.8	H528 L530 M535 Q536	H528-D532 IonicContact CE1-OD1 3.68Å; H528-D532 IonicContact CE1-OD2 3.69Å; H528-D532 PolarHBondContact CE1-OD2 2.87Å; H528-D532 IonicContact ND1-OD2 2.84Å; H528-D532 PolarHBondContact ND1-OD2 3.2Å; H528-D532 PolarHBondContact O-N 2.74Å; L530-D532 PolarHBondContact O-N 3.09Å; D532-M535 PolarHBondContact O-N 3.17Å; D532-Q536 WeakPolarHBondContact O-CG 3.38Å; D532-Q536 PolarHBondContact O-N 3.1Å
533	R	93.4	Very high	90.3	Very high	102 Å²	102	64.1 Å²	64.1	39%	0.385	32%	0.322	S	S	.	.	H	α-helix	trans	-66.4	-41.6	176.5	179.3	54.2	-179.7	-102.2	-1.3	112	E419 M423 G529 L530 L531 M535 Q536 L537	E419-R533 VanDerWaalsContact CD-CZ 3.47Å; E419-R533 HydrophobicContact CG-CG 4.26Å; E419-R533 IonicContact OE1-CZ 3.01Å; E419-R533 IonicContact OE1-NE 2.95Å; E419-R533 PolarHBondContact OE1-NE 2.77Å; E419-R533 IonicContact OE1-NH1 3.65Å; E419-R533 IonicContact OE1-NH2 3.13Å; E419-R533 PolarHBondContact OE1-NH2 2.69Å; E419-R533 IonicContact OE2-CZ 3.89Å; E419-R533 IonicContact OE2-NE 2.78Å; E419-R533 IonicContact OE2-NH2 3.81Å; E419-R533 PolarHBondContact OE2-NH2 3.18Å; M423-R533 HydrophobicContact CE-CB 3.73Å; M423-R533 HydrophobicContact CE-CG 4.1Å; M423-R533 HydrophobicContact SD-CB 3.62Å; M423-R533 HydrophobicContact SD-CG 3.48Å; M423-R533 WeakPolarHBondContact SD-CG 3.46Å; G529-R533 PolarHBondContact O-N 2.84Å; L530-R533 PolarHBondContact O-N 3.06Å; L531-R533 VanDerWaalsContact C-N 3.31Å; L531-R533 PolarHBondContact O-N 3.18Å; R533-M535 VanDerWaalsContact C-N 3.34Å; R533-Q536 PolarHBondContact O-N 3.2Å; R533-L537 PolarHBondContact O-N 3.19Å
534	L	94	Very high	88.8	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-61.1	-44.1	175.6	-71.8	175.1	0	0	0	111.2	V416 I420 I513 L530 L531 Q536 L537 L538 L604	V416-L534 HydrophobicContact CG1-CD2 3.86Å; I420-L534 HydrophobicContact CD1-CD2 4.22Å; I420-L534 HydrophobicContact CG1-CD2 3.89Å; I513-L534 HydrophobicContact CD1-CD1 4.43Å; I513-L534 HydrophobicContact CG2-CD1 4.34Å; L530-L534 HydrophobicContact CD1-CD1 4.38Å; L530-L534 HydrophobicContact CD1-CG 4.32Å; L530-L534 HydrophobicContact CG-CD1 4.21Å; L530-L534 WeakPolarHBondContact O-CG 3.36Å; L530-L534 PolarHBondContact O-N 3.3Å; L531-L534 PolarHBondContact O-N 2.82Å; L534-Q536 PolarHBondContact O-N 3.14Å; L534-L537 PolarHBondContact O-N 3.33Å; L534-L538 WeakPolarHBondContact O-CB 3.48Å; L534-L538 WeakPolarHBondContact O-CG 3.3Å; L534-L538 PolarHBondContact O-N 3.24Å; L534-L604 HydrophobicContact CD1-CD2 4.08Å
535	M	93	Very high	86.9	Confident	13 Å²	13	71.2 Å²	71.2	6%	0.064	37%	0.367	C	S	.	.	H	α-helix	trans	-63.5	-40.9	177.7	-66	-56.8	104.4	0	0	111.8	L531 D532 R533 L537 L538 Q539 V540 L606 F611	L531-M535 HydrophobicContact CD1-CE 3.76Å; L531-M535 HydrophobicContact CD1-CG 4.14Å; L531-M535 HydrophobicContact CD1-SD 4.46Å; L531-M535 HydrophobicContact CG-CG 4.41Å; L531-M535 WeakPolarHBondContact O-CG 3.18Å; L531-M535 PolarHBondContact O-N 2.83Å; D532-M535 PolarHBondContact O-N 3.17Å; R533-M535 VanDerWaalsContact C-N 3.34Å; M535-L537 PolarHBondContact O-N 2.79Å; M535-L538 HydrophobicContact CE-CD1 3.89Å; M535-L538 CarbonylContact O-C 3.51Å; M535-L538 PolarHBondContact O-N 3.14Å; M535-Q539 PolarHBondContact O-N 3.49Å; M535-V540 HydrophobicContact CB-CB 4.45Å; M535-V540 PolarHBondContact O-N 2.92Å; M535-V540 HydrophobicContact SD-CB 4.1Å; M535-V540 HydrophobicContact SD-CG1 4.13Å; M535-L606 HydrophobicContact CE-CD2 3.69Å; M535-F611 HydrophobicContact CE-CE2 4.4Å; M535-F611 HydrophobicContact CE-CZ 3.81Å; M535-F611 HydrophobicContact SD-CZ 4.25Å
536	Q	91.6	Very high	84.6	Confident	140 Å²	140	73.9 Å²	73.9	65%	0.654	38%	0.376	S	S	*	.	H	α-helix	trans	-61.2	-43.5	173.9	-72.7	173.4	19.2	0	0	112.3	D532 R533 L534 L538 Q539	D532-Q536 WeakPolarHBondContact O-CG 3.38Å; D532-Q536 PolarHBondContact O-N 3.1Å; R533-Q536 PolarHBondContact O-N 3.2Å; L534-Q536 PolarHBondContact O-N 3.14Å; Q536-L538 VanDerWaalsContact C-N 3.34Å; Q536-Q539 PolarHBondContact O-N 3.12Å; Q536-Q539 VanDerWaalsContact O-N 3.14Å
537	L	91.2	Very high	82.1	Confident	61 Å²	61	75.7 Å²	75.7	32%	0.319	39%	0.39	S	S	.	.	H	α-helix	trans	-64.8	-40	178	179.8	140.3	0	0	0	111.8	V416 E419 R533 L534 M535 Q539	V416-L537 HydrophobicContact CG2-CD2 4.26Å; E419-L537 HydrophobicContact CB-CD1 3.75Å; E419-L537 HydrophobicContact CG-CD1 3.68Å; R533-L537 PolarHBondContact O-N 3.19Å; L534-L537 PolarHBondContact O-N 3.33Å; M535-L537 PolarHBondContact O-N 2.79Å; L537-Q539 PolarHBondContact O-N 3.22Å
538	L	91.1	Very high	79.2	Confident	31 Å²	31	81.8 Å²	81.8	16%	0.162	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-0.5	176.3	-64.4	168.2	0	0	0	112.9	L412 L534 M535 Q536 V540 L608 F611	L412-L538 HydrophobicContact CD1-CD2 3.77Å; L534-L538 WeakPolarHBondContact O-CB 3.48Å; L534-L538 WeakPolarHBondContact O-CG 3.3Å; L534-L538 PolarHBondContact O-N 3.24Å; M535-L538 HydrophobicContact CE-CD1 3.89Å; M535-L538 CarbonylContact O-C 3.51Å; M535-L538 PolarHBondContact O-N 3.14Å; Q536-L538 VanDerWaalsContact C-N 3.34Å; L538-V540 HydrophobicContact CB-CG2 3.95Å; L538-V540 PolarHBondContact O-N 3.15Å; L538-L608 HydrophobicContact CD2-CD1 4.47Å; L538-F611 HydrophobicContact CD1-CD1 4.16Å; L538-F611 HydrophobicContact CD1-CD2 3.73Å; L538-F611 HydrophobicContact CD1-CE1 4.22Å; L538-F611 HydrophobicContact CD1-CE2 3.77Å; L538-F611 HydrophobicContact CD1-CG 3.91Å; L538-F611 HydrophobicContact CD1-CZ 4.01Å; L538-F611 HydrophobicContact CD2-CB 4.15Å; L538-F611 HydrophobicContact CD2-CG 4.31Å
539	Q	89.1	Confident	76.5	Confident	181 Å²	181	87.1 Å²	87.1	85%	0.846	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	34.8	-177.1	-56.8	-175.7	-6.9	0	0	113.7	M535 Q536 L537	M535-Q539 PolarHBondContact O-N 3.49Å; Q536-Q539 PolarHBondContact O-N 3.12Å; Q536-Q539 VanDerWaalsContact O-N 3.14Å; L537-Q539 PolarHBondContact O-N 3.22Å
