A0A060YBK7_ONCMY Loading...

SAGA-associated factor 29

AlphaFold DB , UniProt , Accession A0A060YBK7, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 290 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	61.5	Low	89.6	Confident	179 Å²	179	67.9 Å²	67.9	88%	0.882	38%	0.384	S	S	*	.				0	143.1	0	-72.1	164.9	90.6	0	0	108	T5 E9	M1-T5 HydrophobicContact CE-CG2 4Å; M1-E9 WeakPolarHBondContact CE-OE1 3.16Å
2	S	83.5	Confident	90.3	Very high	66 Å²	66	70.5 Å²	70.5	46%	0.462	40%	0.402	S	S	.	.			trans	-68.2	151.1	176.8	178.5	0	0	0	0	110.4	D4 T5 K6	S2-D4 PolarHBondContact O-N 3.21Å; S2-D4 PolarHBondContact OG-N 3.47Å; S2-T5 WeakPolarHBondContact O-CB 3.4Å; S2-T5 PolarHBondContact O-N 3.43Å; S2-T5 VanDerWaalsContact O-N 3.1Å; S2-K6 PolarHBondContact O-N 3.03Å; S2-K6 VanDerWaalsContact O-N 3.09Å
3	A	83.2	Confident	90.9	Very high	42 Å²	42	70.8 Å²	70.8	35%	0.347	40%	0.398	S	S	.	.	H	α-helix	trans	-54.3	-36.7	172.9	0	0	0	0	0	111.5	T5 K6 I7	A3-T5 PolarHBondContact O-N 2.92Å; A3-K6 PolarHBondContact O-N 3.13Å; A3-I7 VanDerWaalsContact O-CG1 3.32Å; A3-I7 WeakPolarHBondContact O-CG1 3.49Å; A3-I7 PolarHBondContact O-N 3.13Å
4	D	86.6	Confident	91.4	Very high	90 Å²	90	67.4 Å²	67.4	48%	0.481	38%	0.378	S	S	.	.	H	α-helix	trans	-67.6	-37.5	178.9	-62.3	-35.4	0	0	0	112.2	S2 K6 I7 A8 R91	S2-D4 PolarHBondContact O-N 3.21Å; S2-D4 PolarHBondContact OG-N 3.47Å; D4-K6 VanDerWaalsContact C-N 3.33Å; D4-I7 PolarHBondContact O-N 3.29Å; D4-A8 WeakPolarHBondContact O-CB 3.44Å; D4-A8 PolarHBondContact O-N 2.99Å; D4-R91 IonicContact OD1-NH1 3.85Å; D4-R91 PolarHBondContact OD1-NH1 2.86Å
5	T	92.7	Very high	91.8	Very high	65 Å²	65	69.9 Å²	69.9	40%	0.399	39%	0.385	S	S	.	.	H	α-helix	trans	-62.9	-43.9	173.1	-47.8	0	0	0	0	110.2	M1 S2 A3 A8 E9	M1-T5 HydrophobicContact CE-CG2 4Å; S2-T5 WeakPolarHBondContact O-CB 3.4Å; S2-T5 PolarHBondContact O-N 3.43Å; S2-T5 VanDerWaalsContact O-N 3.1Å; A3-T5 PolarHBondContact O-N 2.92Å; T5-A8 PolarHBondContact O-N 2.99Å; T5-E9 WeakPolarHBondContact O-CG 3.3Å; T5-E9 PolarHBondContact O-N 3.41Å; T5-E9 VanDerWaalsContact O-N 3.08Å
6	K	94.7	Very high	92.2	Very high	76 Å²	76	70.7 Å²	70.7	33%	0.33	39%	0.385	S	S	.	.	H	α-helix	trans	-66.7	-40.2	-179.8	-172.9	58.9	-176.7	167.6	0	112.3	S2 A3 D4 A8 E9 L10 L87	S2-K6 PolarHBondContact O-N 3.03Å; S2-K6 VanDerWaalsContact O-N 3.09Å; A3-K6 PolarHBondContact O-N 3.13Å; D4-K6 VanDerWaalsContact C-N 3.33Å; K6-A8 VanDerWaalsContact C-N 3.34Å; K6-E9 IonicContact NZ-OE2 3.34Å; K6-E9 PolarHBondContact O-N 3.16Å; K6-L10 HydrophobicContact CG-CD1 4.31Å; K6-L10 WeakPolarHBondContact O-CG 3.32Å; K6-L10 PolarHBondContact O-N 2.93Å; K6-L87 HydrophobicContact CB-CD1 4.38Å; K6-L87 HydrophobicContact CG-CD1 3.91Å
7	I	94.8	Very high	92.6	Very high	18 Å²	18	67.3 Å²	67.3	9%	0.092	37%	0.367	C	S	.	.	H	α-helix	trans	-62.1	-42.7	174.9	-70.2	167.6	0	0	0	110.6	A3 D4 E9 L10 L11 I84 L87 L88	A3-I7 VanDerWaalsContact O-CG1 3.32Å; A3-I7 WeakPolarHBondContact O-CG1 3.49Å; A3-I7 PolarHBondContact O-N 3.13Å; D4-I7 PolarHBondContact O-N 3.29Å; I7-E9 VanDerWaalsContact C-N 3.34Å; I7-E9 PolarHBondContact O-N 3.45Å; I7-L10 PolarHBondContact O-N 2.96Å; I7-L11 HydrophobicContact CG2-CD1 3.89Å; I7-L11 HydrophobicContact CG2-CG 4.32Å; I7-L11 WeakPolarHBondContact O-CB 3.27Å; I7-L11 VanDerWaalsContact O-CG 3.31Å; I7-L11 WeakPolarHBondContact O-CG 3.34Å; I7-L11 PolarHBondContact O-N 2.86Å; I7-I84 HydrophobicContact CG2-CG2 4.33Å; I7-L87 HydrophobicContact CD1-CB 4.1Å; I7-L87 HydrophobicContact CG1-CB 4.01Å; I7-L87 HydrophobicContact CG1-CD1 3.89Å; I7-L88 HydrophobicContact CD1-CD2 3.88Å; I7-L88 HydrophobicContact CD1-CG 4.27Å
8	A	96.2	Very high	92.8	Very high	53 Å²	53	68.9 Å²	68.9	44%	0.438	37%	0.374	S	S	.	.	H	α-helix	trans	-62.4	-39.3	177.8	0	0	0	0	0	112.7	D4 T5 K6 L11 T12	D4-A8 WeakPolarHBondContact O-CB 3.44Å; D4-A8 PolarHBondContact O-N 2.99Å; T5-A8 PolarHBondContact O-N 2.99Å; K6-A8 VanDerWaalsContact C-N 3.34Å; A8-L11 PolarHBondContact O-N 3.44Å; A8-T12 PolarHBondContact O-N 3.26Å; A8-T12 PolarHBondContact O-OG1 3.36Å
9	E	96.9	Very high	93.1	Very high	67 Å²	67	70.4 Å²	70.4	31%	0.313	38%	0.377	S	S	.	.	H	α-helix	trans	-62.5	-49.3	172.9	-72.3	171.3	-179.7	0	0	111.6	M1 T5 K6 I7 L11 T12 E13	M1-E9 WeakPolarHBondContact CE-OE1 3.16Å; T5-E9 WeakPolarHBondContact O-CG 3.3Å; T5-E9 PolarHBondContact O-N 3.41Å; T5-E9 VanDerWaalsContact O-N 3.08Å; K6-E9 IonicContact NZ-OE2 3.34Å; K6-E9 PolarHBondContact O-N 3.16Å; I7-E9 VanDerWaalsContact C-N 3.34Å; I7-E9 PolarHBondContact O-N 3.45Å; E9-L11 VanDerWaalsContact C-N 3.29Å; E9-L11 PolarHBondContact O-N 2.75Å; E9-T12 WeakPolarHBondContact O-CA 3.35Å; E9-T12 WeakPolarHBondContact O-CB 3.19Å; E9-T12 PolarHBondContact O-N 3.06Å; E9-E13 PolarHBondContact O-N 3.31Å
10	L	97.4	Very high	93.3	Very high	1 Å²	1	70.4 Å²	70.4	1%	0.005	37%	0.374	C	S	.	.	H	α-helix	trans	-62	-36.8	179.2	-69.7	171.3	0	0	0	112.3	K6 I7 T12 E13 L14 K80 E83 I84 L87	K6-L10 HydrophobicContact CG-CD1 4.31Å; K6-L10 WeakPolarHBondContact O-CG 3.32Å; K6-L10 PolarHBondContact O-N 2.93Å; I7-L10 PolarHBondContact O-N 2.96Å; L10-T12 VanDerWaalsContact C-N 3.32Å; L10-E13 PolarHBondContact O-N 3.01Å; L10-L14 VanDerWaalsContact O-CB 3.26Å; L10-L14 WeakPolarHBondContact O-CB 3.41Å; L10-L14 PolarHBondContact O-N 3.41Å; L10-K80 HydrophobicContact CD2-CD 3.69Å; L10-E83 HydrophobicContact CD1-CB 4Å; L10-E83 VanDerWaalsContact CD2-OE2 3.28Å; L10-E83 WeakPolarHBondContact CD2-OE2 3.16Å; L10-I84 HydrophobicContact CB-CD1 3.92Å; L10-I84 HydrophobicContact CB-CG1 3.63Å; L10-I84 HydrophobicContact CD1-CG1 3.99Å; L10-I84 HydrophobicContact CG-CG1 4.47Å; L10-L87 HydrophobicContact CD1-CD1 3.63Å
11	L	97.7	Very high	93.4	Very high	90 Å²	90	67.6 Å²	67.6	47%	0.471	36%	0.36	S	S	.	.	H	α-helix	trans	-65.4	-36.4	173.5	-74.5	169.7	0	0	0	111.9	I7 A8 E9 H15 I84	I7-L11 HydrophobicContact CG2-CD1 3.89Å; I7-L11 HydrophobicContact CG2-CG 4.32Å; I7-L11 WeakPolarHBondContact O-CB 3.27Å; I7-L11 VanDerWaalsContact O-CG 3.31Å; I7-L11 WeakPolarHBondContact O-CG 3.34Å; I7-L11 PolarHBondContact O-N 2.86Å; A8-L11 PolarHBondContact O-N 3.44Å; E9-L11 VanDerWaalsContact C-N 3.29Å; E9-L11 PolarHBondContact O-N 2.75Å; L11-H15 WeakPolarHBondContact O-CB 3.45Å; L11-H15 PolarHBondContact O-N 2.71Å; L11-I84 HydrophobicContact CD2-CD1 3.8Å; L11-I84 HydrophobicContact CG-CD1 4.05Å
12	T	98.1	Very high	95.1	Very high	99 Å²	99	64.1 Å²	64.1	61%	0.607	34%	0.341	S	S	*	.	H	α-helix	trans	-68.6	-44.6	176	-56.7	0	0	0	0	110.9	A8 E9 L10 H15 Q16	A8-T12 PolarHBondContact O-N 3.26Å; A8-T12 PolarHBondContact O-OG1 3.36Å; E9-T12 WeakPolarHBondContact O-CA 3.35Å; E9-T12 WeakPolarHBondContact O-CB 3.19Å; E9-T12 PolarHBondContact O-N 3.06Å; L10-T12 VanDerWaalsContact C-N 3.32Å; T12-H15 PolarHBondContact O-N 2.87Å; T12-Q16 PolarHBondContact O-N 2.99Å
13	E	97.9	Very high	95.6	Very high	75 Å²	75	66.6 Å²	66.6	35%	0.35	35%	0.345	S	S	.	.	H	α-helix	trans	-59.9	-46.4	173.3	-71.2	175.3	-156.2	0	0	111.3	E9 L10 H15 Q16 L17 K80	E9-E13 PolarHBondContact O-N 3.31Å; L10-E13 PolarHBondContact O-N 3.01Å; E13-H15 VanDerWaalsContact C-N 3.35Å; E13-H15 PolarHBondContact O-N 3.06Å; E13-Q16 WeakPolarHBondContact O-CB 3.33Å; E13-Q16 PolarHBondContact O-N 2.9Å; E13-Q16 VanDerWaalsContact O-N 3.13Å; E13-L17 WeakPolarHBondContact O-CG 3.39Å; E13-L17 PolarHBondContact O-N 3.4Å; E13-K80 WeakPolarHBondContact OE2-CE 3.39Å; E13-K80 IonicContact OE2-NZ 3.03Å; E13-K80 PolarHBondContact OE2-NZ 3.33Å
14	L	98.1	Very high	96.2	Very high	22 Å²	22	66.1 Å²	66.1	12%	0.115	34%	0.336	C	S	.	.	H	α-helix	trans	-59	-45.2	177	177.5	60.3	0	0	0	111.7	L10 Q16 L17 I18 A77 K80 I81 I84	L10-L14 VanDerWaalsContact O-CB 3.26Å; L10-L14 WeakPolarHBondContact O-CB 3.41Å; L10-L14 PolarHBondContact O-N 3.41Å; L14-Q16 VanDerWaalsContact C-N 3.28Å; L14-Q16 PolarHBondContact O-N 3.23Å; L14-L17 PolarHBondContact O-N 2.92Å; L14-I18 HydrophobicContact CD1-CD1 4.39Å; L14-I18 HydrophobicContact CG-CD1 4.21Å; L14-I18 WeakPolarHBondContact O-CG1 3.46Å; L14-I18 PolarHBondContact O-N 2.88Å; L14-A77 HydrophobicContact CD1-CB 3.72Å; L14-A77 WeakPolarHBondContact CD1-O 3.44Å; L14-K80 HydrophobicContact CB-CB 4.32Å; L14-K80 HydrophobicContact CD1-CB 4.38Å; L14-I81 HydrophobicContact CD1-CD1 4.36Å; L14-I81 HydrophobicContact CD1-CG1 4.11Å; L14-I81 HydrophobicContact CD2-CD1 4.4Å; L14-I81 HydrophobicContact CD2-CG1 3.72Å; L14-I84 HydrophobicContact CD2-CD1 4.33Å
15	H	98.1	Very high	96.7	Very high	105 Å²	105	67.5 Å²	67.5	49%	0.486	34%	0.335	S	S	.	.	H	α-helix	trans	-60.1	-39.5	176	-174	59.4	0	0	0	112	L11 T12 E13 I18 K19	L11-H15 WeakPolarHBondContact O-CB 3.45Å; L11-H15 PolarHBondContact O-N 2.71Å; T12-H15 PolarHBondContact O-N 2.87Å; E13-H15 VanDerWaalsContact C-N 3.35Å; E13-H15 PolarHBondContact O-N 3.06Å; H15-I18 PolarHBondContact O-N 3.16Å; H15-K19 VanDerWaalsContact NE2-CE 3.33Å; H15-K19 WeakPolarHBondContact NE2-CE 3.09Å; H15-K19 PolarHBondContact O-N 3.35Å; H15-K19 VanDerWaalsContact O-N 3.17Å
16	Q	98.3	Very high	96.8	Very high	83 Å²	83	67.2 Å²	67.2	39%	0.388	34%	0.335	S	S	.	.	H	α-helix	trans	-67.2	-41.1	176.4	-172.3	57.9	30.5	0	0	112.2	T12 E13 L14 I18 K19 Q20	T12-Q16 PolarHBondContact O-N 2.99Å; E13-Q16 WeakPolarHBondContact O-CB 3.33Å; E13-Q16 PolarHBondContact O-N 2.9Å; E13-Q16 VanDerWaalsContact O-N 3.13Å; L14-Q16 VanDerWaalsContact C-N 3.28Å; L14-Q16 PolarHBondContact O-N 3.23Å; Q16-I18 VanDerWaalsContact C-N 3.3Å; Q16-I18 PolarHBondContact O-N 3.08Å; Q16-K19 WeakPolarHBondContact O-CB 3.49Å; Q16-K19 PolarHBondContact O-N 3.16Å; Q16-Q20 WeakPolarHBondContact O-CG 3.41Å; Q16-Q20 PolarHBondContact O-N 3.43Å