540	V	87.1	Confident	73.6	Confident	42 Å²	42	95.4 Å²	95.4	26%	0.255	48%	0.478	S	S	.	.			trans	-98.5	120.3	177.7	-178.7	0	0	0	0	108.7	M535 L538 S542 F611	M535-V540 HydrophobicContact CB-CB 4.45Å; M535-V540 PolarHBondContact O-N 2.92Å; M535-V540 HydrophobicContact SD-CB 4.1Å; M535-V540 HydrophobicContact SD-CG1 4.13Å; L538-V540 HydrophobicContact CB-CG2 3.95Å; L538-V540 PolarHBondContact O-N 3.15Å; V540-S542 PolarHBondContact O-N 3.16Å; V540-F611 HydrophobicContact CG2-CD1 3.85Å; V540-F611 HydrophobicContact CG2-CE1 3.69Å
541	E	81.4	Confident	70.8	Confident	167 Å²	167	98.6 Å²	98.6	78%	0.78	50%	0.5	S	S	*	.			trans	-68.8	119.1	177.1	-171.1	175.6	178.7	0	0	110.3	I543	E541-I543 PolarHBondContact O-N 3.31Å
542	S	70.6	Confident	67.9	Low	67 Å²	67	105.1 Å²	105.1	47%	0.469	54%	0.535	S	S	.	.			trans	-82.1	106.9	176.6	-177.8	0	0	0	0	110	V540	V540-S542 PolarHBondContact O-N 3.16Å
543	I	66.4	Low	65.2	Low	134 Å²	134	106.3 Å²	106.3	69%	0.687	54%	0.542	S	S	*	.			trans	-93.9	101	171.1	-54.7	173	0	0	0	107.8	E541 S545	E541-I543 PolarHBondContact O-N 3.31Å; I543-S545 PolarHBondContact O-N 2.61Å
544	L	60.6	Low	62.4	Low	136 Å²	136	109.5 Å²	109.5	71%	0.712	56%	0.561	S	S	*	*			trans	-70.6	79.9	165.5	-70.9	172.6	0	0	0	108.7	K546	L544-K546 PolarHBondContact O-N 3.24Å
545	S	54.1	Low	59.6	Low	74 Å²	74	117.6 Å²	117.6	52%	0.517	60%	0.599	S	S	.	*			trans	-64.8	100.7	176.2	178.6	0	0	0	0	109.3	I543 T547	I543-S545 PolarHBondContact O-N 2.61Å; S545-T547 PolarHBondContact O-N 3.42Å; S545-T547 WeakPolarHBondContact OG-CB 3.39Å; S545-T547 WeakPolarHBondContact OG-CG2 3.37Å; S545-T547 PolarHBondContact OG-N 2.85Å; S545-T547 PolarHBondContact OG-OG1 2.99Å
546	K	45.9	Very low	57	Low	192 Å²	192	127.2 Å²	127.2	84%	0.835	63%	0.634	S	S	*	*			trans	-71.7	61.2	158.2	-67.3	-177.1	-177.9	176	0	108.5	L544 T548	L544-K546 PolarHBondContact O-N 3.24Å; K546-T548 PolarHBondContact O-N 2.81Å; K546-T548 PolarHBondContact O-OG1 2.9Å
547	T	44.2	Very low	54.6	Low	101 Å²	101	127.3 Å²	127.3	62%	0.62	64%	0.639	S	S	*	*			trans	-71.7	80.7	169.5	24.5	0	0	0	0	108.7	S545 K549	S545-T547 PolarHBondContact O-N 3.42Å; S545-T547 WeakPolarHBondContact OG-CB 3.39Å; S545-T547 WeakPolarHBondContact OG-CG2 3.37Å; S545-T547 PolarHBondContact OG-N 2.85Å; S545-T547 PolarHBondContact OG-OG1 2.99Å; T547-K549 PolarHBondContact O-N 3.37Å
548	T	35.9	Very low	52.3	Low	128 Å²	128	128.5 Å²	128.5	79%	0.785	65%	0.652	S	S	*	*			trans	-67.5	42.5	156.1	41.6	0	0	0	0	110.7	K546 K550	K546-T548 PolarHBondContact O-N 2.81Å; K546-T548 PolarHBondContact O-OG1 2.9Å; T548-K550 PolarHBondContact O-N 3.03Å
549	K	36.9	Very low	50.3	Low	169 Å²	169	134.4 Å²	134.4	74%	0.735	68%	0.684	S	S	*	*			trans	-72.7	94.7	163.1	-85.1	-173.5	176.8	176.7	0	106.1	T547 S551	T547-K549 PolarHBondContact O-N 3.37Å; K549-S551 PolarHBondContact O-N 2.85Å
550	K	33.9	Very low	49.3	Very low	203 Å²	203	128.6 Å²	128.6	88%	0.883	66%	0.659	S	S	*	*			trans	-63.3	46.7	157.7	-68.9	-178.4	172.9	-179.9	0	110.4	T548	T548-K550 PolarHBondContact O-N 3.03Å
551	S	37.5	Very low	49.1	Very low	66 Å²	66	127.6 Å²	127.6	46%	0.462	65%	0.652	S	S	.	*			trans	-70.4	140.5	157.8	49.7	0	0	0	0	106	K549 D553	K549-S551 PolarHBondContact O-N 2.85Å; S551-D553 WeakPolarHBondContact CB-OD2 3.42Å; S551-D553 PolarHBondContact O-N 2.91Å; S551-D553 PolarHBondContact OG-OD2 2.99Å
552	N	35.1	Very low	49.6	Very low	150 Å²	150	121.9 Å²	121.9	80%	0.802	63%	0.629	S	S	*	*	S	Bend	trans	-66.2	28.8	-174.9	-73.2	-35.7	0	0	0	113.9	H554	N552-H554 PolarHBondContact O-N 3.38Å
553	D	36.5	Very low	50.8	Low	76 Å²	76	118.9 Å²	118.9	41%	0.406	61%	0.608	S	S	.	*			trans	-82.5	67.9	-179.4	-54.8	-35.7	0	0	0	109.1	S551 E555 R556	S551-D553 WeakPolarHBondContact CB-OD2 3.42Å; S551-D553 PolarHBondContact O-N 2.91Å; S551-D553 PolarHBondContact OG-OD2 2.99Å; D553-E555 PolarHBondContact O-N 3Å; D553-R556 HydrophobicContact CB-CB 4.18Å; D553-R556 HydrophobicContact CB-CG 4.48Å; D553-R556 PolarHBondContact O-N 3.31Å; D553-R556 VanDerWaalsContact O-N 3.15Å
554	H	33.9	Very low	52.2	Low	169 Å²	169	112.9 Å²	112.9	78%	0.782	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.8	-7.9	157.2	-79.9	69.6	0	0	0	111.8	N552	N552-H554 PolarHBondContact O-N 3.38Å
555	E	36.5	Very low	53.8	Low	170 Å²	170	110.4 Å²	110.4	79%	0.794	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-20.7	176.9	-66.1	-175.5	164.1	0	0	114.7	D553	D553-E555 PolarHBondContact O-N 3Å
556	R	38.6	Very low	55.4	Low	215 Å²	215	112 Å²	112	81%	0.811	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-19.8	179.7	-94.2	-174.2	178.2	-169.2	-1.1	114.4	D553	D553-R556 HydrophobicContact CB-CB 4.18Å; D553-R556 HydrophobicContact CB-CG 4.48Å; D553-R556 PolarHBondContact O-N 3.31Å; D553-R556 VanDerWaalsContact O-N 3.15Å
557	N	40.5	Very low	57.4	Low	141 Å²	141	106 Å²	106	75%	0.754	56%	0.556	S	S	*	*	S	Bend	trans	-97.3	0.8	-175.9	-83.6	-9.9	0	0	0	115.1	L560	N557-L560 VanDerWaalsContact O-CD1 3.3Å; N557-L560 WeakPolarHBondContact O-CD1 3.42Å
558	S	42.4	Very low	59.6	Low	86 Å²	86	108.6 Å²	108.6	60%	0.601	55%	0.554	S	S	*	*	S	Bend	trans	-108.9	-4	-169.4	56.8	0	0	0	0	116.1
559	N	48.7	Very low	62.3	Low	156 Å²	156	103.8 Å²	103.8	83%	0.834	53%	0.525	S	S	*	.			trans	-102.1	44.8	175	-103.4	-9.6	0	0	0	112.3
560	L	68.5	Low	64.9	Low	59 Å²	59	97.8 Å²	97.8	31%	0.309	51%	0.508	S	S	.	.			trans	-62.3	139.8	169.7	-92.9	70.2	0	0	0	109.4	N557 C569	N557-L560 VanDerWaalsContact O-CD1 3.3Å; N557-L560 WeakPolarHBondContact O-CD1 3.42Å; L560-C569 WeakPolarHBondContact CD2-SG 3.22Å; L560-C569 VanDerWaalsContact CG-SG 3.55Å
561	N	84	Confident	67.7	Low	20 Å²	20	91.4 Å²	91.4	11%	0.107	48%	0.483	C	S	.	.			trans	-59.6	123.3	179.2	178.2	-36.3	0	0	0	110.1	T563 Y564 R583	N561-T563 PolarHBondContact O-N 3.01Å; N561-T563 WeakPolarHBondContact OD1-CB 3.39Å; N561-T563 PolarHBondContact OD1-N 2.95Å; N561-T563 PolarHBondContact OD1-OG1 2.75Å; N561-Y564 HydrophobicContact CB-CD2 4.07Å; N561-Y564 HydrophobicContact CB-CE2 4.49Å; N561-Y564 PolarHBondContact O-N 3.01Å; N561-R583 PolarHBondContact ND2-NH1 3.05Å