17	L	98.2	Very high	96.7	Very high	13 Å²	13	68.7 Å²	68.7	7%	0.068	34%	0.339	C	S	.	.	H	α-helix	trans	-62	-37.9	175.3	-70	167.9	0	0	0	111.9	E13 L14 Q20 T21 I73 H76 A77 K80	E13-L17 WeakPolarHBondContact O-CG 3.39Å; E13-L17 PolarHBondContact O-N 3.4Å; L14-L17 PolarHBondContact O-N 2.92Å; L17-Q20 PolarHBondContact O-N 3.42Å; L17-T21 PolarHBondContact O-N 3.24Å; L17-T21 PolarHBondContact O-OG1 3.12Å; L17-I73 HydrophobicContact CB-CG2 4.25Å; L17-I73 HydrophobicContact CD2-CG2 4.03Å; L17-I73 WeakPolarHBondContact O-CG2 3.12Å; L17-H76 HydrophobicContact CD1-CB 4.31Å; L17-H76 HydrophobicContact CD2-CB 4.35Å; L17-A77 HydrophobicContact CB-CB 4.22Å; L17-A77 HydrophobicContact CD1-CB 4.38Å; L17-K80 HydrophobicContact CD1-CG 3.81Å
18	I	96.8	Very high	96.7	Very high	97 Å²	97	68.5 Å²	68.5	50%	0.497	34%	0.339	S	S	.	.	H	α-helix	trans	-62.7	-43.7	175.1	-68.6	166.3	0	0	0	110.7	L14 H15 Q16 T21 Q22	L14-I18 HydrophobicContact CD1-CD1 4.39Å; L14-I18 HydrophobicContact CG-CD1 4.21Å; L14-I18 WeakPolarHBondContact O-CG1 3.46Å; L14-I18 PolarHBondContact O-N 2.88Å; H15-I18 PolarHBondContact O-N 3.16Å; Q16-I18 VanDerWaalsContact C-N 3.3Å; Q16-I18 PolarHBondContact O-N 3.08Å; I18-T21 WeakPolarHBondContact O-CB 3.43Å; I18-T21 PolarHBondContact O-N 3.41Å; I18-Q22 PolarHBondContact O-N 2.99Å
19	K	97.7	Very high	96.8	Very high	97 Å²	97	71.6 Å²	71.6	42%	0.422	34%	0.344	S	S	.	.	H	α-helix	trans	-62.2	-46.2	175.3	-70.6	179	179.4	178.8	0	112.1	H15 Q16 T21 Q22 E23	H15-K19 VanDerWaalsContact NE2-CE 3.33Å; H15-K19 WeakPolarHBondContact NE2-CE 3.09Å; H15-K19 PolarHBondContact O-N 3.35Å; H15-K19 VanDerWaalsContact O-N 3.17Å; Q16-K19 WeakPolarHBondContact O-CB 3.49Å; Q16-K19 PolarHBondContact O-N 3.16Å; K19-T21 VanDerWaalsContact C-N 3.27Å; K19-T21 PolarHBondContact O-N 2.74Å; K19-Q22 WeakPolarHBondContact O-CB 3.47Å; K19-Q22 PolarHBondContact O-N 2.97Å; K19-E23 PolarHBondContact O-N 3.25Å
20	Q	97.4	Very high	96.7	Very high	70 Å²	70	73.7 Å²	73.7	33%	0.327	35%	0.354	S	S	.	.	H	α-helix	trans	-60.5	-37.8	177.2	-71.8	174.2	-16	0	0	111.9	Q16 L17 Q22 E23 E24 I73	Q16-Q20 WeakPolarHBondContact O-CG 3.41Å; Q16-Q20 PolarHBondContact O-N 3.43Å; L17-Q20 PolarHBondContact O-N 3.42Å; Q20-Q22 VanDerWaalsContact C-N 3.28Å; Q20-Q22 PolarHBondContact O-N 3.43Å; Q20-E23 PolarHBondContact O-N 3.45Å; Q20-E24 WeakPolarHBondContact O-CG 3.47Å; Q20-E24 PolarHBondContact O-N 2.86Å; Q20-I73 HydrophobicContact CB-CD1 4.18Å; Q20-I73 HydrophobicContact CB-CG2 4.29Å
21	T	96.6	Very high	96.6	Very high	11 Å²	11	75 Å²	75	7%	0.067	36%	0.361	C	S	.	.	H	α-helix	trans	-59	-42.2	173.8	-55.3	0	0	0	0	111.1	L17 I18 K19 E24 R25 E70 I73 L74	L17-T21 PolarHBondContact O-N 3.24Å; L17-T21 PolarHBondContact O-OG1 3.12Å; I18-T21 WeakPolarHBondContact O-CB 3.43Å; I18-T21 PolarHBondContact O-N 3.41Å; K19-T21 VanDerWaalsContact C-N 3.27Å; K19-T21 PolarHBondContact O-N 2.74Å; T21-E24 PolarHBondContact O-N 3.48Å; T21-R25 WeakPolarHBondContact O-CB 3.4Å; T21-R25 PolarHBondContact O-N 3.49Å; T21-E70 HydrophobicContact CG2-CG 4.04Å; T21-I73 VanDerWaalsContact OG1-CG2 3.24Å; T21-I73 WeakPolarHBondContact OG1-CG2 3.49Å; T21-L74 HydrophobicContact CG2-CD1 4.44Å; T21-L74 HydrophobicContact CG2-CD2 3.74Å; T21-L74 HydrophobicContact CG2-CG 3.91Å
22	Q	95.8	Very high	96.6	Very high	106 Å²	106	75.1 Å²	75.1	50%	0.495	36%	0.361	S	S	.	.	H	α-helix	trans	-67.9	-36.4	178	-174.7	57.6	49.8	0	0	112.4	I18 K19 Q20 R25 S26	I18-Q22 PolarHBondContact O-N 2.99Å; K19-Q22 WeakPolarHBondContact O-CB 3.47Å; K19-Q22 PolarHBondContact O-N 2.97Å; Q20-Q22 VanDerWaalsContact C-N 3.28Å; Q20-Q22 PolarHBondContact O-N 3.43Å; Q22-R25 PolarHBondContact O-N 3.23Å; Q22-S26 PolarHBondContact O-N 2.97Å; Q22-S26 PolarHBondContact O-OG 3.48Å
23	E	95.6	Very high	96.5	Very high	118 Å²	118	73.8 Å²	73.8	55%	0.551	35%	0.35	S	S	*	.	H	α-helix	trans	-63.1	-48.7	174.5	-69.4	169.3	-173.3	0	0	110.9	K19 Q20 R25 S26 R27	K19-E23 PolarHBondContact O-N 3.25Å; Q20-E23 PolarHBondContact O-N 3.45Å; E23-R25 VanDerWaalsContact C-N 3.35Å; E23-R25 PolarHBondContact O-N 2.94Å; E23-S26 WeakPolarHBondContact O-CB 3.48Å; E23-S26 PolarHBondContact O-N 3.17Å; E23-R27 PolarHBondContact O-N 3.15Å
24	E	95.2	Very high	96.5	Very high	32 Å²	32	72.4 Å²	72.4	15%	0.15	35%	0.345	C	S	.	.	H	α-helix	trans	-61.6	-41.9	176.3	-70.3	-59.9	101.4	0	0	112.2	Q20 T21 S26 R27 S28 A69 E70 I73	Q20-E24 WeakPolarHBondContact O-CG 3.47Å; Q20-E24 PolarHBondContact O-N 2.86Å; T21-E24 PolarHBondContact O-N 3.48Å; E24-S26 VanDerWaalsContact C-N 3.32Å; E24-S26 PolarHBondContact O-N 2.98Å; E24-R27 VanDerWaalsContact CD-CZ 3.5Å; E24-R27 WeakPolarHBondContact O-CB 3.37Å; E24-R27 PolarHBondContact O-N 3.04Å; E24-R27 IonicContact OE1-CZ 2.71Å; E24-R27 VanDerWaalsContact OE1-CZ 3.29Å; E24-R27 IonicContact OE1-NH1 3.88Å; E24-R27 PolarHBondContact OE1-NH1 3.21Å; E24-R27 IonicContact OE1-NH2 2.82Å; E24-R27 IonicContact OE2-CZ 3.67Å; E24-R27 IonicContact OE2-NE 2.98Å; E24-R27 IonicContact OE2-NH1 2.72Å; E24-R27 PolarHBondContact OE2-NH1 3.27Å; E24-R27 IonicContact OE2-NH2 3.44Å; E24-R27 PolarHBondContact OE2-NH2 3.13Å; E24-S28 WeakPolarHBondContact O-CB 3.42Å; E24-S28 PolarHBondContact O-N 3.15Å; E24-A69 WeakPolarHBondContact OE2-CB 3.47Å; E24-E70 HydrophobicContact CB-CB 4.42Å; E24-I73 HydrophobicContact CB-CD1 4.44Å; E24-I73 HydrophobicContact CG-CD1 3.45Å; E24-I73 VanDerWaalsContact CG-CD1 3.45Å
25	R	95.7	Very high	96.5	Very high	120 Å²	120	72 Å²	72	45%	0.453	34%	0.343	S	S	.	.	H	α-helix	trans	-59.9	-43.6	176	-177.8	171.8	-67.4	-179.5	-1.1	111.9	T21 Q22 E23 R27 S28 E29 E70	T21-R25 WeakPolarHBondContact O-CB 3.4Å; T21-R25 PolarHBondContact O-N 3.49Å; Q22-R25 PolarHBondContact O-N 3.23Å; E23-R25 VanDerWaalsContact C-N 3.35Å; E23-R25 PolarHBondContact O-N 2.94Å; R25-R27 VanDerWaalsContact C-N 3.29Å; R25-R27 PolarHBondContact O-N 3.06Å; R25-S28 PolarHBondContact O-N 2.82Å; R25-E29 WeakPolarHBondContact O-CB 3.49Å; R25-E29 PolarHBondContact O-N 3.3Å; R25-E70 IonicContact CZ-OE1 2.81Å; R25-E70 IonicContact NE-OE1 2.94Å; R25-E70 PolarHBondContact NE-OE1 2.73Å; R25-E70 IonicContact NH2-OE1 3.31Å; R25-E70 PolarHBondContact NH2-OE1 3.37Å
26	S	95.6	Very high	96.5	Very high	58 Å²	58	71.9 Å²	71.9	41%	0.406	34%	0.343	S	S	.	.	H	α-helix	trans	-62.6	-38.9	177.8	-53	0	0	0	0	111.3	Q22 E23 E24 H30	Q22-S26 PolarHBondContact O-N 2.97Å; Q22-S26 PolarHBondContact O-OG 3.48Å; E23-S26 WeakPolarHBondContact O-CB 3.48Å; E23-S26 PolarHBondContact O-N 3.17Å; E24-S26 VanDerWaalsContact C-N 3.32Å; E24-S26 PolarHBondContact O-N 2.98Å; S26-H30 PolarHBondContact O-N 3.5Å
27	R	93.1	Very high	96.4	Very high	108 Å²	108	73 Å²	73	41%	0.408	35%	0.346	S	S	.	.	H	α-helix	trans	-66.6	-45.3	174.7	-168.3	-177.6	76.2	-155.1	4.2	112	E23 E24 R25 E29 H30 N31 D66	E23-R27 PolarHBondContact O-N 3.15Å; E24-R27 VanDerWaalsContact CD-CZ 3.5Å; E24-R27 WeakPolarHBondContact O-CB 3.37Å; E24-R27 PolarHBondContact O-N 3.04Å; E24-R27 IonicContact OE1-CZ 2.71Å; E24-R27 VanDerWaalsContact OE1-CZ 3.29Å; E24-R27 IonicContact OE1-NH1 3.88Å; E24-R27 PolarHBondContact OE1-NH1 3.21Å; E24-R27 IonicContact OE1-NH2 2.82Å; E24-R27 IonicContact OE2-CZ 3.67Å; E24-R27 IonicContact OE2-NE 2.98Å; E24-R27 IonicContact OE2-NH1 2.72Å; E24-R27 PolarHBondContact OE2-NH1 3.27Å; E24-R27 IonicContact OE2-NH2 3.44Å; E24-R27 PolarHBondContact OE2-NH2 3.13Å; R25-R27 VanDerWaalsContact C-N 3.29Å; R25-R27 PolarHBondContact O-N 3.06Å; R27-E29 PolarHBondContact O-N 3.49Å; R27-H30 WeakPolarHBondContact O-CB 3.36Å; R27-H30 PolarHBondContact O-N 2.95Å; R27-N31 PolarHBondContact O-N 2.85Å; R27-D66 IonicContact CZ-OD1 2.85Å; R27-D66 VanDerWaalsContact CZ-OD1 3.31Å; R27-D66 IonicContact NE-OD1 3.37Å; R27-D66 PolarHBondContact NE-OD1 2.76Å; R27-D66 IonicContact NH2-OD1 3.53Å; R27-D66 PolarHBondContact NH2-OD1 3.11Å
28	S	95.3	Very high	96.3	Very high	14 Å²	14	72.8 Å²	72.8	10%	0.098	35%	0.346	C	S	.	.	H	α-helix	trans	-59.6	-45.2	177	-175	0	0	0	0	111.4	E24 R25 H30 N31 L32	E24-S28 WeakPolarHBondContact O-CB 3.42Å; E24-S28 PolarHBondContact O-N 3.15Å; R25-S28 PolarHBondContact O-N 2.82Å; S28-H30 VanDerWaalsContact C-N 3.32Å; S28-H30 PolarHBondContact O-N 3.02Å; S28-N31 PolarHBondContact O-N 3.11Å; S28-L32 WeakPolarHBondContact O-CG 3.21Å; S28-L32 PolarHBondContact O-N 2.86Å
29	E	96.4	Very high	96.3	Very high	117 Å²	117	70.6 Å²	70.6	55%	0.547	33%	0.333	S	S	.	.	H	α-helix	trans	-59.4	-41.9	177.5	-173.7	175.4	-169.9	0	0	112.1	R25 R27 N31 L32 L33	R25-E29 WeakPolarHBondContact O-CB 3.49Å; R25-E29 PolarHBondContact O-N 3.3Å; R27-E29 PolarHBondContact O-N 3.49Å; E29-N31 VanDerWaalsContact C-N 3.31Å; E29-N31 PolarHBondContact O-N 2.95Å; E29-L32 PolarHBondContact O-N 3.31Å; E29-L33 HydrophobicContact CG-CD1 4.38Å; E29-L33 WeakPolarHBondContact O-CG 3.45Å; E29-L33 PolarHBondContact O-N 2.9Å
30	H	95.7	Very high	96.2	Very high	111 Å²	111	70.2 Å²	70.2	51%	0.514	33%	0.333	S	S	.	.	H	α-helix	trans	-59.4	-42.3	173.9	-176.4	77.7	0	0	0	112.1	S26 R27 S28 L33 N34	S26-H30 PolarHBondContact O-N 3.5Å; R27-H30 WeakPolarHBondContact O-CB 3.36Å; R27-H30 PolarHBondContact O-N 2.95Å; S28-H30 VanDerWaalsContact C-N 3.32Å; S28-H30 PolarHBondContact O-N 3.02Å; H30-L33 PolarHBondContact O-N 2.88Å; H30-N34 PolarHBondContact CD2-ND2 3.43Å; H30-N34 VanDerWaalsContact CD2-ND2 3.3Å; H30-N34 PolarHBondContact NE2-ND2 2.87Å; H30-N34 PolarHBondContact O-N 3.33Å; H30-N34 VanDerWaalsContact O-N 3.08Å; H30-N34 PolarHBondContact O-ND2 2.93Å