562	P	91.7	Very high	70.3	Confident	48 Å²	48	89.1 Å²	89.1	31%	0.312	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-12.8	-172.4	28.1	-37.3	0	0	0	114	R444 Q445 Y564	R444-P562 HydrophobicContact CB-CB 4.07Å; R444-P562 WeakPolarHBondContact CD-O 3.35Å; R444-P562 PolarHBondContact NH1-O 3.47Å; R444-P562 VanDerWaalsContact O-CG 3.23Å; R444-P562 WeakPolarHBondContact O-CG 3.21Å; Q445-P562 HydrophobicContact CG-CG 4.37Å; P562-Y564 PolarHBondContact O-N 3.01Å
563	T	95.5	Very high	73	Confident	3 Å²	3	86.3 Å²	86.3	2%	0.018	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-30	173.6	-49.1	0	0	0	0	111.5	L443 Q445 L471 N561 L587 H588 V591	L443-T563 HydrophobicContact CB-CG2 4.19Å; L443-T563 HydrophobicContact CD2-CG2 3.8Å; L443-T563 HydrophobicContact CG-CG2 4.48Å; L443-T563 WeakPolarHBondContact O-CA 3.12Å; L443-T563 PolarHBondContact O-OG1 2.85Å; L443-T563 VanDerWaalsContact O-OG1 3.09Å; Q445-T563 PolarHBondContact NE2-OG1 2.78Å; L471-T563 HydrophobicContact CD2-CG2 3.86Å; N561-T563 PolarHBondContact O-N 3.01Å; N561-T563 WeakPolarHBondContact OD1-CB 3.39Å; N561-T563 PolarHBondContact OD1-N 2.95Å; N561-T563 PolarHBondContact OD1-OG1 2.75Å; T563-L587 HydrophobicContact CG2-CD2 4.19Å; T563-H588 PolarHBondContact O-N 3.35Å; T563-V591 HydrophobicContact CG2-CG2 4.39Å; T563-V591 WeakPolarHBondContact O-CG2 3.47Å
564	Y	95.9	Very high	75.5	Confident	8 Å²	8	85 Å²	85	3%	0.031	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	164.5	-177	-59.5	-87.7	0	0	0	112.3	N561 P562 C569 R583 I586 L587 A603	N561-Y564 HydrophobicContact CB-CD2 4.07Å; N561-Y564 HydrophobicContact CB-CE2 4.49Å; N561-Y564 PolarHBondContact O-N 3.01Å; P562-Y564 PolarHBondContact O-N 3.01Å; Y564-C569 HydrophobicContact CD1-CB 4.17Å; Y564-C569 HydrophobicContact CD2-CB 4.36Å; Y564-C569 HydrophobicContact CG-CB 3.78Å; Y564-R583 HydrophobicContact CE2-CB 3.98Å; Y564-I586 CarbonylContact C-O 3.55Å; Y564-I586 WeakPolarHBondContact CA-O 3.34Å; Y564-L587 HydrophobicContact CD1-CD2 3.93Å; Y564-L587 HydrophobicContact CE1-CD2 3.9Å; Y564-A603 HydrophobicContact CE1-CB 4.28Å
565	F	93.6	Very high	77.9	Confident	85 Å²	85	82.3 Å²	82.3	37%	0.373	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	132.2	178.9	-169	-137.1	0	0	0	111	G567 R568 I586 P589	F565-G567 PolarHBondContact O-N 3.13Å; F565-R568 HydrophobicContact CB-CB 4.3Å; F565-R568 HydrophobicContact CD1-CB 4.2Å; F565-R568 HydrophobicContact CD1-CG 3.89Å; F565-R568 WeakPolarHBondContact O-CA 3.28Å; F565-R568 PolarHBondContact O-N 3.47Å; F565-I586 HydrophobicContact CB-CB 4.38Å; F565-I586 WeakPolarHBondContact CB-O 3Å; F565-I586 PolarHBondContact N-O 2.91Å; F565-P589 HydrophobicContact CD2-CG 4.37Å; F565-P589 HydrophobicContact CE2-CG 4.35Å
566	D	88.4	Confident	80.2	Confident	107 Å²	107	80.5 Å²	80.5	57%	0.572	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.9	128.9	-171.7	-62.7	-17.7	0	0	0	111.9	R568	D566-R568 PolarHBondContact O-N 3.29Å
567	G	86.9	Confident	82.1	Confident	66 Å²	66	73.4 Å²	73.4	68%	0.68	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	70.8	6.5	-177.2	0	0	0	0	0	114.9	F565	F565-G567 PolarHBondContact O-N 3.13Å
568	R	91	Very high	84.3	Confident	156 Å²	156	70.4 Å²	70.4	59%	0.589	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.5	30.2	179.1	-63	-64.8	-171.2	153	1.1	112.8	F565 D566 G585 I586	F565-R568 HydrophobicContact CB-CB 4.3Å; F565-R568 HydrophobicContact CD1-CB 4.2Å; F565-R568 HydrophobicContact CD1-CG 3.89Å; F565-R568 WeakPolarHBondContact O-CA 3.28Å; F565-R568 PolarHBondContact O-N 3.47Å; D566-R568 PolarHBondContact O-N 3.29Å; R568-G585 WeakPolarHBondContact O-CA 3.38Å; R568-I586 HydrophobicContact CB-CB 4.22Å; R568-I586 HydrophobicContact CB-CD1 4Å; R568-I586 HydrophobicContact CB-CG1 4.19Å; R568-I586 HydrophobicContact CG-CD1 4.24Å; R568-I586 PolarHBondContact O-N 2.75Å
569	C	92.3	Very high	86.6	Confident	26 Å²	26	71.6 Å²	71.6	18%	0.176	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	163.2	169.5	70	0	0	0	0	111.8	L560 Y564 L584	L560-C569 WeakPolarHBondContact CD2-SG 3.22Å; L560-C569 VanDerWaalsContact CG-SG 3.55Å; Y564-C569 HydrophobicContact CD1-CB 4.17Å; Y564-C569 HydrophobicContact CD2-CB 4.36Å; Y564-C569 HydrophobicContact CG-CB 3.78Å; C569-L584 CarbonylContact C-O 3.08Å; C569-L584 WeakPolarHBondContact CA-O 3.39Å; C569-L584 WeakPolarHBondContact CB-O 3.29Å
570	A	91.6	Very high	88.7	Confident	44 Å²	44	68 Å²	68	36%	0.364	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	144.8	176	0	0	0	0	0	110.2	R583 L584	A570-R583 WeakPolarHBondContact O-CA 3.41Å; A570-L584 HydrophobicContact CB-CD2 3.94Å; A570-L584 PolarHBondContact N-O 3.33Å; A570-L584 PolarHBondContact O-N 3.14Å
571	D	92.1	Very high	89.9	Confident	68 Å²	68	65.5 Å²	65.5	36%	0.364	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	140.5	165.5	-73.1	-27.9	0	0	0	109.2	I573 I580 R583	D571-I573 HydrophobicContact CB-CG1 4.27Å; D571-I580 HydrophobicContact CB-CG1 4.41Å; D571-I580 HydrophobicContact CB-CG2 4.14Å; D571-R583 VanDerWaalsContact OD1-CD 3.29Å; D571-R583 WeakPolarHBondContact OD1-CD 3.48Å; D571-R583 VanDerWaalsContact OD1-CG 3.26Å; D571-R583 WeakPolarHBondContact OD1-CG 3.29Å; D571-R583 IonicContact OD1-CZ 2.75Å; D571-R583 IonicContact OD1-NE 3.15Å; D571-R583 PolarHBondContact OD1-NE 3.32Å
572	I	92.5	Very high	90.3	Very high	18 Å²	18	64.7 Å²	64.7	9%	0.092	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	115.3	173.7	-54	168.2	0	0	0	106.6	L531 I580 I581 G582 L584 L604 L606	L531-I572 HydrophobicContact CD1-CD1 3.75Å; L531-I572 HydrophobicContact CD2-CD1 3.62Å; L531-I572 HydrophobicContact CD2-CG1 3.87Å; L531-I572 HydrophobicContact CG-CD1 4.34Å; I572-I580 WeakPolarHBondContact O-CA 3.31Å; I572-I581 HydrophobicContact CB-CG1 4.2Å; I572-I581 HydrophobicContact CG2-CD1 3.99Å; I572-I581 HydrophobicContact CG2-CG1 3.77Å; I572-I581 WeakPolarHBondContact O-CG1 3.1Å; I572-I581 PolarHBondContact O-N 2.94Å; I572-G582 PolarHBondContact N-O 3.3Å; I572-G582 PolarHBondContact O-N 2.91Å; I572-L584 HydrophobicContact CD1-CD2 4.11Å; I572-L584 HydrophobicContact CG1-CD2 3.75Å; I572-L604 HydrophobicContact CD1-CD1 3.5Å; I572-L604 VanDerWaalsContact CD1-CD1 3.5Å; I572-L606 HydrophobicContact CD1-CD1 4.02Å; I572-L606 HydrophobicContact CG2-CD1 4.25Å
573	I	91.9	Very high	90.4	Very high	92 Å²	92	66.5 Å²	66.5	47%	0.472	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	125.8	-171.7	-56.6	175.7	0	0	0	109.1	D571 K579 I580	D571-I573 HydrophobicContact CB-CG1 4.27Å; I573-K579 CarbonylContact C-O 3.56Å; I573-K579 WeakPolarHBondContact CA-O 3.43Å; I573-I580 HydrophobicContact CG1-CG1 4.26Å
574	L	88.7	Confident	90.4	Very high	49 Å²	49	66.6 Å²	66.6	26%	0.257	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	130.8	174.2	-172.7	64.7	0	0	0	110.2	S578 K579 I581 V610	L574-S578 PolarHBondContact O-N 2.81Å; L574-K579 PolarHBondContact N-O 2.78Å; L574-K579 PolarHBondContact O-N 3.25Å; L574-K579 VanDerWaalsContact O-N 3.11Å; L574-I581 HydrophobicContact CB-CD1 4.16Å; L574-I581 HydrophobicContact CB-CG1 4.4Å; L574-I581 HydrophobicContact CB-CG2 3.72Å; L574-I581 HydrophobicContact CD2-CG2 4.24Å; L574-V610 HydrophobicContact CD2-CB 4.38Å; L574-V610 HydrophobicContact CD2-CG2 4.49Å
575	E	85.3	Confident	90.4	Very high	111 Å²	111	66.2 Å²	66.2	52%	0.519	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	147.5	173.1	-69	-63.4	166.2	0	0	110.7	G577 S578	E575-G577 PolarHBondContact OE2-N 3.44Å; E575-S578 VanDerWaalsContact OE1-CA 3.22Å; E575-S578 WeakPolarHBondContact OE1-CA 3.46Å; E575-S578 WeakPolarHBondContact OE1-CB 3.24Å; E575-S578 PolarHBondContact OE1-N 2.81Å; E575-S578 PolarHBondContact OE1-OG 3.49Å; E575-S578 PolarHBondContact OE2-N 2.97Å; E575-S578 VanDerWaalsContact OE2-N 3.13Å
576	P	83.1	Confident	90.6	Very high	132 Å²	132	63 Å²	63	86%	0.857	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	cis	-76.2	148.7	1.3	31.5	-35	0	0	0	113.4
577	G	80.5	Confident	91.1	Very high	66 Å²	66	58.2 Å²	58.2	68%	0.68	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	113.4	3.4	170.8	0	0	0	0	0	114.9	E575 K579	E575-G577 PolarHBondContact OE2-N 3.44Å; G577-K579 PolarHBondContact O-N 3.34Å; G577-K579 VanDerWaalsContact O-N 3.12Å
578	S	86.5	Confident	91.5	Very high	78 Å²	78	56.2 Å²	56.2	55%	0.545	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.6	40.1	177.2	-53.5	0	0	0	0	114.2	L574 E575	L574-S578 PolarHBondContact O-N 2.81Å; E575-S578 VanDerWaalsContact OE1-CA 3.22Å; E575-S578 WeakPolarHBondContact OE1-CA 3.46Å; E575-S578 WeakPolarHBondContact OE1-CB 3.24Å; E575-S578 PolarHBondContact OE1-N 2.81Å; E575-S578 PolarHBondContact OE1-OG 3.49Å; E575-S578 PolarHBondContact OE2-N 2.97Å; E575-S578 VanDerWaalsContact OE2-N 3.13Å
579	K	89.8	Confident	91.8	Very high	112 Å²	112	52.1 Å²	52.1	49%	0.487	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	125	-179.1	-177.6	-177.2	176.1	-171	0	109.8	I573 L574 G577 I581	I573-K579 CarbonylContact C-O 3.56Å; I573-K579 WeakPolarHBondContact CA-O 3.43Å; L574-K579 PolarHBondContact N-O 2.78Å; L574-K579 PolarHBondContact O-N 3.25Å; L574-K579 VanDerWaalsContact O-N 3.11Å; G577-K579 PolarHBondContact O-N 3.34Å; G577-K579 VanDerWaalsContact O-N 3.12Å; K579-I581 HydrophobicContact CD-CG2 4.23Å; K579-I581 HydrophobicContact CG-CG2 4.17Å; K579-I581 PolarHBondContact O-N 3.42Å
580	I	92.2	Very high	92	Very high	81 Å²	81	53 Å²	53	42%	0.415	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	116.6	170.8	-58.5	168.9	0	0	0	108.3	D571 I572 I573	D571-I580 HydrophobicContact CB-CG1 4.41Å; D571-I580 HydrophobicContact CB-CG2 4.14Å; I572-I580 WeakPolarHBondContact O-CA 3.31Å; I573-I580 HydrophobicContact CG1-CG1 4.26Å
581	I	93.7	Very high	92.3	Very high	6 Å²	6	51 Å²	51	3%	0.031	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	-13.8	-179.5	61.4	164.7	0	0	0	112.5	I572 L574 K579 L606 D607 V610 F611	I572-I581 HydrophobicContact CB-CG1 4.2Å; I572-I581 HydrophobicContact CG2-CD1 3.99Å; I572-I581 HydrophobicContact CG2-CG1 3.77Å; I572-I581 WeakPolarHBondContact O-CG1 3.1Å; I572-I581 PolarHBondContact O-N 2.94Å; L574-I581 HydrophobicContact CB-CD1 4.16Å; L574-I581 HydrophobicContact CB-CG1 4.4Å; L574-I581 HydrophobicContact CB-CG2 3.72Å; L574-I581 HydrophobicContact CD2-CG2 4.24Å; K579-I581 HydrophobicContact CD-CG2 4.23Å; K579-I581 HydrophobicContact CG-CG2 4.17Å; K579-I581 PolarHBondContact O-N 3.42Å; I581-L606 HydrophobicContact CB-CD1 4.47Å; I581-L606 HydrophobicContact CD1-CD1 3.77Å; I581-L606 HydrophobicContact CG1-CD1 3.87Å; I581-D607 WeakPolarHBondContact O-CB 3.26Å; I581-D607 PolarHBondContact O-N 3.47Å; I581-V610 HydrophobicContact CB-CG2 4.17Å; I581-V610 HydrophobicContact CD1-CG2 4.14Å; I581-V610 HydrophobicContact CG2-CB 4.27Å; I581-V610 HydrophobicContact CG2-CG1 3.96Å; I581-V610 HydrophobicContact CG2-CG2 3.97Å; I581-F611 HydrophobicContact CD1-CE1 4.22Å; I581-F611 HydrophobicContact CD1-CE2 4.22Å; I581-F611 HydrophobicContact CD1-CZ 3.5Å
582	G	93.4	Very high	92.6	Very high	3 Å²	3	48.2 Å²	48.2	3%	0.031	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174	-178.7	-177.9	0	0	0	0	0	112.5	I572 D605	I572-G582 PolarHBondContact N-O 3.3Å; I572-G582 PolarHBondContact O-N 2.91Å; G582-D605 CarbonylContact C-O 3.53Å; G582-D605 WeakPolarHBondContact CA-O 3.47Å
583	R	94.5	Very high	92.9	Very high	85 Å²	85	54.7 Å²	54.7	32%	0.321	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	147.5	178.7	-61.6	-169.4	171.8	119.6	-4	110.3	N561 Y564 A570 D571 L604 D605	N561-R583 PolarHBondContact ND2-NH1 3.05Å; Y564-R583 HydrophobicContact CE2-CB 3.98Å; A570-R583 WeakPolarHBondContact O-CA 3.41Å; D571-R583 VanDerWaalsContact OD1-CD 3.29Å; D571-R583 WeakPolarHBondContact OD1-CD 3.48Å; D571-R583 VanDerWaalsContact OD1-CG 3.26Å; D571-R583 WeakPolarHBondContact OD1-CG 3.29Å; D571-R583 IonicContact OD1-CZ 2.75Å; D571-R583 IonicContact OD1-NE 3.15Å; D571-R583 PolarHBondContact OD1-NE 3.32Å; R583-L604 WeakPolarHBondContact O-CA 3.22Å; R583-D605 PolarHBondContact N-O 2.9Å; R583-D605 PolarHBondContact O-N 2.91Å