31	N	95.1	Very high	96.1	Very high	28 Å²	28	74.2 Å²	74.2	15%	0.15	35%	0.345	C	S	.	.	H	α-helix	trans	-70.4	-37.2	179	-72.7	-25	0	0	0	112.5	R27 S28 E29 N34 I35 T62 D66	R27-N31 PolarHBondContact O-N 2.85Å; S28-N31 PolarHBondContact O-N 3.11Å; E29-N31 VanDerWaalsContact C-N 3.31Å; E29-N31 PolarHBondContact O-N 2.95Å; N31-N34 WeakPolarHBondContact O-CB 3.44Å; N31-N34 PolarHBondContact O-N 3.38Å; N31-I35 WeakPolarHBondContact O-CG1 3.34Å; N31-I35 PolarHBondContact O-N 2.98Å; N31-T62 WeakPolarHBondContact ND2-CG2 3.41Å; N31-D66 PolarHBondContact ND2-OD2 2.9Å
32	L	97.2	Very high	96	Very high	94 Å²	94	74.9 Å²	74.9	49%	0.492	35%	0.348	S	S	.	.	H	α-helix	trans	-63.2	-42.1	172.6	-67.6	177.4	0	0	0	111.9	S28 E29 N34 I35 Q36 A63	S28-L32 WeakPolarHBondContact O-CG 3.21Å; S28-L32 PolarHBondContact O-N 2.86Å; E29-L32 PolarHBondContact O-N 3.31Å; L32-N34 VanDerWaalsContact C-N 3.28Å; L32-N34 PolarHBondContact O-N 3.22Å; L32-I35 HydrophobicContact CD2-CD1 4.32Å; L32-I35 WeakPolarHBondContact O-CB 3.4Å; L32-I35 PolarHBondContact O-N 2.95Å; L32-I35 VanDerWaalsContact O-N 3.15Å; L32-Q36 PolarHBondContact O-N 3.47Å; L32-A63 HydrophobicContact CD2-CB 4.28Å
33	L	97.7	Very high	95.8	Very high	70 Å²	70	76.3 Å²	76.3	37%	0.366	35%	0.354	S	S	.	.	H	α-helix	trans	-60.2	-38.4	173.3	-77.7	164.7	0	0	0	111.9	E29 H30 I35 Q36 K37	E29-L33 HydrophobicContact CG-CD1 4.38Å; E29-L33 WeakPolarHBondContact O-CG 3.45Å; E29-L33 PolarHBondContact O-N 2.9Å; H30-L33 PolarHBondContact O-N 2.88Å; L33-I35 VanDerWaalsContact C-N 3.35Å; L33-Q36 PolarHBondContact O-N 3.29Å; L33-K37 WeakPolarHBondContact O-CB 3.38Å; L33-K37 WeakPolarHBondContact O-CG 3.14Å; L33-K37 PolarHBondContact O-N 3.36Å
34	N	97.1	Very high	95.7	Very high	47 Å²	47	76.5 Å²	76.5	25%	0.251	36%	0.363	S	S	.	.	H	α-helix	trans	-67	-35.4	176.2	-71.9	-29.6	0	0	0	112.5	H30 N31 L32 T38 L59	H30-N34 PolarHBondContact CD2-ND2 3.43Å; H30-N34 VanDerWaalsContact CD2-ND2 3.3Å; H30-N34 PolarHBondContact NE2-ND2 2.87Å; H30-N34 PolarHBondContact O-N 3.33Å; H30-N34 VanDerWaalsContact O-N 3.08Å; H30-N34 PolarHBondContact O-ND2 2.93Å; N31-N34 WeakPolarHBondContact O-CB 3.44Å; N31-N34 PolarHBondContact O-N 3.38Å; L32-N34 VanDerWaalsContact C-N 3.28Å; L32-N34 PolarHBondContact O-N 3.22Å; N34-T38 WeakPolarHBondContact O-CB 3.5Å; N34-T38 PolarHBondContact O-N 3.08Å; N34-T38 PolarHBondContact O-OG1 3.04Å; N34-L59 HydrophobicContact CB-CD2 4.2Å
35	I	97.8	Very high	95.5	Very high	12 Å²	12	80.4 Å²	80.4	6%	0.062	38%	0.382	C	S	.	.	H	α-helix	trans	-62.4	-50.9	171.7	-68.7	168.1	0	0	0	109.9	N31 L32 L33 K37 T38 H39 L56 L59 Y60 A63	N31-I35 WeakPolarHBondContact O-CG1 3.34Å; N31-I35 PolarHBondContact O-N 2.98Å; L32-I35 HydrophobicContact CD2-CD1 4.32Å; L32-I35 WeakPolarHBondContact O-CB 3.4Å; L32-I35 PolarHBondContact O-N 2.95Å; L32-I35 VanDerWaalsContact O-N 3.15Å; L33-I35 VanDerWaalsContact C-N 3.35Å; I35-K37 PolarHBondContact O-N 3.49Å; I35-T38 PolarHBondContact O-N 3.39Å; I35-T38 VanDerWaalsContact O-N 3.17Å; I35-H39 PolarHBondContact O-CD2 3.28Å; I35-H39 PolarHBondContact O-N 3.1Å; I35-L56 HydrophobicContact CG2-CD2 4.4Å; I35-L59 HydrophobicContact CD1-CB 4.2Å; I35-L59 HydrophobicContact CG1-CB 3.52Å; I35-L59 HydrophobicContact CG1-CD1 4.21Å; I35-L59 HydrophobicContact CG1-CG 4.41Å; I35-Y60 HydrophobicContact CD1-CD1 3.82Å; I35-Y60 HydrophobicContact CD1-CE1 4.01Å; I35-Y60 HydrophobicContact CD1-CG 4.45Å; I35-Y60 HydrophobicContact CG2-CE1 3.81Å; I35-Y60 HydrophobicContact CG2-CE2 4.42Å; I35-A63 HydrophobicContact CD1-CB 3.74Å
36	Q	97.7	Very high	95.1	Very high	104 Å²	104	82.1 Å²	82.1	49%	0.486	40%	0.4	S	S	.	.	H	α-helix	trans	-56.9	-52.6	179.7	-177.5	-175.7	-18.5	0	0	111.5	L32 L33 T38 H39 E40	L32-Q36 PolarHBondContact O-N 3.47Å; L33-Q36 PolarHBondContact O-N 3.29Å; Q36-T38 PolarHBondContact O-N 3.05Å; Q36-H39 WeakPolarHBondContact O-CB 3.43Å; Q36-H39 PolarHBondContact O-N 3.3Å; Q36-E40 WeakPolarHBondContact CG-OE1 3.25Å; Q36-E40 PolarHBondContact NE2-OE1 2.69Å; Q36-E40 WeakPolarHBondContact O-CG 3.47Å; Q36-E40 PolarHBondContact O-N 3.49Å
37	K	97.3	Very high	94.7	Very high	107 Å²	107	86 Å²	86	47%	0.465	41%	0.41	S	S	.	.	H	α-helix	trans	-59.5	-34.3	178.5	-72.1	175.2	-177	175.5	0	112.7	L33 I35 R41	L33-K37 WeakPolarHBondContact O-CB 3.38Å; L33-K37 WeakPolarHBondContact O-CG 3.14Å; L33-K37 PolarHBondContact O-N 3.36Å; I35-K37 PolarHBondContact O-N 3.49Å; K37-R41 WeakPolarHBondContact O-CG 3.41Å; K37-R41 PolarHBondContact O-N 2.95Å; K37-R41 VanDerWaalsContact O-N 3.16Å
38	T	96.2	Very high	94.3	Very high	8 Å²	8	84.8 Å²	84.8	5%	0.049	41%	0.414	C	S	.	.	H	α-helix	trans	-70.5	-38.2	177.5	-59	0	0	0	0	111.2	N34 I35 Q36 M42 Y52 K55 L56 L59	N34-T38 WeakPolarHBondContact O-CB 3.5Å; N34-T38 PolarHBondContact O-N 3.08Å; N34-T38 PolarHBondContact O-OG1 3.04Å; I35-T38 PolarHBondContact O-N 3.39Å; I35-T38 VanDerWaalsContact O-N 3.17Å; Q36-T38 PolarHBondContact O-N 3.05Å; T38-M42 WeakPolarHBondContact O-CB 3.45Å; T38-M42 PolarHBondContact O-N 2.94Å; T38-M42 VanDerWaalsContact O-N 3.08Å; T38-Y52 HydrophobicContact CG2-CD1 3.95Å; T38-Y52 HydrophobicContact CG2-CE1 4.37Å; T38-K55 HydrophobicContact CG2-CD 3.99Å; T38-K55 HydrophobicContact CG2-CG 4.24Å; T38-L56 HydrophobicContact CG2-CD2 3.64Å; T38-L56 HydrophobicContact CG2-CG 3.84Å; T38-L59 HydrophobicContact CG2-CD1 4.43Å
39	H	95.9	Very high	94.2	Very high	51 Å²	51	85.2 Å²	85.2	24%	0.236	42%	0.417	C	S	.	.	H	α-helix	trans	-63.9	-46.5	171.9	-87.5	-67.4	0	0	0	112.3	I35 Q36 R41 M42 Q43 Y60	I35-H39 PolarHBondContact O-CD2 3.28Å; I35-H39 PolarHBondContact O-N 3.1Å; Q36-H39 WeakPolarHBondContact O-CB 3.43Å; Q36-H39 PolarHBondContact O-N 3.3Å; H39-R41 VanDerWaalsContact C-N 3.31Å; H39-R41 PolarHBondContact O-N 2.81Å; H39-M42 PolarHBondContact O-N 2.62Å; H39-M42 VanDerWaalsContact O-N 3.16Å; H39-Q43 WeakPolarHBondContact O-CG 3.06Å; H39-Q43 PolarHBondContact O-N 3.12Å; H39-Y60 AromaticContact NE2-CZ 3.85Å; H39-Y60 PolarHBondContact NE2-OH 3.18Å
40	E	96	Very high	94	Very high	88 Å²	88	84.4 Å²	84.4	41%	0.411	42%	0.422	S	S	.	.	H	α-helix	trans	-56.7	-44.3	178.4	-72.1	168.9	-177.2	0	0	111.6	Q36 Q43 T44	Q36-E40 WeakPolarHBondContact CG-OE1 3.25Å; Q36-E40 PolarHBondContact NE2-OE1 2.69Å; Q36-E40 WeakPolarHBondContact O-CG 3.47Å; Q36-E40 PolarHBondContact O-N 3.49Å; E40-Q43 PolarHBondContact O-N 3.07Å; E40-T44 WeakPolarHBondContact O-CB 3.46Å; E40-T44 PolarHBondContact O-N 3.33Å; E40-T44 PolarHBondContact O-OG1 3.1Å
41	R	94.3	Very high	94	Very high	154 Å²	154	85.7 Å²	85.7	58%	0.581	42%	0.423	S	S	*	.	H	α-helix	trans	-64.3	-45.1	175.7	-71.3	178.2	-175.6	-166.9	1.6	112.6	K37 H39 Q43 T44 E45 Y52	K37-R41 WeakPolarHBondContact O-CG 3.41Å; K37-R41 PolarHBondContact O-N 2.95Å; K37-R41 VanDerWaalsContact O-N 3.16Å; H39-R41 VanDerWaalsContact C-N 3.31Å; H39-R41 PolarHBondContact O-N 2.81Å; R41-Q43 VanDerWaalsContact C-N 3.3Å; R41-Q43 PolarHBondContact O-N 3.16Å; R41-T44 PolarHBondContact O-N 3.03Å; R41-E45 PolarHBondContact O-N 3.08Å; R41-Y52 HydrophobicContact CB-CE1 4.31Å
42	M	94.5	Very high	93.9	Very high	26 Å²	26	84.9 Å²	84.9	13%	0.128	42%	0.418	C	S	.	.	H	α-helix	trans	-60.6	-40.5	177.9	-177.1	-172.3	67.6	0	0	111.9	T38 H39 N46 K47 T48 Y52 L56	T38-M42 WeakPolarHBondContact O-CB 3.45Å; T38-M42 PolarHBondContact O-N 2.94Å; T38-M42 VanDerWaalsContact O-N 3.08Å; H39-M42 PolarHBondContact O-N 2.62Å; H39-M42 VanDerWaalsContact O-N 3.16Å; M42-N46 PolarHBondContact O-N 2.81Å; M42-K47 PolarHBondContact O-N 3.07Å; M42-T48 HydrophobicContact SD-CG2 3.96Å; M42-Y52 HydrophobicContact CB-CD1 3.83Å; M42-Y52 HydrophobicContact CB-CD2 3.99Å; M42-Y52 HydrophobicContact CB-CE1 4.08Å; M42-Y52 HydrophobicContact CB-CE2 4.23Å; M42-Y52 HydrophobicContact CB-CG 3.81Å; M42-Y52 HydrophobicContact CG-CD1 4.31Å; M42-Y52 HydrophobicContact CG-CD2 3.77Å; M42-Y52 HydrophobicContact CG-CE2 4.36Å; M42-Y52 HydrophobicContact CG-CG 3.76Å; M42-Y52 HydrophobicContact SD-CG 4.28Å; M42-L56 HydrophobicContact CE-CD1 4.38Å; M42-L56 HydrophobicContact SD-CD1 4.07Å
43	Q	92.8	Very high	93.8	Very high	135 Å²	135	88 Å²	88	63%	0.631	42%	0.423	S	S	*	.	H	α-helix	trans	-66.9	-43.1	175.7	-72	176.9	10.2	0	0	111.5	H39 E40 R41 E45 N46	H39-Q43 WeakPolarHBondContact O-CG 3.06Å; H39-Q43 PolarHBondContact O-N 3.12Å; E40-Q43 PolarHBondContact O-N 3.07Å; R41-Q43 VanDerWaalsContact C-N 3.3Å; R41-Q43 PolarHBondContact O-N 3.16Å; Q43-E45 VanDerWaalsContact C-N 3.31Å; Q43-E45 PolarHBondContact O-N 3.18Å; Q43-N46 WeakPolarHBondContact O-CA 3.47Å; Q43-N46 PolarHBondContact O-N 3.19Å
44	T	93.1	Very high	93.7	Very high	122 Å²	122	89.4 Å²	89.4	75%	0.748	44%	0.435	S	S	*	.	H	α-helix	trans	-61.6	-39.8	178.3	-55.4	0	0	0	0	111.8	E40 R41 N46	E40-T44 WeakPolarHBondContact O-CB 3.46Å; E40-T44 PolarHBondContact O-N 3.33Å; E40-T44 PolarHBondContact O-OG1 3.1Å; R41-T44 PolarHBondContact O-N 3.03Å; T44-N46 PolarHBondContact O-N 3.14Å
45	E	91.1	Very high	93.7	Very high	115 Å²	115	90.6 Å²	90.6	54%	0.537	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-5	175.8	-70.6	178.3	-157.8	0	0	113.4	R41 Q43 K47 Y52	R41-E45 PolarHBondContact O-N 3.08Å; Q43-E45 VanDerWaalsContact C-N 3.31Å; Q43-E45 PolarHBondContact O-N 3.18Å; E45-K47 WeakPolarHBondContact O-CB 3.2Å; E45-K47 PolarHBondContact O-N 3.45Å; E45-Y52 PolarHBondContact OE1-OH 2.92Å; E45-Y52 WeakPolarHBondContact OE2-CE2 3.28Å; E45-Y52 PolarHBondContact OE2-OH 3.21Å
46	N	87.8	Confident	93.6	Very high	156 Å²	156	90.7 Å²	90.7	83%	0.834	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.3	33.6	-176.9	-153	17.4	0	0	0	113.5	M42 Q43 T44	M42-N46 PolarHBondContact O-N 2.81Å; Q43-N46 WeakPolarHBondContact O-CA 3.47Å; Q43-N46 PolarHBondContact O-N 3.19Å; T44-N46 PolarHBondContact O-N 3.14Å
47	K	86.4	Confident	93.6	Very high	140 Å²	140	94.2 Å²	94.2	61%	0.609	45%	0.448	S	S	*	.			trans	-143.4	110.2	-171.9	-171.3	176.3	-177	177	0	111.2	M42 E45 S49 Y52	M42-K47 PolarHBondContact O-N 3.07Å; E45-K47 WeakPolarHBondContact O-CB 3.2Å; E45-K47 PolarHBondContact O-N 3.45Å; K47-S49 VanDerWaalsContact C-N 3.26Å; K47-S49 PolarHBondContact O-N 3.46Å; K47-Y52 WeakPolarHBondContact O-CD2 3.48Å
48	T	86.1	Confident	93.6	Very high	82 Å²	82	90.8 Å²	90.8	50%	0.503	44%	0.443	S	S	.	.			trans	-79	76.6	170.4	-44.8	0	0	0	0	110.4	M42 R53	M42-T48 HydrophobicContact SD-CG2 3.96Å; T48-R53 HydrophobicContact CG2-CG 4.03Å
49	S	91.4	Very high	93.7	Very high	22 Å²	22	91.8 Å²	91.8	15%	0.154	45%	0.448	C	S	.	.			trans	-72.2	157.7	179.9	75.8	0	0	0	0	112.4	K47 Y51 Y52 R53	K47-S49 VanDerWaalsContact C-N 3.26Å; K47-S49 PolarHBondContact O-N 3.46Å; S49-Y51 PolarHBondContact O-N 2.95Å; S49-Y51 PolarHBondContact OG-N 3.44Å; S49-Y52 PolarHBondContact O-N 3.4Å; S49-Y52 VanDerWaalsContact O-N 3.13Å; S49-Y52 WeakPolarHBondContact OG-CD2 3.27Å; S49-Y52 PolarHBondContact OG-N 3.39Å; S49-R53 PolarHBondContact O-N 2.81Å; S49-R53 VanDerWaalsContact O-N 3.16Å
50	P	94.1	Very high	93.8	Very high	101 Å²	101	95.1 Å²	95.1	66%	0.656	46%	0.459	S	S	*	.	H	α-helix	trans	-54.3	-33.4	171	-26.8	35.4	0	0	0	113.1	R53 T54	P50-R53 PolarHBondContact O-N 3.41Å; P50-T54 PolarHBondContact O-N 3.1Å; P50-T54 PolarHBondContact O-OG1 3.25Å; P50-T54 VanDerWaalsContact O-OG1 3.13Å
51	Y	93.7	Very high	93.9	Very high	138 Å²	138	95.2 Å²	95.2	54%	0.541	47%	0.465	S	S	.	.	H	α-helix	trans	-58.9	-51.9	174.4	169.1	-96.4	0	0	0	111.8	S49 R53 T54 K55	S49-Y51 PolarHBondContact O-N 2.95Å; S49-Y51 PolarHBondContact OG-N 3.44Å; Y51-R53 VanDerWaalsContact C-N 3.32Å; Y51-R53 PolarHBondContact O-N 3.26Å; Y51-T54 PolarHBondContact O-N 2.89Å; Y51-K55 HydrophobicContact CE1-CD 3.98Å; Y51-K55 WeakPolarHBondContact O-CB 3.45Å; Y51-K55 PolarHBondContact O-N 2.84Å; Y51-K55 WeakPolarHBondContact OH-CD 3.48Å; Y51-K55 PolarHBondContact OH-NZ 3.29Å
52	Y	94.9	Very high	94	Very high	11 Å²	11	91 Å²	91	4%	0.043	46%	0.457	C	S	.	.	H	α-helix	trans	-62.5	-40	179.9	-75	-61.9	0	0	0	112.1	T38 R41 M42 E45 K47 S49 K55 L56	T38-Y52 HydrophobicContact CG2-CD1 3.95Å; T38-Y52 HydrophobicContact CG2-CE1 4.37Å; R41-Y52 HydrophobicContact CB-CE1 4.31Å; M42-Y52 HydrophobicContact CB-CD1 3.83Å; M42-Y52 HydrophobicContact CB-CD2 3.99Å; M42-Y52 HydrophobicContact CB-CE1 4.08Å; M42-Y52 HydrophobicContact CB-CE2 4.23Å; M42-Y52 HydrophobicContact CB-CG 3.81Å; M42-Y52 HydrophobicContact CG-CD1 4.31Å; M42-Y52 HydrophobicContact CG-CD2 3.77Å; M42-Y52 HydrophobicContact CG-CE2 4.36Å; M42-Y52 HydrophobicContact CG-CG 3.76Å; M42-Y52 HydrophobicContact SD-CG 4.28Å; E45-Y52 PolarHBondContact OE1-OH 2.92Å; E45-Y52 WeakPolarHBondContact OE2-CE2 3.28Å; E45-Y52 PolarHBondContact OE2-OH 3.21Å; K47-Y52 WeakPolarHBondContact O-CD2 3.48Å; S49-Y52 PolarHBondContact O-N 3.4Å; S49-Y52 VanDerWaalsContact O-N 3.13Å; S49-Y52 WeakPolarHBondContact OG-CD2 3.27Å; S49-Y52 PolarHBondContact OG-N 3.39Å; Y52-K55 PolarHBondContact O-N 3.45Å; Y52-L56 VanDerWaalsContact O-CB 3.27Å; Y52-L56 WeakPolarHBondContact O-CB 3.22Å; Y52-L56 VanDerWaalsContact O-CG 3.32Å; Y52-L56 WeakPolarHBondContact O-CG 3.32Å; Y52-L56 PolarHBondContact O-N 3.46Å
53	R	93.8	Very high	94.1	Very high	158 Å²	158	90.3 Å²	90.3	60%	0.596	46%	0.456	S	S	*	.	H	α-helix	trans	-60.1	-48.7	176.4	-68.3	-179.2	-180	179.1	0.6	111.9	T48 S49 P50 Y51 R57	T48-R53 HydrophobicContact CG2-CG 4.03Å; S49-R53 PolarHBondContact O-N 2.81Å; S49-R53 VanDerWaalsContact O-N 3.16Å; P50-R53 PolarHBondContact O-N 3.41Å; Y51-R53 VanDerWaalsContact C-N 3.32Å; Y51-R53 PolarHBondContact O-N 3.26Å; R53-R57 VanDerWaalsContact O-CB 3.3Å; R53-R57 WeakPolarHBondContact O-CB 3.23Å; R53-R57 PolarHBondContact O-N 3.5Å
54	T	96.5	Very high	94.2	Very high	101 Å²	101	92 Å²	92	62%	0.62	46%	0.457	S	S	*	.	H	α-helix	trans	-65.8	-43.7	179.5	-59.8	0	0	0	0	111.4	P50 Y51 R57 G58	P50-T54 PolarHBondContact O-N 3.1Å; P50-T54 PolarHBondContact O-OG1 3.25Å; P50-T54 VanDerWaalsContact O-OG1 3.13Å; Y51-T54 PolarHBondContact O-N 2.89Å; T54-R57 PolarHBondContact O-N 3.43Å; T54-G58 PolarHBondContact O-N 3.28Å
55	K	96.1	Very high	94.4	Very high	72 Å²	72	88.6 Å²	88.6	31%	0.313	44%	0.441	S	S	.	.	H	α-helix	trans	-63.4	-50	179	-175.4	172.3	-176.8	176.7	0	112.2	T38 Y51 Y52 R57 G58 L59	T38-K55 HydrophobicContact CG2-CD 3.99Å; T38-K55 HydrophobicContact CG2-CG 4.24Å; Y51-K55 HydrophobicContact CE1-CD 3.98Å; Y51-K55 WeakPolarHBondContact O-CB 3.45Å; Y51-K55 PolarHBondContact O-N 2.84Å; Y51-K55 WeakPolarHBondContact OH-CD 3.48Å; Y51-K55 PolarHBondContact OH-NZ 3.29Å; Y52-K55 PolarHBondContact O-N 3.45Å; K55-R57 VanDerWaalsContact C-N 3.33Å; K55-R57 PolarHBondContact O-N 3.26Å; K55-G58 PolarHBondContact O-N 3.09Å; K55-L59 HydrophobicContact CG-CD1 4.24Å; K55-L59 WeakPolarHBondContact O-CG 3.22Å; K55-L59 PolarHBondContact O-N 2.66Å
56	L	96.4	Very high	94.6	Very high	14 Å²	14	83.5 Å²	83.5	7%	0.073	42%	0.417	C	S	.	.	H	α-helix	trans	-62.1	-40.7	178	-74.4	169.6	0	0	0	111.3	I35 T38 M42 Y52 G58 L59 Y60	I35-L56 HydrophobicContact CG2-CD2 4.4Å; T38-L56 HydrophobicContact CG2-CD2 3.64Å; T38-L56 HydrophobicContact CG2-CG 3.84Å; M42-L56 HydrophobicContact CE-CD1 4.38Å; M42-L56 HydrophobicContact SD-CD1 4.07Å; Y52-L56 VanDerWaalsContact O-CB 3.27Å; Y52-L56 WeakPolarHBondContact O-CB 3.22Å; Y52-L56 VanDerWaalsContact O-CG 3.32Å; Y52-L56 WeakPolarHBondContact O-CG 3.32Å; Y52-L56 PolarHBondContact O-N 3.46Å; L56-G58 VanDerWaalsContact C-N 3.32Å; L56-G58 PolarHBondContact O-N 3.43Å; L56-L59 PolarHBondContact O-N 3.19Å; L56-Y60 HydrophobicContact CB-CD2 4.32Å; L56-Y60 HydrophobicContact CB-CE2 4.22Å; L56-Y60 HydrophobicContact CD2-CE2 4.46Å; L56-Y60 WeakPolarHBondContact O-CD2 3.45Å; L56-Y60 PolarHBondContact O-N 3.07Å
57	R	96.9	Very high	94.9	Very high	178 Å²	178	78.2 Å²	78.2	67%	0.672	40%	0.395	S	S	*	.	H	α-helix	trans	-57.4	-45.5	174.4	-175.2	-175.7	-63.5	175.8	-1.5	111.8	R53 T54 K55 T61	R53-R57 VanDerWaalsContact O-CB 3.3Å; R53-R57 WeakPolarHBondContact O-CB 3.23Å; R53-R57 PolarHBondContact O-N 3.5Å; T54-R57 PolarHBondContact O-N 3.43Å; K55-R57 VanDerWaalsContact C-N 3.33Å; K55-R57 PolarHBondContact O-N 3.26Å; R57-T61 WeakPolarHBondContact O-CB 3.4Å; R57-T61 PolarHBondContact O-N 2.9Å; R57-T61 PolarHBondContact O-OG1 2.79Å
58	G	97.9	Very high	95.2	Very high	35 Å²	35	76.5 Å²	76.5	36%	0.361	39%	0.389	S	S	.	.	H	α-helix	trans	-59.8	-49.7	175.4	0	0	0	0	0	111.9	T54 K55 L56 Y60 T61 T62	T54-G58 PolarHBondContact O-N 3.28Å; K55-G58 PolarHBondContact O-N 3.09Å; L56-G58 VanDerWaalsContact C-N 3.32Å; L56-G58 PolarHBondContact O-N 3.43Å; G58-Y60 PolarHBondContact O-N 3.02Å; G58-T61 WeakPolarHBondContact O-CB 3.2Å; G58-T61 PolarHBondContact O-N 3.27Å; G58-T61 VanDerWaalsContact O-N 3.12Å; G58-T62 PolarHBondContact O-N 3.13Å; G58-T62 PolarHBondContact O-OG1 3.03Å
59	L	97.6	Very high	95.6	Very high	29 Å²	29	74 Å²	74	15%	0.152	38%	0.377	C	S	.	.	H	α-helix	trans	-61	-42.9	179.3	-67.4	171.3	0	0	0	112.7	N34 I35 T38 K55 L56 T61 T62 A63	N34-L59 HydrophobicContact CB-CD2 4.2Å; I35-L59 HydrophobicContact CD1-CB 4.2Å; I35-L59 HydrophobicContact CG1-CB 3.52Å; I35-L59 HydrophobicContact CG1-CD1 4.21Å; I35-L59 HydrophobicContact CG1-CG 4.41Å; T38-L59 HydrophobicContact CG2-CD1 4.43Å; K55-L59 HydrophobicContact CG-CD1 4.24Å; K55-L59 WeakPolarHBondContact O-CG 3.22Å; K55-L59 PolarHBondContact O-N 2.66Å; L56-L59 PolarHBondContact O-N 3.19Å; L59-T61 VanDerWaalsContact C-N 3.31Å; L59-T61 PolarHBondContact O-N 3.24Å; L59-T62 PolarHBondContact O-N 2.78Å; L59-A63 WeakPolarHBondContact O-CB 3.42Å; L59-A63 PolarHBondContact O-N 3.02Å
60	Y	97.9	Very high	95.8	Very high	120 Å²	120	74.3 Å²	74.3	47%	0.471	38%	0.376	S	S	.	.	H	α-helix	trans	-65.7	-34.5	175.2	-76.9	-60	0	0	0	112.7	I35 H39 L56 G58 A63 R64	I35-Y60 HydrophobicContact CD1-CD1 3.82Å; I35-Y60 HydrophobicContact CD1-CE1 4.01Å; I35-Y60 HydrophobicContact CD1-CG 4.45Å; I35-Y60 HydrophobicContact CG2-CE1 3.81Å; I35-Y60 HydrophobicContact CG2-CE2 4.42Å; H39-Y60 AromaticContact NE2-CZ 3.85Å; H39-Y60 PolarHBondContact NE2-OH 3.18Å; L56-Y60 HydrophobicContact CB-CD2 4.32Å; L56-Y60 HydrophobicContact CB-CE2 4.22Å; L56-Y60 HydrophobicContact CD2-CE2 4.46Å; L56-Y60 WeakPolarHBondContact O-CD2 3.45Å; L56-Y60 PolarHBondContact O-N 3.07Å; G58-Y60 PolarHBondContact O-N 3.02Å; Y60-A63 PolarHBondContact O-N 3.38Å; Y60-R64 WeakPolarHBondContact O-CB 3.44Å; Y60-R64 PolarHBondContact O-N 3.07Å
61	T	97.8	Very high	95.8	Very high	90 Å²	90	72.2 Å²	72.2	55%	0.552	36%	0.363	S	S	*	.	H	α-helix	trans	-64.1	-44.2	174.7	-55.3	0	0	0	0	110.4	R57 G58 L59 R64 A65	R57-T61 WeakPolarHBondContact O-CB 3.4Å; R57-T61 PolarHBondContact O-N 2.9Å; R57-T61 PolarHBondContact O-OG1 2.79Å; G58-T61 WeakPolarHBondContact O-CB 3.2Å; G58-T61 PolarHBondContact O-N 3.27Å; G58-T61 VanDerWaalsContact O-N 3.12Å; L59-T61 VanDerWaalsContact C-N 3.31Å; L59-T61 PolarHBondContact O-N 3.24Å; T61-R64 PolarHBondContact O-N 2.92Å; T61-A65 PolarHBondContact O-N 2.94Å; T61-A65 VanDerWaalsContact O-N 3.11Å