584	L	95.2	Very high	93.2	Very high	6 Å²	6	52.9 Å²	52.9	3%	0.031	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	149.8	167.6	73.9	163.7	0	0	0	111	F524 I527 H528 L531 C569 A570 I572 A603 L604	F524-L584 HydrophobicContact CE2-CD1 4.24Å; F524-L584 HydrophobicContact CE2-CG 4.25Å; F524-L584 HydrophobicContact CZ-CD1 4.11Å; F524-L584 HydrophobicContact CZ-CG 4.36Å; I527-L584 HydrophobicContact CG2-CB 4.17Å; I527-L584 HydrophobicContact CG2-CD1 4.47Å; H528-L584 HydrophobicContact CB-CD1 4.18Å; L531-L584 HydrophobicContact CD2-CD1 4Å; L531-L584 HydrophobicContact CD2-CD2 3.91Å; C569-L584 CarbonylContact C-O 3.08Å; C569-L584 WeakPolarHBondContact CA-O 3.39Å; C569-L584 WeakPolarHBondContact CB-O 3.29Å; A570-L584 HydrophobicContact CB-CD2 3.94Å; A570-L584 PolarHBondContact N-O 3.33Å; A570-L584 PolarHBondContact O-N 3.14Å; I572-L584 HydrophobicContact CD1-CD2 4.11Å; I572-L584 HydrophobicContact CG1-CD2 3.75Å; L584-A603 CarbonylContact C-O 3.56Å; L584-A603 VanDerWaalsContact CA-O 3.24Å; L584-A603 WeakPolarHBondContact CA-O 3.36Å; L584-L604 HydrophobicContact CB-CB 4.47Å; L584-L604 HydrophobicContact CB-CD1 4.1Å
585	G	95.5	Very high	93.6	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.8	173.1	-179	0	0	0	0	0	114.1	R568 S602 A603	R568-G585 WeakPolarHBondContact O-CA 3.38Å; G585-S602 CarbonylContact O-C 3.53Å; G585-S602 VanDerWaalsContact O-CA 3.31Å; G585-S602 WeakPolarHBondContact O-CA 3.46Å; G585-A603 PolarHBondContact N-O 3.35Å; G585-A603 PolarHBondContact O-N 3.15Å
586	I	97.8	Very high	94.1	Very high	18 Å²	18	51.4 Å²	51.4	9%	0.092	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	131.6	166.8	-52.8	177	0	0	0	107.3	S522 F524 Y564 F565 R568	S522-I586 VanDerWaalsContact CB-CD1 3.5Å; S522-I586 WeakPolarHBondContact OG-CD1 3.35Å; F524-I586 HydrophobicContact CB-CD1 4.43Å; F524-I586 HydrophobicContact CB-CG1 4.26Å; F524-I586 HydrophobicContact CD2-CG1 4.22Å; Y564-I586 CarbonylContact C-O 3.55Å; Y564-I586 WeakPolarHBondContact CA-O 3.34Å; F565-I586 HydrophobicContact CB-CB 4.38Å; F565-I586 WeakPolarHBondContact CB-O 3Å; F565-I586 PolarHBondContact N-O 2.91Å; R568-I586 HydrophobicContact CB-CB 4.22Å; R568-I586 HydrophobicContact CB-CD1 4Å; R568-I586 HydrophobicContact CB-CG1 4.19Å; R568-I586 HydrophobicContact CG-CD1 4.24Å; R568-I586 PolarHBondContact O-N 2.75Å
587	L	97.7	Very high	94.8	Very high	5 Å²	5	45.4 Å²	45.4	3%	0.026	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	146.5	178.4	-62.7	-176.1	0	0	0	111.5	L471 L475 T563 Y564 I592 C601 A603	L471-L587 HydrophobicContact CD1-CD1 4.35Å; L471-L587 HydrophobicContact CD2-CD2 3.96Å; L475-L587 HydrophobicContact CD1-CD1 3.94Å; L475-L587 HydrophobicContact CD2-CD1 3.67Å; L475-L587 HydrophobicContact CG-CD1 4.39Å; T563-L587 HydrophobicContact CG2-CD2 4.19Å; Y564-L587 HydrophobicContact CD1-CD2 3.93Å; Y564-L587 HydrophobicContact CE1-CD2 3.9Å; L587-I592 HydrophobicContact CB-CD1 3.83Å; L587-I592 HydrophobicContact CB-CG1 4.14Å; L587-I592 HydrophobicContact CD1-CD1 4.02Å; L587-C601 HydrophobicContact CD1-CB 3.94Å; L587-C601 HydrophobicContact CG-CB 4.34Å; L587-C601 PolarHBondContact N-O 2.62Å; L587-A603 HydrophobicContact CD1-CB 4.49Å; L587-A603 HydrophobicContact CD2-CB 3.88Å; L587-A603 HydrophobicContact CG-CB 4.22Å
588	H	97.2	Very high	95.4	Very high	24 Å²	24	48 Å²	48	11%	0.111	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-63	140.9	177.7	-168.5	-87.6	0	0	0	110.8	T563 D590 V591 I592	T563-H588 PolarHBondContact O-N 3.35Å; H588-D590 IonicContact CE1-OD2 2.85Å; H588-D590 PolarHBondContact CE1-OD2 2.93Å; H588-D590 WeakPolarHBondContact ND1-CB 3.22Å; H588-D590 PolarHBondContact ND1-N 2.94Å; H588-D590 VanDerWaalsContact ND1-N 3.12Å; H588-D590 IonicContact ND1-OD2 2.75Å; H588-D590 PolarHBondContact ND1-OD2 3.16Å; H588-D590 PolarHBondContact O-N 3.26Å; H588-D590 VanDerWaalsContact O-N 3.14Å; H588-V591 HydrophobicContact CB-CG2 4.11Å; H588-V591 WeakPolarHBondContact O-CB 3.19Å; H588-V591 PolarHBondContact O-N 3.22Å; H588-I592 PolarHBondContact O-N 2.97Å; H588-I592 VanDerWaalsContact O-N 3.12Å
589	P	96.2	Very high	95.9	Very high	70 Å²	70	46.4 Å²	46.4	46%	0.455	23%	0.227	S	C	.	.	H	α-helix	trans	-54.4	-34.7	179.4	-28.7	35.3	0	0	0	114.5	F565 I592 R593	F565-P589 HydrophobicContact CD2-CG 4.37Å; F565-P589 HydrophobicContact CE2-CG 4.35Å; P589-I592 WeakPolarHBondContact O-CB 3.48Å; P589-I592 PolarHBondContact O-N 2.99Å; P589-R593 WeakPolarHBondContact O-CB 3.45Å; P589-R593 PolarHBondContact O-N 2.86Å
590	D	97.5	Very high	96.2	Very high	46 Å²	46	43.5 Å²	43.5	25%	0.246	22%	0.219	C	C	.	.	H	α-helix	trans	-66.7	-37.1	174.4	-65.1	-31.5	0	0	0	112.7	R444 H588 R593 N594	R444-D590 IonicContact NE-OD2 3.59Å; H588-D590 IonicContact CE1-OD2 2.85Å; H588-D590 PolarHBondContact CE1-OD2 2.93Å; H588-D590 WeakPolarHBondContact ND1-CB 3.22Å; H588-D590 PolarHBondContact ND1-N 2.94Å; H588-D590 VanDerWaalsContact ND1-N 3.12Å; H588-D590 IonicContact ND1-OD2 2.75Å; H588-D590 PolarHBondContact ND1-OD2 3.16Å; H588-D590 PolarHBondContact O-N 3.26Å; H588-D590 VanDerWaalsContact O-N 3.14Å; D590-R593 PolarHBondContact O-N 2.84Å; D590-R593 IonicContact OD1-CZ 3.96Å; D590-R593 IonicContact OD1-NH1 3.37Å; D590-R593 PolarHBondContact OD1-NH1 2.9Å; D590-R593 IonicContact OD1-NH2 2.93Å; D590-R593 PolarHBondContact OD1-NH2 3.17Å; D590-N594 WeakPolarHBondContact O-CB 3.21Å; D590-N594 PolarHBondContact O-N 2.85Å; D590-N594 PolarHBondContact O-ND2 3.11Å; D590-N594 PolarHBondContact O-OD1 2.88Å