62	T	96.9	Very high	95.8	Very high	65 Å²	65	69.1 Å²	69.1	40%	0.399	36%	0.362	S	S	.	.	H	α-helix	trans	-64.6	-47.4	175	-56	0	0	0	0	111.9	N31 G58 L59 R64 A65 D66	N31-T62 WeakPolarHBondContact ND2-CG2 3.41Å; G58-T62 PolarHBondContact O-N 3.13Å; G58-T62 PolarHBondContact O-OG1 3.03Å; L59-T62 PolarHBondContact O-N 2.78Å; T62-R64 VanDerWaalsContact C-N 3.26Å; T62-R64 PolarHBondContact O-N 3.47Å; T62-A65 WeakPolarHBondContact O-CA 3.38Å; T62-A65 WeakPolarHBondContact O-CB 3.37Å; T62-A65 PolarHBondContact O-N 3Å; T62-D66 PolarHBondContact O-N 3.13Å
63	A	96.8	Very high	95.9	Very high	13 Å²	13	70 Å²	70	11%	0.107	37%	0.367	C	S	.	.	H	α-helix	trans	-61.6	-35.1	179.3	0	0	0	0	0	112.5	L32 I35 L59 Y60 D66 A67	L32-A63 HydrophobicContact CD2-CB 4.28Å; I35-A63 HydrophobicContact CD1-CB 3.74Å; L59-A63 WeakPolarHBondContact O-CB 3.42Å; L59-A63 PolarHBondContact O-N 3.02Å; Y60-A63 PolarHBondContact O-N 3.38Å; A63-D66 PolarHBondContact O-N 2.87Å; A63-A67 PolarHBondContact O-N 3.5Å
64	R	95.5	Very high	96	Very high	171 Å²	171	66 Å²	66	65%	0.645	36%	0.357	S	S	*	.	H	α-helix	trans	-63.7	-45.9	171.3	179.9	-178.8	166.3	175.1	-1	111.6	Y60 T61 T62 D66 A67 E68	Y60-R64 WeakPolarHBondContact O-CB 3.44Å; Y60-R64 PolarHBondContact O-N 3.07Å; T61-R64 PolarHBondContact O-N 2.92Å; T62-R64 VanDerWaalsContact C-N 3.26Å; T62-R64 PolarHBondContact O-N 3.47Å; R64-D66 VanDerWaalsContact C-N 3.32Å; R64-D66 PolarHBondContact O-N 3.35Å; R64-A67 PolarHBondContact O-N 3.36Å; R64-E68 IonicContact CZ-OE1 3.7Å; R64-E68 IonicContact NE-OE1 3.07Å; R64-E68 PolarHBondContact NE-OE1 2.9Å; R64-E68 IonicContact NH2-OE1 3.15Å; R64-E68 PolarHBondContact NH2-OE1 3.38Å; R64-E68 VanDerWaalsContact NH2-OE1 3.15Å; R64-E68 WeakPolarHBondContact O-CG 3.38Å; R64-E68 PolarHBondContact O-N 3.35Å
65	A	95.9	Very high	95.9	Very high	50 Å²	50	63.9 Å²	63.9	41%	0.413	34%	0.338	S	S	.	.	H	α-helix	trans	-63.5	-37.5	177.9	0	0	0	0	0	112.1	T61 T62 E68 A69	T61-A65 PolarHBondContact O-N 2.94Å; T61-A65 VanDerWaalsContact O-N 3.11Å; T62-A65 WeakPolarHBondContact O-CA 3.38Å; T62-A65 WeakPolarHBondContact O-CB 3.37Å; T62-A65 PolarHBondContact O-N 3Å; A65-E68 PolarHBondContact O-N 3.26Å; A65-A69 WeakPolarHBondContact O-CB 3.45Å; A65-A69 PolarHBondContact O-N 2.83Å
66	D	95.4	Very high	95.9	Very high	7 Å²	7	64.4 Å²	64.4	4%	0.037	34%	0.341	C	S	.	.	H	α-helix	trans	-61.8	-45.9	173.6	-69	-40.2	0	0	0	111.6	R27 N31 T62 A63 R64 E68 A69 E70	R27-D66 IonicContact CZ-OD1 2.85Å; R27-D66 VanDerWaalsContact CZ-OD1 3.31Å; R27-D66 IonicContact NE-OD1 3.37Å; R27-D66 PolarHBondContact NE-OD1 2.76Å; R27-D66 IonicContact NH2-OD1 3.53Å; R27-D66 PolarHBondContact NH2-OD1 3.11Å; N31-D66 PolarHBondContact ND2-OD2 2.9Å; T62-D66 PolarHBondContact O-N 3.13Å; A63-D66 PolarHBondContact O-N 2.87Å; R64-D66 VanDerWaalsContact C-N 3.32Å; R64-D66 PolarHBondContact O-N 3.35Å; D66-E68 PolarHBondContact O-N 2.82Å; D66-A69 PolarHBondContact O-N 3.07Å; D66-E70 PolarHBondContact O-N 2.9Å
67	A	94.1	Very high	95.9	Very high	46 Å²	46	64.1 Å²	64.1	38%	0.38	34%	0.341	S	S	.	.	H	α-helix	trans	-62.8	-42.1	176.7	0	0	0	0	0	111.9	A63 R64 A69 E70 C71	A63-A67 PolarHBondContact O-N 3.5Å; R64-A67 PolarHBondContact O-N 3.36Å; A67-A69 VanDerWaalsContact C-N 3.32Å; A67-A69 PolarHBondContact O-N 2.89Å; A67-E70 PolarHBondContact O-N 3.04Å; A67-C71 WeakPolarHBondContact O-CB 3.45Å; A67-C71 PolarHBondContact O-N 2.98Å; A67-C71 PolarHBondContact O-SG 3.24Å
68	E	93.8	Very high	95.9	Very high	103 Å²	103	59.4 Å²	59.4	48%	0.481	33%	0.329	S	S	.	.	H	α-helix	trans	-61.9	-39.8	175.6	-73.7	172.9	-177.7	0	0	111.7	R64 A65 D66 S72	R64-E68 IonicContact CZ-OE1 3.7Å; R64-E68 IonicContact NE-OE1 3.07Å; R64-E68 PolarHBondContact NE-OE1 2.9Å; R64-E68 IonicContact NH2-OE1 3.15Å; R64-E68 PolarHBondContact NH2-OE1 3.38Å; R64-E68 VanDerWaalsContact NH2-OE1 3.15Å; R64-E68 WeakPolarHBondContact O-CG 3.38Å; R64-E68 PolarHBondContact O-N 3.35Å; A65-E68 PolarHBondContact O-N 3.26Å; D66-E68 PolarHBondContact O-N 2.82Å; E68-S72 WeakPolarHBondContact O-CB 3.48Å; E68-S72 PolarHBondContact O-N 3.05Å
69	A	95.1	Very high	95.7	Very high	31 Å²	31	62.1 Å²	62.1	26%	0.256	34%	0.335	S	S	.	.	H	α-helix	trans	-66.4	-48.4	176	0	0	0	0	0	112.3	E24 A65 D66 A67 C71 S72 I73	E24-A69 WeakPolarHBondContact OE2-CB 3.47Å; A65-A69 WeakPolarHBondContact O-CB 3.45Å; A65-A69 PolarHBondContact O-N 2.83Å; D66-A69 PolarHBondContact O-N 3.07Å; A67-A69 VanDerWaalsContact C-N 3.32Å; A67-A69 PolarHBondContact O-N 2.89Å; A69-C71 PolarHBondContact O-N 3.1Å; A69-S72 WeakPolarHBondContact O-CB 3.43Å; A69-S72 PolarHBondContact O-N 3.23Å; A69-S72 VanDerWaalsContact O-N 3.09Å; A69-I73 WeakPolarHBondContact O-CG1 3.5Å; A69-I73 PolarHBondContact O-N 2.96Å; A69-I73 VanDerWaalsContact O-N 3.13Å
70	E	95	Very high	95.7	Very high	27 Å²	27	61.8 Å²	61.8	13%	0.126	33%	0.332	C	S	.	.	H	α-helix	trans	-58.6	-47	176.5	-173	179.3	171.3	0	0	110.8	T21 E24 R25 D66 A67 S72 I73 L74	T21-E70 HydrophobicContact CG2-CG 4.04Å; E24-E70 HydrophobicContact CB-CB 4.42Å; R25-E70 IonicContact CZ-OE1 2.81Å; R25-E70 IonicContact NE-OE1 2.94Å; R25-E70 PolarHBondContact NE-OE1 2.73Å; R25-E70 IonicContact NH2-OE1 3.31Å; R25-E70 PolarHBondContact NH2-OE1 3.37Å; D66-E70 PolarHBondContact O-N 2.9Å; A67-E70 PolarHBondContact O-N 3.04Å; E70-S72 VanDerWaalsContact C-N 3.27Å; E70-S72 PolarHBondContact O-N 2.71Å; E70-I73 PolarHBondContact O-N 2.75Å; E70-L74 HydrophobicContact CG-CD1 4.31Å; E70-L74 PolarHBondContact O-N 2.88Å
71	C	93.6	Very high	95.6	Very high	57 Å²	57	59.1 Å²	59.1	39%	0.385	33%	0.326	S	S	.	.	H	α-helix	trans	-60.8	-34.3	176	-71.1	0	0	0	0	112.7	A67 A69 R75	A67-C71 WeakPolarHBondContact O-CB 3.45Å; A67-C71 PolarHBondContact O-N 2.98Å; A67-C71 PolarHBondContact O-SG 3.24Å; A69-C71 PolarHBondContact O-N 3.1Å; C71-R75 WeakPolarHBondContact O-CG 3.47Å; C71-R75 PolarHBondContact O-N 3.03Å; C71-R75 VanDerWaalsContact O-N 3.1Å; C71-R75 PolarHBondContact O-NH1 3.37Å
72	S	94.6	Very high	95.4	Very high	74 Å²	74	57.6 Å²	57.6	52%	0.517	32%	0.322	S	S	.	.	H	α-helix	trans	-66.3	-42	177.3	-170.2	0	0	0	0	112	E68 A69 E70 R75 H76	E68-S72 WeakPolarHBondContact O-CB 3.48Å; E68-S72 PolarHBondContact O-N 3.05Å; A69-S72 WeakPolarHBondContact O-CB 3.43Å; A69-S72 PolarHBondContact O-N 3.23Å; A69-S72 VanDerWaalsContact O-N 3.09Å; E70-S72 VanDerWaalsContact C-N 3.27Å; E70-S72 PolarHBondContact O-N 2.71Å; S72-R75 PolarHBondContact O-N 3.5Å; S72-H76 PolarHBondContact O-N 3.18Å; S72-H76 VanDerWaalsContact O-N 3.12Å
73	I	96.8	Very high	95.3	Very high	30 Å²	30	58.2 Å²	58.2	15%	0.154	32%	0.321	C	S	.	.	H	α-helix	trans	-67.7	-42.9	178.7	-60.7	171	0	0	0	110.5	L17 Q20 T21 E24 A69 E70 R75 H76 A77	L17-I73 HydrophobicContact CB-CG2 4.25Å; L17-I73 HydrophobicContact CD2-CG2 4.03Å; L17-I73 WeakPolarHBondContact O-CG2 3.12Å; Q20-I73 HydrophobicContact CB-CD1 4.18Å; Q20-I73 HydrophobicContact CB-CG2 4.29Å; T21-I73 VanDerWaalsContact OG1-CG2 3.24Å; T21-I73 WeakPolarHBondContact OG1-CG2 3.49Å; E24-I73 HydrophobicContact CB-CD1 4.44Å; E24-I73 HydrophobicContact CG-CD1 3.45Å; E24-I73 VanDerWaalsContact CG-CD1 3.45Å; A69-I73 WeakPolarHBondContact O-CG1 3.5Å; A69-I73 PolarHBondContact O-N 2.96Å; A69-I73 VanDerWaalsContact O-N 3.13Å; E70-I73 PolarHBondContact O-N 2.75Å; I73-R75 VanDerWaalsContact C-N 3.34Å; I73-R75 PolarHBondContact O-N 3.47Å; I73-H76 WeakPolarHBondContact O-CB 3.2Å; I73-H76 PolarHBondContact O-N 3.12Å; I73-A77 PolarHBondContact O-N 3.31Å
74	L	95.7	Very high	95.3	Very high	74 Å²	74	58.4 Å²	58.4	39%	0.387	32%	0.32	S	S	.	.	H	α-helix	trans	-60	-42.2	176.7	-76.2	171.9	0	0	0	112.3	T21 E70 A77 L78	T21-L74 HydrophobicContact CG2-CD1 4.44Å; T21-L74 HydrophobicContact CG2-CD2 3.74Å; T21-L74 HydrophobicContact CG2-CG 3.91Å; E70-L74 HydrophobicContact CG-CD1 4.31Å; E70-L74 PolarHBondContact O-N 2.88Å; L74-A77 WeakPolarHBondContact O-CB 3.08Å; L74-A77 PolarHBondContact O-N 2.93Å; L74-L78 WeakPolarHBondContact O-CG 3.23Å; L74-L78 PolarHBondContact O-N 3.45Å
75	R	94.8	Very high	95.1	Very high	55 Å²	55	54.8 Å²	54.8	21%	0.208	31%	0.308	C	S	.	.	H	α-helix	trans	-62.3	-43.2	174.5	-73.3	-173.9	-168.2	94.3	-2.9	111.8	C71 S72 I73 A77 L78 D79 I131 G132	C71-R75 WeakPolarHBondContact O-CG 3.47Å; C71-R75 PolarHBondContact O-N 3.03Å; C71-R75 VanDerWaalsContact O-N 3.1Å; C71-R75 PolarHBondContact O-NH1 3.37Å; S72-R75 PolarHBondContact O-N 3.5Å; I73-R75 VanDerWaalsContact C-N 3.34Å; I73-R75 PolarHBondContact O-N 3.47Å; R75-A77 VanDerWaalsContact C-N 3.29Å; R75-A77 PolarHBondContact O-N 2.74Å; R75-L78 WeakPolarHBondContact O-CB 3.47Å; R75-L78 PolarHBondContact O-N 3.03Å; R75-L78 VanDerWaalsContact O-N 3.09Å; R75-D79 PolarHBondContact O-N 3.24Å; R75-I131 PolarHBondContact NE-O 3.5Å; R75-G132 PolarHBondContact NH2-O 3.43Å
76	H	96.1	Very high	95	Very high	83 Å²	83	55.2 Å²	55.2	38%	0.384	31%	0.308	S	S	.	.	H	α-helix	trans	-62.1	-37.5	175.7	-169.8	-173.1	0	0	0	112	L17 S72 I73 L78 D79 K80	L17-H76 HydrophobicContact CD1-CB 4.31Å; L17-H76 HydrophobicContact CD2-CB 4.35Å; S72-H76 PolarHBondContact O-N 3.18Å; S72-H76 VanDerWaalsContact O-N 3.12Å; I73-H76 WeakPolarHBondContact O-CB 3.2Å; I73-H76 PolarHBondContact O-N 3.12Å; H76-L78 VanDerWaalsContact C-N 3.33Å; H76-L78 PolarHBondContact O-N 3.37Å; H76-D79 WeakPolarHBondContact O-CB 3.4Å; H76-D79 PolarHBondContact O-N 3.47Å; H76-K80 WeakPolarHBondContact NE2-CE 3.48Å; H76-K80 WeakPolarHBondContact O-CG 3.41Å; H76-K80 PolarHBondContact O-N 3.04Å; H76-K80 VanDerWaalsContact O-N 3.09Å
77	A	96.9	Very high	94.8	Very high	9 Å²	9	56.6 Å²	56.6	7%	0.074	32%	0.315	C	S	.	.	H	α-helix	trans	-63	-39.3	173.8	0	0	0	0	0	112	L14 L17 I73 L74 R75 K80 I81	L14-A77 HydrophobicContact CD1-CB 3.72Å; L14-A77 WeakPolarHBondContact CD1-O 3.44Å; L17-A77 HydrophobicContact CB-CB 4.22Å; L17-A77 HydrophobicContact CD1-CB 4.38Å; I73-A77 PolarHBondContact O-N 3.31Å; L74-A77 WeakPolarHBondContact O-CB 3.08Å; L74-A77 PolarHBondContact O-N 2.93Å; R75-A77 VanDerWaalsContact C-N 3.29Å; R75-A77 PolarHBondContact O-N 2.74Å; A77-K80 PolarHBondContact O-N 3.2Å; A77-I81 WeakPolarHBondContact O-CG1 3.35Å; A77-I81 PolarHBondContact O-N 3.09Å; A77-I81 VanDerWaalsContact O-N 3.08Å
78	L	94.9	Very high	94.7	Very high	79 Å²	79	57.7 Å²	57.7	41%	0.414	32%	0.315	S	S	.	.	H	α-helix	trans	-64.3	-39.4	174.4	-67.8	169.3	0	0	0	112.2	L74 R75 H76 K80 I81 A82 I131	L74-L78 WeakPolarHBondContact O-CG 3.23Å; L74-L78 PolarHBondContact O-N 3.45Å; R75-L78 WeakPolarHBondContact O-CB 3.47Å; R75-L78 PolarHBondContact O-N 3.03Å; R75-L78 VanDerWaalsContact O-N 3.09Å; H76-L78 VanDerWaalsContact C-N 3.33Å; H76-L78 PolarHBondContact O-N 3.37Å; L78-K80 VanDerWaalsContact C-N 3.33Å; L78-K80 PolarHBondContact O-N 3.36Å; L78-I81 PolarHBondContact O-N 2.97Å; L78-A82 PolarHBondContact O-N 3.43Å; L78-I131 HydrophobicContact CD1-CD1 3.68Å; L78-I131 HydrophobicContact CD1-CG1 4.43Å
79	D	95.1	Very high	94.4	Very high	92 Å²	92	55.7 Å²	55.7	49%	0.492	31%	0.305	S	S	.	.	H	α-helix	trans	-59.8	-44.4	174.7	-64.5	-29.1	0	0	0	110.8	R75 H76 I81 A82 E83	R75-D79 PolarHBondContact O-N 3.24Å; H76-D79 WeakPolarHBondContact O-CB 3.4Å; H76-D79 PolarHBondContact O-N 3.47Å; D79-I81 VanDerWaalsContact C-N 3.33Å; D79-I81 PolarHBondContact O-N 2.9Å; D79-A82 WeakPolarHBondContact O-CB 3.48Å; D79-A82 PolarHBondContact O-N 2.81Å; D79-A82 VanDerWaalsContact O-N 3.09Å; D79-E83 WeakPolarHBondContact O-CG 3.46Å; D79-E83 PolarHBondContact O-N 3.39Å
80	K	97.1	Very high	94.2	Very high	22 Å²	22	59.2 Å²	59.2	10%	0.096	32%	0.316	C	S	.	.	H	α-helix	trans	-61.4	-39.7	175.5	-62.8	-64.1	163.5	-177.1	0	112.8	L10 E13 L14 L17 H76 A77 L78 A82 E83 I84	L10-K80 HydrophobicContact CD2-CD 3.69Å; E13-K80 WeakPolarHBondContact OE2-CE 3.39Å; E13-K80 IonicContact OE2-NZ 3.03Å; E13-K80 PolarHBondContact OE2-NZ 3.33Å; L14-K80 HydrophobicContact CB-CB 4.32Å; L14-K80 HydrophobicContact CD1-CB 4.38Å; L17-K80 HydrophobicContact CD1-CG 3.81Å; H76-K80 WeakPolarHBondContact NE2-CE 3.48Å; H76-K80 WeakPolarHBondContact O-CG 3.41Å; H76-K80 PolarHBondContact O-N 3.04Å; H76-K80 VanDerWaalsContact O-N 3.09Å; A77-K80 PolarHBondContact O-N 3.2Å; L78-K80 VanDerWaalsContact C-N 3.33Å; L78-K80 PolarHBondContact O-N 3.36Å; K80-A82 VanDerWaalsContact C-N 3.33Å; K80-E83 IonicContact NZ-OE1 2.65Å; K80-E83 PolarHBondContact O-N 2.9Å; K80-I84 WeakPolarHBondContact O-CD1 3.5Å; K80-I84 VanDerWaalsContact O-CG1 3.25Å; K80-I84 WeakPolarHBondContact O-CG1 3.42Å; K80-I84 PolarHBondContact O-N 3.22Å
81	I	95.6	Very high	93.9	Very high	64 Å²	64	63.7 Å²	63.7	33%	0.328	33%	0.332	S	S	.	.	H	α-helix	trans	-63.2	-41.5	174.5	-68	166.9	0	0	0	110.6	L14 A77 L78 D79 I84 K85	L14-I81 HydrophobicContact CD1-CD1 4.36Å; L14-I81 HydrophobicContact CD1-CG1 4.11Å; L14-I81 HydrophobicContact CD2-CD1 4.4Å; L14-I81 HydrophobicContact CD2-CG1 3.72Å; A77-I81 WeakPolarHBondContact O-CG1 3.35Å; A77-I81 PolarHBondContact O-N 3.09Å; A77-I81 VanDerWaalsContact O-N 3.08Å; L78-I81 PolarHBondContact O-N 2.97Å; D79-I81 VanDerWaalsContact C-N 3.33Å; D79-I81 PolarHBondContact O-N 2.9Å; I81-I84 PolarHBondContact O-N 3.03Å; I81-K85 HydrophobicContact CG2-CD 4.22Å; I81-K85 WeakPolarHBondContact O-CB 3.45Å; I81-K85 WeakPolarHBondContact O-CG 3.36Å; I81-K85 PolarHBondContact O-N 3.34Å
82	A	93.8	Very high	93.6	Very high	58 Å²	58	65.4 Å²	65.4	48%	0.479	33%	0.331	S	S	.	.	H	α-helix	trans	-64.1	-43.8	177.4	0	0	0	0	0	111.7	L78 D79 K80 K85 S86	L78-A82 PolarHBondContact O-N 3.43Å; D79-A82 WeakPolarHBondContact O-CB 3.48Å; D79-A82 PolarHBondContact O-N 2.81Å; D79-A82 VanDerWaalsContact O-N 3.09Å; K80-A82 VanDerWaalsContact C-N 3.33Å; A82-K85 PolarHBondContact O-N 2.88Å; A82-S86 PolarHBondContact O-N 2.96Å
83	E	95.5	Very high	93.2	Very high	78 Å²	78	62.8 Å²	62.8	36%	0.364	31%	0.31	S	S	.	.	H	α-helix	trans	-58.7	-48.2	174.5	-71.7	178.7	-131.2	0	0	111.6	L10 D79 K80 K85 S86 L87	L10-E83 HydrophobicContact CD1-CB 4Å; L10-E83 VanDerWaalsContact CD2-OE2 3.28Å; L10-E83 WeakPolarHBondContact CD2-OE2 3.16Å; D79-E83 WeakPolarHBondContact O-CG 3.46Å; D79-E83 PolarHBondContact O-N 3.39Å; K80-E83 IonicContact NZ-OE1 2.65Å; K80-E83 PolarHBondContact O-N 2.9Å; E83-K85 VanDerWaalsContact C-N 3.34Å; E83-K85 PolarHBondContact O-N 2.73Å; E83-S86 WeakPolarHBondContact O-CB 3.49Å; E83-S86 PolarHBondContact O-N 3.39Å; E83-L87 WeakPolarHBondContact O-CG 3.27Å; E83-L87 PolarHBondContact O-N 2.95Å
84	I	95.4	Very high	92.7	Very high	17 Å²	17	63.9 Å²	63.9	9%	0.087	32%	0.324	C	S	.	.	H	α-helix	trans	-59.7	-45.7	177.7	-68.6	163.1	0	0	0	110.8	I7 L10 L11 L14 K80 I81 S86 L87 L88	I7-I84 HydrophobicContact CG2-CG2 4.33Å; L10-I84 HydrophobicContact CB-CD1 3.92Å; L10-I84 HydrophobicContact CB-CG1 3.63Å; L10-I84 HydrophobicContact CD1-CG1 3.99Å; L10-I84 HydrophobicContact CG-CG1 4.47Å; L11-I84 HydrophobicContact CD2-CD1 3.8Å; L11-I84 HydrophobicContact CG-CD1 4.05Å; L14-I84 HydrophobicContact CD2-CD1 4.33Å; K80-I84 WeakPolarHBondContact O-CD1 3.5Å; K80-I84 VanDerWaalsContact O-CG1 3.25Å; K80-I84 WeakPolarHBondContact O-CG1 3.42Å; K80-I84 PolarHBondContact O-N 3.22Å; I81-I84 PolarHBondContact O-N 3.03Å; I84-S86 VanDerWaalsContact C-N 3.33Å; I84-S86 PolarHBondContact O-N 2.84Å; I84-L87 PolarHBondContact O-N 3.24Å; I84-L88 HydrophobicContact CG2-CD1 4.05Å; I84-L88 HydrophobicContact CG2-CG 4.47Å; I84-L88 WeakPolarHBondContact O-CG 3.32Å; I84-L88 PolarHBondContact O-N 3.45Å
85	K	92.6	Very high	92.2	Very high	95 Å²	95	63.3 Å²	63.3	41%	0.413	33%	0.33	S	S	.	.	H	α-helix	trans	-61.5	-40.2	177.5	-75.9	179.5	177.2	-179	0	111.8	I81 A82 E83 L88 E89 T126	I81-K85 HydrophobicContact CG2-CD 4.22Å; I81-K85 WeakPolarHBondContact O-CB 3.45Å; I81-K85 WeakPolarHBondContact O-CG 3.36Å; I81-K85 PolarHBondContact O-N 3.34Å; A82-K85 PolarHBondContact O-N 2.88Å; E83-K85 VanDerWaalsContact C-N 3.34Å; E83-K85 PolarHBondContact O-N 2.73Å; K85-L88 PolarHBondContact O-N 2.97Å; K85-E89 WeakPolarHBondContact O-CB 3.41Å; K85-E89 PolarHBondContact O-N 2.85Å; K85-T126 PolarHBondContact NZ-O 3.11Å
86	S	92.3	Very high	91.4	Very high	59 Å²	59	62.8 Å²	62.8	41%	0.413	33%	0.329	S	S	.	.	H	α-helix	trans	-60.1	-48.7	175.7	-165.9	0	0	0	0	111.3	A82 E83 I84 L88 E89 E90	A82-S86 PolarHBondContact O-N 2.96Å; E83-S86 WeakPolarHBondContact O-CB 3.49Å; E83-S86 PolarHBondContact O-N 3.39Å; I84-S86 VanDerWaalsContact C-N 3.33Å; I84-S86 PolarHBondContact O-N 2.84Å; S86-L88 VanDerWaalsContact C-N 3.33Å; S86-L88 PolarHBondContact O-N 2.83Å; S86-E89 PolarHBondContact O-N 2.92Å; S86-E89 VanDerWaalsContact O-N 3.14Å; S86-E90 WeakPolarHBondContact O-CG 3.49Å; S86-E90 PolarHBondContact O-N 3.37Å; S86-E90 PolarHBondContact OG-OE1 2.72Å
87	L	92.9	Very high	90.5	Very high	35 Å²	35	63.3 Å²	63.3	18%	0.183	33%	0.333	C	S	.	.	H	α-helix	trans	-63	-38.6	179.7	-69	173.3	0	0	0	112.6	K6 I7 L10 E83 I84 E89 R91	K6-L87 HydrophobicContact CB-CD1 4.38Å; K6-L87 HydrophobicContact CG-CD1 3.91Å; I7-L87 HydrophobicContact CD1-CB 4.1Å; I7-L87 HydrophobicContact CG1-CB 4.01Å; I7-L87 HydrophobicContact CG1-CD1 3.89Å; L10-L87 HydrophobicContact CD1-CD1 3.63Å; E83-L87 WeakPolarHBondContact O-CG 3.27Å; E83-L87 PolarHBondContact O-N 2.95Å; I84-L87 PolarHBondContact O-N 3.24Å; L87-E89 VanDerWaalsContact C-N 3.32Å; L87-R91 WeakPolarHBondContact O-CB 3.24Å; L87-R91 PolarHBondContact O-N 2.85Å
88	L	90.9	Very high	89.7	Confident	70 Å²	70	66.3 Å²	66.3	37%	0.366	36%	0.358	S	S	.	.	H	α-helix	trans	-64.4	-39.3	175.4	-71.9	173.4	0	0	0	111.8	I7 I84 K85 S86 R91 R92	I7-L88 HydrophobicContact CD1-CD2 3.88Å; I7-L88 HydrophobicContact CD1-CG 4.27Å; I84-L88 HydrophobicContact CG2-CD1 4.05Å; I84-L88 HydrophobicContact CG2-CG 4.47Å; I84-L88 WeakPolarHBondContact O-CG 3.32Å; I84-L88 PolarHBondContact O-N 3.45Å; K85-L88 PolarHBondContact O-N 2.97Å; S86-L88 VanDerWaalsContact C-N 3.33Å; S86-L88 PolarHBondContact O-N 2.83Å; L88-R91 PolarHBondContact O-N 3.48Å; L88-R92 PolarHBondContact O-N 3.31Å
89	E	88.6	Confident	88.1	Confident	61 Å²	61	63.8 Å²	63.8	29%	0.285	35%	0.35	S	S	.	.	H	α-helix	trans	-70.9	-43.6	177.8	-176.7	59.1	-167.9	0	0	111.8	K85 S86 L87 R91 R92 I93	K85-E89 WeakPolarHBondContact O-CB 3.41Å; K85-E89 PolarHBondContact O-N 2.85Å; S86-E89 PolarHBondContact O-N 2.92Å; S86-E89 VanDerWaalsContact O-N 3.14Å; L87-E89 VanDerWaalsContact C-N 3.32Å; E89-R91 VanDerWaalsContact C-N 3.27Å; E89-R91 PolarHBondContact O-N 2.96Å; E89-R92 VanDerWaalsContact CD-NE 3.3Å; E89-R92 WeakPolarHBondContact O-CB 3.38Å; E89-R92 PolarHBondContact O-N 2.71Å; E89-R92 IonicContact OE1-CZ 2.87Å; E89-R92 VanDerWaalsContact OE1-CZ 3.23Å; E89-R92 IonicContact OE1-NE 2.78Å; E89-R92 PolarHBondContact OE1-NE 3.14Å; E89-R92 IonicContact OE1-NH2 3.71Å; E89-R92 PolarHBondContact OE1-NH2 3.07Å; E89-R92 IonicContact OE2-CZ 2.73Å; E89-R92 IonicContact OE2-NE 3.25Å; E89-R92 PolarHBondContact OE2-NE 2.85Å; E89-I93 HydrophobicContact CG-CD1 4.01Å; E89-I93 VanDerWaalsContact O-CG1 3.31Å; E89-I93 WeakPolarHBondContact O-CG1 3.35Å; E89-I93 PolarHBondContact O-N 3.23Å