591	V	98.1	Very high	96.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.9	-47.3	175.4	175.1	0	0	0	0	109.4	L443 R444 L475 T563 H588 R593 N594 F595	L443-V591 HydrophobicContact CD2-CG1 4.01Å; R444-V591 HydrophobicContact CG-CG2 3.86Å; L475-V591 HydrophobicContact CD1-CG1 4.05Å; T563-V591 HydrophobicContact CG2-CG2 4.39Å; T563-V591 WeakPolarHBondContact O-CG2 3.47Å; H588-V591 HydrophobicContact CB-CG2 4.11Å; H588-V591 WeakPolarHBondContact O-CB 3.19Å; H588-V591 PolarHBondContact O-N 3.22Å; V591-R593 VanDerWaalsContact C-N 3.29Å; V591-R593 PolarHBondContact O-N 3.05Å; V591-N594 PolarHBondContact O-N 3.02Å; V591-N594 VanDerWaalsContact O-N 3.11Å; V591-F595 HydrophobicContact CG1-CD2 4.06Å; V591-F595 HydrophobicContact CG1-CE2 4.13Å; V591-F595 WeakPolarHBondContact O-CD2 3.38Å; V591-F595 PolarHBondContact O-N 3.36Å; V591-F595 VanDerWaalsContact O-N 3.14Å
592	I	97.7	Very high	96.7	Very high	11 Å²	11	39.3 Å²	39.3	6%	0.056	20%	0.198	C	C	.	.	H	α-helix	trans	-51.8	-49.7	174.1	-64.2	-60.2	0	0	0	110.5	L587 H588 P589 N594 F595 E596 L597 M599 C601	L587-I592 HydrophobicContact CB-CD1 3.83Å; L587-I592 HydrophobicContact CB-CG1 4.14Å; L587-I592 HydrophobicContact CD1-CD1 4.02Å; H588-I592 PolarHBondContact O-N 2.97Å; H588-I592 VanDerWaalsContact O-N 3.12Å; P589-I592 WeakPolarHBondContact O-CB 3.48Å; P589-I592 PolarHBondContact O-N 2.99Å; I592-N594 PolarHBondContact O-N 2.82Å; I592-F595 CarbonylContact O-C 3.57Å; I592-F595 PolarHBondContact O-N 3.13Å; I592-E596 PolarHBondContact O-N 3.36Å; I592-L597 CarbonylContact C-O 3.43Å; I592-L597 HydrophobicContact CG2-CB 3.72Å; I592-L597 VanDerWaalsContact CG2-O 3.26Å; I592-L597 WeakPolarHBondContact CG2-O 3.34Å; I592-L597 WeakPolarHBondContact O-CA 3.34Å; I592-L597 WeakPolarHBondContact O-CB 3.21Å; I592-L597 PolarHBondContact O-N 2.95Å; I592-M599 WeakPolarHBondContact CG2-O 3.37Å; I592-C601 HydrophobicContact CD1-CB 3.43Å; I592-C601 VanDerWaalsContact CD1-CB 3.43Å
593	R	97.8	Very high	96.9	Very high	153 Å²	153	39.2 Å²	39.2	58%	0.577	20%	0.197	S	C	*	.	H	α-helix	trans	-65.1	-37.8	178	-172.4	-179.8	66.7	-121.7	-6.2	113.4	P589 D590 V591 F595 E596	P589-R593 WeakPolarHBondContact O-CB 3.45Å; P589-R593 PolarHBondContact O-N 2.86Å; D590-R593 PolarHBondContact O-N 2.84Å; D590-R593 IonicContact OD1-CZ 3.96Å; D590-R593 IonicContact OD1-NH1 3.37Å; D590-R593 PolarHBondContact OD1-NH1 2.9Å; D590-R593 IonicContact OD1-NH2 2.93Å; D590-R593 PolarHBondContact OD1-NH2 3.17Å; V591-R593 VanDerWaalsContact C-N 3.29Å; V591-R593 PolarHBondContact O-N 3.05Å; R593-F595 VanDerWaalsContact C-N 3.25Å; R593-F595 PolarHBondContact O-N 3.36Å; R593-E596 VanDerWaalsContact O-CA 3.28Å; R593-E596 WeakPolarHBondContact O-CA 3.26Å; R593-E596 PolarHBondContact O-N 2.91Å
594	N	98.1	Very high	97.1	Very high	55 Å²	55	35.1 Å²	35.1	29%	0.294	18%	0.181	S	C	.	.	H	α-helix	trans	-66.6	-27.6	-179.4	-69.2	-16	0	0	0	112.8	K442 D590 V591 I592 E596	K442-N594 HydrophobicContact CB-CB 3.95Å; K442-N594 HydrophobicContact CG-CB 4.11Å; K442-N594 PolarHBondContact O-ND2 3.12Å; D590-N594 WeakPolarHBondContact O-CB 3.21Å; D590-N594 PolarHBondContact O-N 2.85Å; D590-N594 PolarHBondContact O-ND2 3.11Å; D590-N594 PolarHBondContact O-OD1 2.88Å; V591-N594 PolarHBondContact O-N 3.02Å; V591-N594 VanDerWaalsContact O-N 3.11Å; I592-N594 PolarHBondContact O-N 2.82Å; N594-E596 VanDerWaalsContact C-N 3.29Å
595	F	97.6	Very high	97.2	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.018	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	15.7	169	-70.2	-85.5	0	0	0	112.2	K442 L443 P472 L475 N476 A479 V591 I592 R593 L597	K442-F595 HydrophobicContact CB-CD2 4.21Å; K442-F595 HydrophobicContact CB-CE1 4.46Å; K442-F595 HydrophobicContact CB-CE2 3.5Å; K442-F595 VanDerWaalsContact CB-CE2 3.5Å; K442-F595 HydrophobicContact CB-CZ 3.65Å; K442-F595 HydrophobicContact CD-CD1 4.29Å; K442-F595 HydrophobicContact CD-CE1 3.93Å; K442-F595 HydrophobicContact CD-CE2 4.33Å; K442-F595 HydrophobicContact CD-CZ 3.95Å; K442-F595 HydrophobicContact CG-CZ 4.48Å; L443-F595 HydrophobicContact CD2-CE2 3.79Å; L443-F595 HydrophobicContact CD2-CZ 4.2Å; L443-F595 HydrophobicContact CG-CE2 4.44Å; P472-F595 HydrophobicContact CB-CE1 3.95Å; P472-F595 HydrophobicContact CB-CZ 3.8Å; P472-F595 HydrophobicContact CG-CZ 4.34Å; L475-F595 HydrophobicContact CB-CB 4.03Å; L475-F595 HydrophobicContact CB-CD1 3.66Å; L475-F595 HydrophobicContact CB-CD2 4.11Å; L475-F595 HydrophobicContact CB-CE1 4.12Å; L475-F595 HydrophobicContact CB-CG 3.65Å; L475-F595 HydrophobicContact CD1-CD1 4.47Å; L475-F595 HydrophobicContact CD1-CD2 3.48Å; L475-F595 VanDerWaalsContact CD1-CD2 3.48Å; L475-F595 HydrophobicContact CD1-CE2 3.63Å; L475-F595 HydrophobicContact CD1-CG 3.94Å; L475-F595 HydrophobicContact CD1-CZ 4.21Å; L475-F595 HydrophobicContact CG-CD2 4.44Å; L475-F595 HydrophobicContact CG-CG 4.45Å; N476-F595 WeakPolarHBondContact OD1-CD1 3.04Å; A479-F595 VanDerWaalsContact CB-O 3.29Å; A479-F595 WeakPolarHBondContact CB-O 3.37Å; V591-F595 HydrophobicContact CG1-CD2 4.06Å; V591-F595 HydrophobicContact CG1-CE2 4.13Å; V591-F595 WeakPolarHBondContact O-CD2 3.38Å; V591-F595 PolarHBondContact O-N 3.36Å; V591-F595 VanDerWaalsContact O-N 3.14Å; I592-F595 CarbonylContact O-C 3.57Å; I592-F595 PolarHBondContact O-N 3.13Å; R593-F595 VanDerWaalsContact C-N 3.25Å; R593-F595 PolarHBondContact O-N 3.36Å; F595-L597 HydrophobicContact CB-CD1 4.5Å; F595-L597 HydrophobicContact CB-CG 4.48Å; F595-L597 PolarHBondContact O-N 3.28Å; F595-L597 VanDerWaalsContact O-N 3.09Å
596	E	96.5	Very high	97.2	Very high	125 Å²	125	35.8 Å²	35.8	58%	0.584	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.5	19.5	177.9	-55	179	174.9	0	0	114.9	R482 I592 R593 N594	R482-E596 VanDerWaalsContact CZ-CB 3.45Å; R482-E596 IonicContact CZ-OE2 3.15Å; R482-E596 PolarHBondContact NE-O 2.92Å; R482-E596 VanDerWaalsContact NH1-CB 3.29Å; R482-E596 PolarHBondContact NH1-O 3.25Å; R482-E596 IonicContact NH1-OE2 2.74Å; R482-E596 IonicContact NH2-OE2 3.92Å; R482-E596 PolarHBondContact NH2-OE2 3.13Å; I592-E596 PolarHBondContact O-N 3.36Å; R593-E596 VanDerWaalsContact O-CA 3.28Å; R593-E596 WeakPolarHBondContact O-CA 3.26Å; R593-E596 PolarHBondContact O-N 2.91Å; N594-E596 VanDerWaalsContact C-N 3.29Å