90	E	90.1	Very high	86.2	Confident	104 Å²	104	64 Å²	64	49%	0.486	36%	0.355	S	S	.	.	H	α-helix	trans	-56.3	-43	172.5	-74.1	166.6	-150	0	0	111.3	S86 I93 A94	S86-E90 WeakPolarHBondContact O-CG 3.49Å; S86-E90 PolarHBondContact O-N 3.37Å; S86-E90 PolarHBondContact OG-OE1 2.72Å; E90-I93 PolarHBondContact O-N 3.01Å; E90-A94 WeakPolarHBondContact O-CB 3.44Å; E90-A94 PolarHBondContact O-N 3.14Å
91	R	88.3	Confident	83.9	Confident	121 Å²	121	69.9 Å²	69.9	46%	0.457	39%	0.388	S	S	.	.	H	α-helix	trans	-62.5	-42.5	174.6	-171.8	178.7	70.3	179.1	3.7	112	D4 L87 L88 E89 A94 A95	D4-R91 IonicContact OD1-NH1 3.85Å; D4-R91 PolarHBondContact OD1-NH1 2.86Å; L87-R91 WeakPolarHBondContact O-CB 3.24Å; L87-R91 PolarHBondContact O-N 2.85Å; L88-R91 PolarHBondContact O-N 3.48Å; E89-R91 VanDerWaalsContact C-N 3.27Å; E89-R91 PolarHBondContact O-N 2.96Å; R91-A94 PolarHBondContact O-N 3.36Å; R91-A95 WeakPolarHBondContact O-CB 3.17Å; R91-A95 PolarHBondContact O-N 2.87Å
92	R	87.9	Confident	81.5	Confident	94 Å²	94	69.4 Å²	69.4	36%	0.355	39%	0.39	S	S	.	.	H	α-helix	trans	-60.8	-46	176.5	-173.4	-164.6	71.2	83.2	8.2	110.9	L88 E89 A95 K96 E176	L88-R92 PolarHBondContact O-N 3.31Å; E89-R92 VanDerWaalsContact CD-NE 3.3Å; E89-R92 WeakPolarHBondContact O-CB 3.38Å; E89-R92 PolarHBondContact O-N 2.71Å; E89-R92 IonicContact OE1-CZ 2.87Å; E89-R92 VanDerWaalsContact OE1-CZ 3.23Å; E89-R92 IonicContact OE1-NE 2.78Å; E89-R92 PolarHBondContact OE1-NE 3.14Å; E89-R92 IonicContact OE1-NH2 3.71Å; E89-R92 PolarHBondContact OE1-NH2 3.07Å; E89-R92 IonicContact OE2-CZ 2.73Å; E89-R92 IonicContact OE2-NE 3.25Å; E89-R92 PolarHBondContact OE2-NE 2.85Å; R92-A95 PolarHBondContact O-N 3.1Å; R92-K96 PolarHBondContact O-N 2.86Å; R92-E176 IonicContact CZ-OE1 3.02Å; R92-E176 IonicContact CZ-OE2 3.67Å; R92-E176 IonicContact NH1-OE1 2.8Å; R92-E176 PolarHBondContact NH1-OE1 3.39Å; R92-E176 IonicContact NH1-OE2 3.46Å; R92-E176 PolarHBondContact NH1-OE2 3.09Å; R92-E176 IonicContact NH2-OE1 3.91Å; R92-E176 PolarHBondContact NH2-OE1 3.42Å; R92-E176 IonicContact NH2-OE2 2.88Å; R92-E176 PolarHBondContact NH2-OE2 2.75Å
93	I	86.1	Confident	79.4	Confident	18 Å²	18	74.6 Å²	74.6	9%	0.092	41%	0.409	C	S	.	.	H	α-helix	trans	-64.2	-47	178.9	-67.3	165.4	0	0	0	110.4	E89 E90 A95 K96 M97 Q155	E89-I93 HydrophobicContact CG-CD1 4.01Å; E89-I93 VanDerWaalsContact O-CG1 3.31Å; E89-I93 WeakPolarHBondContact O-CG1 3.35Å; E89-I93 PolarHBondContact O-N 3.23Å; E90-I93 PolarHBondContact O-N 3.01Å; I93-A95 VanDerWaalsContact C-N 3.34Å; I93-A95 PolarHBondContact O-N 2.89Å; I93-K96 WeakPolarHBondContact O-CB 3.39Å; I93-K96 PolarHBondContact O-N 3.32Å; I93-K96 VanDerWaalsContact O-N 3.13Å; I93-M97 HydrophobicContact CG2-CE 3.72Å; I93-M97 PolarHBondContact O-N 3.17Å; I93-Q155 HydrophobicContact CD1-CG 4.44Å; I93-Q155 HydrophobicContact CG2-CG 4.05Å
94	A	86.9	Confident	77.2	Confident	53 Å²	53	78.2 Å²	78.2	44%	0.438	43%	0.431	S	S	.	.	H	α-helix	trans	-60	-43.1	177.6	0	0	0	0	0	112	E90 R91 K96 M97 A98	E90-A94 WeakPolarHBondContact O-CB 3.44Å; E90-A94 PolarHBondContact O-N 3.14Å; R91-A94 PolarHBondContact O-N 3.36Å; A94-K96 PolarHBondContact O-N 3.35Å; A94-M97 PolarHBondContact O-N 2.84Å; A94-A98 WeakPolarHBondContact O-CB 3.39Å; A94-A98 PolarHBondContact O-N 3.33Å
95	A	83.7	Confident	74.8	Confident	62 Å²	62	82.6 Å²	82.6	51%	0.512	46%	0.455	S	S	.	.	H	α-helix	trans	-64.3	-38.3	174.6	0	0	0	0	0	112.3	R91 R92 I93 G99	R91-A95 WeakPolarHBondContact O-CB 3.17Å; R91-A95 PolarHBondContact O-N 2.87Å; R92-A95 PolarHBondContact O-N 3.1Å; I93-A95 VanDerWaalsContact C-N 3.34Å; I93-A95 PolarHBondContact O-N 2.89Å; A95-G99 PolarHBondContact O-N 2.81Å; A95-G99 VanDerWaalsContact O-N 3.14Å
96	K	78.7	Confident	72.4	Confident	45 Å²	45	82.8 Å²	82.8	20%	0.196	47%	0.466	C	S	.	.	H	α-helix	trans	-60.2	-48.7	173.4	-173.1	177.3	170.7	-172.5	0	110.1	R92 I93 A94 G99 V100 R108 E176 D190	R92-K96 PolarHBondContact O-N 2.86Å; I93-K96 WeakPolarHBondContact O-CB 3.39Å; I93-K96 PolarHBondContact O-N 3.32Å; I93-K96 VanDerWaalsContact O-N 3.13Å; A94-K96 PolarHBondContact O-N 3.35Å; K96-G99 PolarHBondContact O-N 3.11Å; K96-V100 WeakPolarHBondContact O-CG2 3.41Å; K96-V100 PolarHBondContact O-N 3.21Å; K96-R108 PolarHBondContact O-NH2 3.39Å; K96-E176 IonicContact NZ-OE1 3.64Å; K96-D190 IonicContact NZ-OD2 3.47Å; K96-D190 PolarHBondContact NZ-OD2 3.2Å
97	M	78	Confident	70.3	Confident	94 Å²	94	85.9 Å²	85.9	46%	0.463	48%	0.484	S	S	.	.	H	α-helix	trans	-64.4	-43.7	179	-71	-160.9	-92.4	0	0	113.3	I93 A94 G99 V100	I93-M97 HydrophobicContact CG2-CE 3.72Å; I93-M97 PolarHBondContact O-N 3.17Å; A94-M97 PolarHBondContact O-N 2.84Å; M97-G99 VanDerWaalsContact C-N 3.29Å; M97-G99 PolarHBondContact O-N 2.84Å; M97-V100 PolarHBondContact O-N 3.47Å; M97-V100 VanDerWaalsContact O-N 3.13Å
98	A	78.9	Confident	68.6	Low	72 Å²	72	90.4 Å²	90.4	60%	0.595	50%	0.499	S	S	*	.	H	α-helix	trans	-61.5	-38.1	178.8	0	0	0	0	0	112.2	A94 V100	A94-A98 WeakPolarHBondContact O-CB 3.39Å; A94-A98 PolarHBondContact O-N 3.33Å; A98-V100 VanDerWaalsContact C-N 3.35Å
99	G	62.9	Low	66.8	Low	25 Å²	25	96.7 Å²	96.7	26%	0.258	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	8.1	176.3	0	0	0	0	0	115.4	A95 K96 M97 R108	A95-G99 PolarHBondContact O-N 2.81Å; A95-G99 VanDerWaalsContact O-N 3.14Å; K96-G99 PolarHBondContact O-N 3.11Å; M97-G99 VanDerWaalsContact C-N 3.29Å; M97-G99 PolarHBondContact O-N 2.84Å; G99-R108 PolarHBondContact O-NH2 3.09Å
100	V	55.2	Low	65.4	Low	98 Å²	98	97.4 Å²	97.4	59%	0.594	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-18.5	169.5	166.7	0	0	0	0	111	K96 M97 A98 S102	K96-V100 WeakPolarHBondContact O-CG2 3.41Å; K96-V100 PolarHBondContact O-N 3.21Å; M97-V100 PolarHBondContact O-N 3.47Å; M97-V100 VanDerWaalsContact O-N 3.13Å; A98-V100 VanDerWaalsContact C-N 3.35Å; V100-S102 VanDerWaalsContact C-N 3.35Å
101	N	47.2	Very low	64.7	Low	145 Å²	145	94.9 Å²	94.9	78%	0.775	52%	0.521	S	S	*	.	S	Bend	trans	-89.8	8.7	179.5	-65.4	-23.5	0	0	0	114.1
102	S	45	Very low	64.5	Low	53 Å²	53	98.8 Å²	98.8	37%	0.371	54%	0.536	S	S	.	.			trans	-111	95.4	176.9	-178.4	0	0	0	0	109.5	V100 N104	V100-S102 VanDerWaalsContact C-N 3.35Å; S102-N104 PolarHBondContact O-N 2.89Å
103	D	50.9	Low	64.4	Low	167 Å²	167	101.6 Å²	101.6	89%	0.893	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-3.1	172.2	-78.5	-33.1	0	0	0	113.3
104	N	49.3	Very low	64.6	Low	154 Å²	154	103.1 Å²	103.1	82%	0.824	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	-2.8	-174.3	-76.9	-27	0	0	0	114.6	S102	S102-N104 PolarHBondContact O-N 2.89Å
105	D	44.2	Very low	64.8	Low	110 Å²	110	104.2 Å²	104.2	59%	0.588	57%	0.568	S	S	*	*	S	Bend	trans	-82.8	137.7	176.2	-98.2	-34.6	0	0	0	111.2
106	P	42.1	Very low	65.1	Low	98 Å²	98	101.6 Å²	101.6	64%	0.636	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-56.8	147.9	174.1	24.7	-32.3	0	0	0	109.8	R108	P106-R108 PolarHBondContact O-N 3.09Å
107	P	49.7	Very low	65.8	Low	124 Å²	124	100.5 Å²	100.5	81%	0.805	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-51.1	120.3	-178.6	19.4	-31	0	0	0	108.8	K109	P107-K109 PolarHBondContact O-N 3.39Å
108	R	55.1	Low	66.6	Low	131 Å²	131	100 Å²	100	49%	0.494	54%	0.543	S	S	.	.			trans	-45.9	120.9	179.7	-72.8	-176.2	-175.5	-166.7	6	107.4	K96 G99 P106 T110	K96-R108 PolarHBondContact O-NH2 3.39Å; G99-R108 PolarHBondContact O-NH2 3.09Å; P106-R108 PolarHBondContact O-N 3.09Å; R108-T110 PolarHBondContact O-N 3.27Å
109	K	53.4	Low	67.3	Low	201 Å²	201	100 Å²	100	87%	0.874	53%	0.533	S	S	*	.			trans	-49.3	113.7	-177.7	-73.7	179.4	179.4	175.4	0	108.4	P107 M111	P107-K109 PolarHBondContact O-N 3.39Å; K109-M111 PolarHBondContact O-N 3.2Å
110	T	60.7	Low	68.8	Low	76 Å²	76	99.4 Å²	99.4	47%	0.466	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-47.3	121.8	178	-44.7	0	0	0	0	109.7	R108 R112 E194 E195	R108-T110 PolarHBondContact O-N 3.27Å; T110-R112 PolarHBondContact O-N 2.93Å; T110-E194 HydrophobicContact CG2-CB 4.19Å; T110-E195 HydrophobicContact CG2-CB 4.26Å; T110-E195 HydrophobicContact CG2-CG 3.37Å
111	M	73.9	Confident	70.8	Confident	51 Å²	51	100.8 Å²	100.8	25%	0.251	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-62.2	120.9	178.7	-176.2	-179.8	-48.7	0	0	109.2	K109 R113 V115 L116 L119 E194	K109-M111 PolarHBondContact O-N 3.2Å; M111-R113 PolarHBondContact O-N 3.47Å; M111-V115 HydrophobicContact CG-CB 3.79Å; M111-V115 HydrophobicContact CG-CG1 3.77Å; M111-V115 HydrophobicContact SD-CB 4.38Å; M111-V115 HydrophobicContact SD-CG1 3.93Å; M111-L116 HydrophobicContact CG-CB 4.45Å; M111-L116 HydrophobicContact SD-CB 4.03Å; M111-L116 HydrophobicContact SD-CD1 4.36Å; M111-L119 HydrophobicContact CE-CD1 3.8Å; M111-L119 HydrophobicContact SD-CD1 3.46Å; M111-L119 WeakPolarHBondContact SD-CD1 3.43Å; M111-E194 WeakPolarHBondContact CA-OE2 3.25Å; M111-E194 HydrophobicContact CB-CB 4.34Å; M111-E194 HydrophobicContact CB-CG 3.96Å; M111-E194 WeakPolarHBondContact CB-OE2 3.15Å; M111-E194 PolarHBondContact N-OE2 2.92Å
112	R	84.2	Confident	73.1	Confident	203 Å²	203	99.1 Å²	99.1	77%	0.766	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-57.4	137	177	-63.7	-177.6	-179.8	-172.4	-0.9	109.4	T110 G114 V115 L116	T110-R112 PolarHBondContact O-N 2.93Å; R112-G114 PolarHBondContact O-N 3.43Å; R112-V115 HydrophobicContact CB-CG2 4.34Å; R112-V115 WeakPolarHBondContact O-CA 3.26Å; R112-V115 WeakPolarHBondContact O-CB 3.24Å; R112-V115 PolarHBondContact O-N 3.17Å; R112-L116 PolarHBondContact O-N 3.21Å