597	L	96.8	Very high	97.1	Very high	6 Å²	6	35.7 Å²	35.7	3%	0.031	18%	0.184	C	C	.	.			trans	-80.9	154.7	173.2	-62.5	174.3	0	0	0	109.8	L475 L478 A479 R482 Y518 I592 F595	L475-L597 HydrophobicContact CD2-CD1 4.02Å; L478-L597 HydrophobicContact CB-CD1 4.14Å; L478-L597 HydrophobicContact CB-CD2 3.98Å; L478-L597 HydrophobicContact CD1-CD1 4.22Å; A479-L597 HydrophobicContact CB-CD2 4.24Å; R482-L597 HydrophobicContact CG-CD2 3.99Å; Y518-L597 HydrophobicContact CD2-CD1 4.5Å; Y518-L597 HydrophobicContact CE1-CD2 4.34Å; Y518-L597 HydrophobicContact CE2-CB 3.92Å; Y518-L597 HydrophobicContact CE2-CD1 4.14Å; Y518-L597 HydrophobicContact CE2-CD2 4.23Å; Y518-L597 HydrophobicContact CE2-CG 4.32Å; I592-L597 CarbonylContact C-O 3.43Å; I592-L597 HydrophobicContact CG2-CB 3.72Å; I592-L597 VanDerWaalsContact CG2-O 3.26Å; I592-L597 WeakPolarHBondContact CG2-O 3.34Å; I592-L597 WeakPolarHBondContact O-CA 3.34Å; I592-L597 WeakPolarHBondContact O-CB 3.21Å; I592-L597 PolarHBondContact O-N 2.95Å; F595-L597 HydrophobicContact CB-CD1 4.5Å; F595-L597 HydrophobicContact CB-CG 4.48Å; F595-L597 PolarHBondContact O-N 3.28Å; F595-L597 VanDerWaalsContact O-N 3.09Å
598	T	94.6	Very high	97	Very high	120 Å²	120	35.4 Å²	35.4	74%	0.736	18%	0.183	S	C	*	.			trans	-120.6	-7.3	-175.9	55.3	0	0	0	0	114.7	Y518	Y518-T598 PolarHBondContact OH-N 2.82Å; Y518-T598 VanDerWaalsContact OH-N 3.14Å
599	M	95.3	Very high	96.8	Very high	44 Å²	44	37.6 Å²	37.6	22%	0.217	19%	0.193	C	C	.	.	S	Bend	trans	-120.7	162.3	-174.7	-64.4	178.8	-69.2	0	0	111.1	L486 Y518 K520 I592	L486-M599 HydrophobicContact CD1-CE 3.24Å; L486-M599 HydrophobicContact CD1-SD 3.33Å; L486-M599 WeakPolarHBondContact CD1-SD 3.41Å; L486-M599 HydrophobicContact CD2-CE 3.8Å; L486-M599 HydrophobicContact CG-CE 4.06Å; Y518-M599 HydrophobicContact CD1-CE 4.25Å; Y518-M599 HydrophobicContact CE1-CB 4.43Å; Y518-M599 HydrophobicContact CE1-CE 3.34Å; Y518-M599 HydrophobicContact CE2-CB 3.82Å; Y518-M599 WeakPolarHBondContact CE2-O 3.23Å; Y518-M599 PolarHBondContact OH-N 2.94Å; K520-M599 HydrophobicContact CG-SD 4.23Å; I592-M599 WeakPolarHBondContact CG2-O 3.37Å
600	P	96.8	Very high	96.6	Very high	51 Å²	51	35.9 Å²	35.9	33%	0.331	18%	0.181	S	C	.	.			trans	-57.2	141.9	175.7	-26.9	35.7	0	0	0	113.3	Y518 N519	Y518-P600 WeakPolarHBondContact CD2-O 3.49Å; N519-P600 PolarHBondContact N-O 3.34Å; N519-P600 WeakPolarHBondContact O-CD 3.42Å
601	C	98	Very high	96.2	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	131	170.1	-162.5	0	0	0	0	109.5	Y517 Y518 L587 I592	Y517-C601 CarbonylContact O-C 3.42Å; Y517-C601 VanDerWaalsContact O-CA 3.28Å; Y517-C601 WeakPolarHBondContact O-CA 3.41Å; Y518-C601 HydrophobicContact CD2-CB 3.88Å; L587-C601 HydrophobicContact CD1-CB 3.94Å; L587-C601 HydrophobicContact CG-CB 4.34Å; L587-C601 PolarHBondContact N-O 2.62Å; I592-C601 HydrophobicContact CD1-CB 3.43Å; I592-C601 VanDerWaalsContact CD1-CB 3.43Å
602	S	98.4	Very high	95.5	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	146.2	164.6	-63.2	0	0	0	0	109.7	V516 Y517 S522 G585	V516-S602 CarbonylContact C-O 3.58Å; V516-S602 VanDerWaalsContact CA-O 3.27Å; V516-S602 WeakPolarHBondContact CA-O 3.48Å; Y517-S602 PolarHBondContact N-O 3.23Å; Y517-S602 PolarHBondContact O-N 3.03Å; S522-S602 WeakPolarHBondContact O-CB 3.27Å; S522-S602 PolarHBondContact O-OG 2.84Å; G585-S602 CarbonylContact O-C 3.53Å; G585-S602 VanDerWaalsContact O-CA 3.31Å; G585-S602 WeakPolarHBondContact O-CA 3.46Å
603	A	98.2	Very high	95.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	148	-179.2	0	0	0	0	0	111.8	L471 A515 V516 Y564 L584 G585 L587	L471-A603 HydrophobicContact CD1-CB 3.83Å; A515-A603 CarbonylContact O-C 3.54Å; A515-A603 WeakPolarHBondContact O-CA 3.33Å; V516-A603 HydrophobicContact CG1-CB 3.98Å; Y564-A603 HydrophobicContact CE1-CB 4.28Å; L584-A603 CarbonylContact C-O 3.56Å; L584-A603 VanDerWaalsContact CA-O 3.24Å; L584-A603 WeakPolarHBondContact CA-O 3.36Å; G585-A603 PolarHBondContact N-O 3.35Å; G585-A603 PolarHBondContact O-N 3.15Å; L587-A603 HydrophobicContact CD1-CB 4.49Å; L587-A603 HydrophobicContact CD2-CB 3.88Å; L587-A603 HydrophobicContact CG-CB 4.22Å
604	L	98	Very high	95.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	135.1	167.2	165.6	68.7	0	0	0	107.8	C514 A515 I527 L530 L531 L534 I572 R583 L584 L606	C514-L604 CarbonylContact C-O 3.53Å; C514-L604 WeakPolarHBondContact CA-O 3.3Å; C514-L604 PolarHBondContact SG-O 2.98Å; A515-L604 PolarHBondContact N-O 2.91Å; A515-L604 PolarHBondContact O-N 3.46Å; I527-L604 HydrophobicContact CG2-CB 3.47Å; I527-L604 VanDerWaalsContact CG2-CB 3.47Å; L530-L604 HydrophobicContact CD2-CD2 4.11Å; L530-L604 HydrophobicContact CG-CD2 4.22Å; L531-L604 HydrophobicContact CB-CD1 4.49Å; L531-L604 HydrophobicContact CB-CD2 4.33Å; L531-L604 HydrophobicContact CD1-CD1 4.17Å; L534-L604 HydrophobicContact CD1-CD2 4.08Å; I572-L604 HydrophobicContact CD1-CD1 3.5Å; I572-L604 VanDerWaalsContact CD1-CD1 3.5Å; R583-L604 WeakPolarHBondContact O-CA 3.22Å; L584-L604 HydrophobicContact CB-CB 4.47Å; L584-L604 HydrophobicContact CB-CD1 4.1Å; L604-L606 HydrophobicContact CD1-CB 4.35Å
605	D	96.7	Very high	95.1	Very high	19 Å²	19	36.8 Å²	36.8	10%	0.102	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	121.9	169.7	-175.7	-20	0	0	0	107.5	S469 R512 I513 G582 R583	S469-D605 PolarHBondContact OG-OD2 3.39Å; R512-D605 IonicContact CZ-OD1 2.79Å; R512-D605 IonicContact NE-OD1 3.49Å; R512-D605 PolarHBondContact NE-OD1 2.89Å; R512-D605 VanDerWaalsContact NE-OD1 3.1Å; R512-D605 IonicContact NH2-OD1 3.15Å; R512-D605 PolarHBondContact NH2-OD1 2.84Å; R512-D605 IonicContact NH2-OD2 3.67Å; I513-D605 CarbonylContact O-C 3.46Å; I513-D605 WeakPolarHBondContact O-CA 3.36Å; G582-D605 CarbonylContact C-O 3.53Å; G582-D605 WeakPolarHBondContact CA-O 3.47Å; R583-D605 PolarHBondContact N-O 2.9Å; R583-D605 PolarHBondContact O-N 2.91Å
606	L	96.5	Very high	95	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	135.4	-172.5	-177.6	67.9	0	0	0	110.5	R512 I513 L531 M535 I572 I581 L604 F611	R512-L606 CarbonylContact C-O 3.54Å; R512-L606 WeakPolarHBondContact CA-O 3.36Å; I513-L606 HydrophobicContact CB-CB 4.39Å; I513-L606 HydrophobicContact CD1-CD2 4.19Å; I513-L606 PolarHBondContact N-O 2.77Å; I513-L606 PolarHBondContact O-N 2.72Å; L531-L606 HydrophobicContact CD1-CD2 4.34Å; M535-L606 HydrophobicContact CE-CD2 3.69Å; I572-L606 HydrophobicContact CD1-CD1 4.02Å; I572-L606 HydrophobicContact CG2-CD1 4.25Å; I581-L606 HydrophobicContact CB-CD1 4.47Å; I581-L606 HydrophobicContact CD1-CD1 3.77Å; I581-L606 HydrophobicContact CG1-CD1 3.87Å; L604-L606 HydrophobicContact CD1-CB 4.35Å; L606-F611 HydrophobicContact CD1-CE2 4.49Å; L606-F611 HydrophobicContact CD2-CE2 4.18Å; L606-F611 HydrophobicContact CG-CE2 4.36Å
607	D	95.9	Very high	94.9	Very high	16 Å²	16	33.4 Å²	33.4	9%	0.086	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	120.1	169	-167.3	-11.8	0	0	0	109.9	R512 I581 E609 V610 F611	R512-D607 IonicContact NH1-OD2 3.87Å; I581-D607 WeakPolarHBondContact O-CB 3.26Å; I581-D607 PolarHBondContact O-N 3.47Å; D607-E609 PolarHBondContact OD1-N 3.32Å; D607-E609 VanDerWaalsContact OD1-N 3.14Å; D607-V610 HydrophobicContact CB-CG1 4.2Å; D607-V610 WeakPolarHBondContact O-CG2 3.22Å; D607-F611 WeakPolarHBondContact O-CE2 3.47Å
608	L	95.6	Very high	94.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.192	C	C	.	.	S	Bend	trans	-88.8	-25.4	-179.4	-176.7	53	0	0	0	112	I409 L412 V416 V493 R511 I513 L538 V610 F611	I409-L608 HydrophobicContact CD1-CD2 4.33Å; I409-L608 HydrophobicContact CD1-CG 4.14Å; L412-L608 HydrophobicContact CD2-CD1 3.66Å; L412-L608 HydrophobicContact CD2-CG 3.96Å; L412-L608 HydrophobicContact CG-CD1 3.91Å; L412-L608 HydrophobicContact CG-CD2 4.32Å; L412-L608 HydrophobicContact CG-CG 4.23Å; V416-L608 HydrophobicContact CG2-CD1 4.18Å; V416-L608 HydrophobicContact CG2-CD2 4.42Å; V493-L608 HydrophobicContact CG1-CD2 3.94Å; R511-L608 HydrophobicContact CB-CB 4.49Å; R511-L608 HydrophobicContact CG-CB 4.11Å; R511-L608 HydrophobicContact CG-CD2 3.98Å; R511-L608 HydrophobicContact CG-CG 4.43Å; R511-L608 WeakPolarHBondContact O-CB 3.46Å; R511-L608 PolarHBondContact O-N 3.24Å; I513-L608 HydrophobicContact CD1-CB 4.14Å; I513-L608 HydrophobicContact CD1-CD1 3.85Å; I513-L608 HydrophobicContact CD1-CD2 4.19Å; I513-L608 HydrophobicContact CD1-CG 4.27Å; I513-L608 HydrophobicContact CG1-CB 4.24Å; I513-L608 HydrophobicContact CG1-CD2 4.19Å; L538-L608 HydrophobicContact CD2-CD1 4.47Å; L608-V610 PolarHBondContact O-N 3.46Å; L608-F611 HydrophobicContact CD1-CD2 4.08Å; L608-F611 PolarHBondContact O-N 2.85Å
609	E	93.1	Very high	94.8	Very high	70 Å²	70	29.1 Å²	29.1	33%	0.327	15%	0.153	S	C	.	.	G	3₁₀ helix	trans	-67.7	-21.2	-174	-64	-168.6	-179.6	0	0	113	I409 H510 R511 D607 F611 L612	I409-E609 HydrophobicContact CD1-CG 4.23Å; I409-E609 HydrophobicContact CG1-CG 4.44Å; H510-E609 WeakPolarHBondContact CA-OE1 3.35Å; R511-E609 HydrophobicContact CB-CG 3.71Å; R511-E609 PolarHBondContact N-OE1 2.74Å; D607-E609 PolarHBondContact OD1-N 3.32Å; D607-E609 VanDerWaalsContact OD1-N 3.14Å; E609-F611 PolarHBondContact O-N 2.93Å; E609-F611 VanDerWaalsContact O-N 3.17Å; E609-L612 HydrophobicContact CB-CD1 4.48Å; E609-L612 PolarHBondContact O-N 2.94Å
610	V	90.9	Very high	94.7	Very high	34 Å²	34	28 Å²	28	21%	0.206	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-67	-12.1	178.5	-56.9	0	0	0	0	114	L574 I581 D607 L608	L574-V610 HydrophobicContact CD2-CB 4.38Å; L574-V610 HydrophobicContact CD2-CG2 4.49Å; I581-V610 HydrophobicContact CB-CG2 4.17Å; I581-V610 HydrophobicContact CD1-CG2 4.14Å; I581-V610 HydrophobicContact CG2-CB 4.27Å; I581-V610 HydrophobicContact CG2-CG1 3.96Å; I581-V610 HydrophobicContact CG2-CG2 3.97Å; D607-V610 HydrophobicContact CB-CG1 4.2Å; D607-V610 WeakPolarHBondContact O-CG2 3.22Å; L608-V610 PolarHBondContact O-N 3.46Å
611	F	88.8	Confident	94.5	Very high	41 Å²	41	26.1 Å²	26.1	18%	0.18	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-103.4	8.7	-178.4	-55.4	-72.4	0	0	0	113.6	L412 M535 L538 V540 I581 L606 D607 L608 E609	L412-F611 HydrophobicContact CD2-CB 4.32Å; M535-F611 HydrophobicContact CE-CE2 4.4Å; M535-F611 HydrophobicContact CE-CZ 3.81Å; M535-F611 HydrophobicContact SD-CZ 4.25Å; L538-F611 HydrophobicContact CD1-CD1 4.16Å; L538-F611 HydrophobicContact CD1-CD2 3.73Å; L538-F611 HydrophobicContact CD1-CE1 4.22Å; L538-F611 HydrophobicContact CD1-CE2 3.77Å; L538-F611 HydrophobicContact CD1-CG 3.91Å; L538-F611 HydrophobicContact CD1-CZ 4.01Å; L538-F611 HydrophobicContact CD2-CB 4.15Å; L538-F611 HydrophobicContact CD2-CG 4.31Å; V540-F611 HydrophobicContact CG2-CD1 3.85Å; V540-F611 HydrophobicContact CG2-CE1 3.69Å; I581-F611 HydrophobicContact CD1-CE1 4.22Å; I581-F611 HydrophobicContact CD1-CE2 4.22Å; I581-F611 HydrophobicContact CD1-CZ 3.5Å; L606-F611 HydrophobicContact CD1-CE2 4.49Å; L606-F611 HydrophobicContact CD2-CE2 4.18Å; L606-F611 HydrophobicContact CG-CE2 4.36Å; D607-F611 WeakPolarHBondContact O-CE2 3.47Å; L608-F611 HydrophobicContact CD1-CD2 4.08Å; L608-F611 PolarHBondContact O-N 2.85Å; E609-F611 PolarHBondContact O-N 2.93Å; E609-F611 VanDerWaalsContact O-N 3.17Å
612	L	84.4	Confident	94.2	Very high	133 Å²	133	28.5 Å²	28.5	70%	0.696	15%	0.145	S	C	*	.			trans	-81.3	0	177.6	-70	174.3	0	0	0	114.3	P408 I409 L412 E609	P408-L612 HydrophobicContact CB-CD2 4.09Å; I409-L612 HydrophobicContact CB-CD1 3.71Å; I409-L612 HydrophobicContact CB-CD2 4.16Å; I409-L612 HydrophobicContact CB-CG 4.49Å; I409-L612 HydrophobicContact CD1-CD1 3.87Å; I409-L612 HydrophobicContact CD1-CD2 4.15Å; I409-L612 HydrophobicContact CD1-CG 4.16Å; I409-L612 HydrophobicContact CG1-CD1 4.05Å; L412-L612 HydrophobicContact CB-CD2 4.29Å; L412-L612 HydrophobicContact CD2-CD2 3.77Å; L412-L612 HydrophobicContact CD2-CG 4.34Å; E609-L612 HydrophobicContact CB-CD1 4.48Å; E609-L612 PolarHBondContact O-N 2.94Å

Retrieved 612 of 612 residues in 213.4 ms (Link to these results)

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