113	R	86.9	Confident	75.5	Confident	153 Å²	153	98.2 Å²	98.2	58%	0.577	51%	0.505	S	S	*	.	H	α-helix	trans	-43.6	-43.6	177.9	-176.7	176	179.1	153.4	-2.3	114.3	M111 V115 L116 M117 Q237	M111-R113 PolarHBondContact O-N 3.47Å; R113-V115 VanDerWaalsContact C-N 3.31Å; R113-V115 PolarHBondContact O-N 3.08Å; R113-L116 WeakPolarHBondContact O-CB 3.49Å; R113-L116 PolarHBondContact O-N 2.99Å; R113-M117 HydrophobicContact CG-CG 4.42Å; R113-M117 WeakPolarHBondContact O-CG 3.41Å; R113-M117 PolarHBondContact O-N 3.42Å; R113-Q237 PolarHBondContact NH2-O 3.06Å
114	G	90.4	Very high	77.7	Confident	51 Å²	51	90.6 Å²	90.6	53%	0.526	47%	0.465	S	S	.	.	H	α-helix	trans	-63	-32.9	178.5	0	0	0	0	0	114.4	R112 T118	R112-G114 PolarHBondContact O-N 3.43Å; G114-T118 PolarHBondContact O-N 3.37Å; G114-T118 PolarHBondContact O-OG1 2.95Å
115	V	90.2	Very high	79.8	Confident	75 Å²	75	89.7 Å²	89.7	46%	0.455	46%	0.457	S	S	.	.	H	α-helix	trans	-71.5	-44.5	174.4	178.9	0	0	0	0	109.8	M111 R112 R113 M117 T118 L119	M111-V115 HydrophobicContact CG-CB 3.79Å; M111-V115 HydrophobicContact CG-CG1 3.77Å; M111-V115 HydrophobicContact SD-CB 4.38Å; M111-V115 HydrophobicContact SD-CG1 3.93Å; R112-V115 HydrophobicContact CB-CG2 4.34Å; R112-V115 WeakPolarHBondContact O-CA 3.26Å; R112-V115 WeakPolarHBondContact O-CB 3.24Å; R112-V115 PolarHBondContact O-N 3.17Å; R113-V115 VanDerWaalsContact C-N 3.31Å; R113-V115 PolarHBondContact O-N 3.08Å; V115-M117 PolarHBondContact O-N 2.91Å; V115-T118 WeakPolarHBondContact O-CB 3.32Å; V115-T118 PolarHBondContact O-N 3.2Å; V115-L119 WeakPolarHBondContact O-CG 3.4Å; V115-L119 PolarHBondContact O-N 3.23Å
116	L	90.3	Very high	82.2	Confident	8 Å²	8	87.7 Å²	87.7	4%	0.042	45%	0.449	C	S	.	.	H	α-helix	trans	-57.6	-48.4	176.4	176.9	61.3	0	0	0	111.3	M111 R112 R113 T118 L119 L120 I192 T239	M111-L116 HydrophobicContact CG-CB 4.45Å; M111-L116 HydrophobicContact SD-CB 4.03Å; M111-L116 HydrophobicContact SD-CD1 4.36Å; R112-L116 PolarHBondContact O-N 3.21Å; R113-L116 WeakPolarHBondContact O-CB 3.49Å; R113-L116 PolarHBondContact O-N 2.99Å; L116-T118 VanDerWaalsContact C-N 3.29Å; L116-T118 PolarHBondContact O-N 2.85Å; L116-L119 WeakPolarHBondContact O-CB 3.46Å; L116-L119 PolarHBondContact O-N 2.76Å; L116-L120 HydrophobicContact CD1-CG 4.34Å; L116-L120 HydrophobicContact CG-CD1 4.47Å; L116-L120 WeakPolarHBondContact O-CG 3.33Å; L116-L120 PolarHBondContact O-N 2.94Å; L116-I192 HydrophobicContact CD1-CG1 4.17Å; L116-T239 HydrophobicContact CD2-CG2 3.88Å
117	M	94	Very high	84.7	Confident	22 Å²	22	83.6 Å²	83.6	11%	0.108	42%	0.422	C	S	.	.	H	α-helix	trans	-60.2	-39.8	178.2	-67.1	-59.2	113.2	0	0	112.2	R113 V115 L119 L120 Q121 Q237 T239	R113-M117 HydrophobicContact CG-CG 4.42Å; R113-M117 WeakPolarHBondContact O-CG 3.41Å; R113-M117 PolarHBondContact O-N 3.42Å; V115-M117 PolarHBondContact O-N 2.91Å; M117-L119 VanDerWaalsContact C-N 3.35Å; M117-L119 PolarHBondContact O-N 3.13Å; M117-L120 HydrophobicContact CE-CD1 3.64Å; M117-L120 PolarHBondContact O-N 3Å; M117-L120 HydrophobicContact SD-CD1 4.24Å; M117-Q121 PolarHBondContact O-N 3.24Å; M117-Q237 VanDerWaalsContact SD-C 3.58Å; M117-Q237 VanDerWaalsContact SD-CA 3.58Å; M117-T239 HydrophobicContact CE-CG2 4.18Å
118	T	94.8	Very high	87	Confident	82 Å²	82	80.5 Å²	80.5	50%	0.503	40%	0.402	S	S	.	.	H	α-helix	trans	-60.3	-43.6	173.3	-57.3	0	0	0	0	111.6	G114 V115 L116 Q121 Q122	G114-T118 PolarHBondContact O-N 3.37Å; G114-T118 PolarHBondContact O-OG1 2.95Å; V115-T118 WeakPolarHBondContact O-CB 3.32Å; V115-T118 PolarHBondContact O-N 3.2Å; L116-T118 VanDerWaalsContact C-N 3.29Å; L116-T118 PolarHBondContact O-N 2.85Å; T118-Q121 PolarHBondContact O-N 2.91Å; T118-Q122 WeakPolarHBondContact O-CB 3.49Å; T118-Q122 PolarHBondContact O-N 3.01Å
119	L	92.9	Very high	88.9	Confident	74 Å²	74	76.7 Å²	76.7	39%	0.387	39%	0.391	S	S	.	.	H	α-helix	trans	-65.8	-38.9	177.4	-69.2	176.9	0	0	0	112.4	M111 V115 L116 M117 Q122 S123	M111-L119 HydrophobicContact CE-CD1 3.8Å; M111-L119 HydrophobicContact SD-CD1 3.46Å; M111-L119 WeakPolarHBondContact SD-CD1 3.43Å; V115-L119 WeakPolarHBondContact O-CG 3.4Å; V115-L119 PolarHBondContact O-N 3.23Å; L116-L119 WeakPolarHBondContact O-CB 3.46Å; L116-L119 PolarHBondContact O-N 2.76Å; M117-L119 VanDerWaalsContact C-N 3.35Å; M117-L119 PolarHBondContact O-N 3.13Å; L119-Q122 PolarHBondContact O-N 2.88Å; L119-S123 VanDerWaalsContact O-CB 3.3Å; L119-S123 WeakPolarHBondContact O-CB 3.25Å; L119-S123 PolarHBondContact O-N 2.96Å
120	L	95.5	Very high	91	Very high	12 Å²	12	69.3 Å²	69.3	6%	0.063	36%	0.358	C	S	.	.	H	α-helix	trans	-64.2	-43.6	175.6	-66.1	-176.1	0	0	0	111.2	L116 M117 S123 A124 L174 I192 L234 T239 Y280	L116-L120 HydrophobicContact CD1-CG 4.34Å; L116-L120 HydrophobicContact CG-CD1 4.47Å; L116-L120 WeakPolarHBondContact O-CG 3.33Å; L116-L120 PolarHBondContact O-N 2.94Å; M117-L120 HydrophobicContact CE-CD1 3.64Å; M117-L120 PolarHBondContact O-N 3Å; M117-L120 HydrophobicContact SD-CD1 4.24Å; L120-S123 PolarHBondContact O-N 2.95Å; L120-A124 PolarHBondContact O-N 3.21Å; L120-L174 HydrophobicContact CD1-CD2 4.21Å; L120-L174 HydrophobicContact CD2-CD2 3.48Å; L120-L174 VanDerWaalsContact CD2-CD2 3.48Å; L120-I192 HydrophobicContact CD2-CD1 3.9Å; L120-L234 HydrophobicContact CD1-CD2 4.47Å; L120-T239 HydrophobicContact CD1-CG2 4.41Å; L120-Y280 WeakPolarHBondContact CA-OH 3.43Å; L120-Y280 HydrophobicContact CB-CE2 4.49Å; L120-Y280 WeakPolarHBondContact O-CE2 3.42Å; L120-Y280 PolarHBondContact O-OH 3.3Å
121	Q	96.2	Very high	92.6	Very high	127 Å²	127	69.6 Å²	69.6	59%	0.593	36%	0.356	S	S	*	.	H	α-helix	trans	-61.5	-46.8	175.1	-171	176.8	13.6	0	0	111.1	M117 T118 S123 A124 M125	M117-Q121 PolarHBondContact O-N 3.24Å; T118-Q121 PolarHBondContact O-N 2.91Å; Q121-S123 VanDerWaalsContact C-N 3.32Å; Q121-S123 PolarHBondContact O-N 2.84Å; Q121-A124 PolarHBondContact O-N 3.01Å; Q121-M125 HydrophobicContact CG-SD 4.3Å; Q121-M125 WeakPolarHBondContact O-CG 3.49Å; Q121-M125 PolarHBondContact O-N 3.1Å
122	Q	95.5	Very high	93.5	Very high	110 Å²	110	68 Å²	68	51%	0.514	35%	0.352	S	S	.	.	H	α-helix	trans	-61.9	-38.9	177	-171.7	178	5.6	0	0	112.1	T118 L119 A124 M125 T126	T118-Q122 WeakPolarHBondContact O-CB 3.49Å; T118-Q122 PolarHBondContact O-N 3.01Å; L119-Q122 PolarHBondContact O-N 2.88Å; Q122-A124 VanDerWaalsContact C-N 3.34Å; Q122-A124 PolarHBondContact O-N 2.68Å; Q122-M125 PolarHBondContact O-N 2.85Å; Q122-T126 HydrophobicContact CG-CG2 4.27Å; Q122-T126 WeakPolarHBondContact O-CB 3.2Å; Q122-T126 WeakPolarHBondContact O-CG2 3.44Å; Q122-T126 PolarHBondContact O-N 2.85Å; Q122-T126 PolarHBondContact O-OG1 2.92Å
123	S	94.9	Very high	93.8	Very high	33 Å²	33	64.5 Å²	64.5	23%	0.231	34%	0.343	C	S	.	.	H	α-helix	trans	-63.4	-39	176.5	-171.6	0	0	0	0	111.9	L119 L120 Q121 L127 R279	L119-S123 VanDerWaalsContact O-CB 3.3Å; L119-S123 WeakPolarHBondContact O-CB 3.25Å; L119-S123 PolarHBondContact O-N 2.96Å; L120-S123 PolarHBondContact O-N 2.95Å; Q121-S123 VanDerWaalsContact C-N 3.32Å; Q121-S123 PolarHBondContact O-N 2.84Å; S123-L127 PolarHBondContact O-N 3.3Å; S123-R279 VanDerWaalsContact O-CD 3.31Å; S123-R279 WeakPolarHBondContact O-CD 3.01Å; S123-R279 PolarHBondContact OG-NE 3.13Å; S123-R279 PolarHBondContact OG-NH2 3.36Å
124	A	96.8	Very high	93.8	Very high	7 Å²	7	63.3 Å²	63.3	6%	0.058	36%	0.355	C	S	.	.	H	α-helix	trans	-69.1	-41.4	172.8	0	0	0	0	0	113.1	L120 Q121 Q122 T126 L127 K214 A277 R279 Y280	L120-A124 PolarHBondContact O-N 3.21Å; Q121-A124 PolarHBondContact O-N 3.01Å; Q122-A124 VanDerWaalsContact C-N 3.34Å; Q122-A124 PolarHBondContact O-N 2.68Å; A124-T126 VanDerWaalsContact C-N 3.3Å; A124-T126 PolarHBondContact O-N 2.77Å; A124-L127 WeakPolarHBondContact O-CB 3Å; A124-L127 PolarHBondContact O-N 2.86Å; A124-K214 WeakPolarHBondContact O-CE 3.46Å; A124-K214 PolarHBondContact O-NZ 3.29Å; A124-K214 VanDerWaalsContact O-NZ 3.11Å; A124-A277 HydrophobicContact CB-CB 3.59Å; A124-R279 HydrophobicContact CB-CB 4.17Å; A124-Y280 HydrophobicContact CB-CD2 4.11Å; A124-Y280 HydrophobicContact CB-CE2 3.55Å
125	M	94.8	Very high	93.9	Very high	135 Å²	135	64.8 Å²	64.8	67%	0.665	37%	0.37	S	S	*	.	H	α-helix	trans	-64.3	-36.4	178.9	-72.3	-179.5	71.8	0	0	112.4	Q121 Q122	Q121-M125 HydrophobicContact CG-SD 4.3Å; Q121-M125 WeakPolarHBondContact O-CG 3.49Å; Q121-M125 PolarHBondContact O-N 3.1Å; Q122-M125 PolarHBondContact O-N 2.85Å
126	T	93.7	Very high	94.1	Very high	68 Å²	68	65.1 Å²	65.1	42%	0.417	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	0.6	-175.4	58.1	0	0	0	0	114.7	K85 Q122 A124 P128	K85-T126 PolarHBondContact NZ-O 3.11Å; Q122-T126 HydrophobicContact CG-CG2 4.27Å; Q122-T126 WeakPolarHBondContact O-CB 3.2Å; Q122-T126 WeakPolarHBondContact O-CG2 3.44Å; Q122-T126 PolarHBondContact O-N 2.85Å; Q122-T126 PolarHBondContact O-OG1 2.92Å; A124-T126 VanDerWaalsContact C-N 3.3Å; A124-T126 PolarHBondContact O-N 2.77Å; T126-P128 WeakPolarHBondContact O-CD 3.21Å
127	L	95.9	Very high	94.3	Very high	12 Å²	12	69.4 Å²	69.4	6%	0.063	40%	0.4	C	S	.	.	S	Bend	trans	-59	118.4	169.6	-177.2	66.3	0	0	0	108.6	S123 A124 P211 Q212 K214 R279	S123-L127 PolarHBondContact O-N 3.3Å; A124-L127 WeakPolarHBondContact O-CB 3Å; A124-L127 PolarHBondContact O-N 2.86Å; L127-P211 WeakPolarHBondContact CD1-O 3.34Å; L127-Q212 VanDerWaalsContact CD1-C 3.46Å; L127-Q212 WeakPolarHBondContact CD1-O 3.47Å; L127-K214 HydrophobicContact CB-CG 4.12Å; L127-K214 HydrophobicContact CD2-CG 3.6Å; L127-K214 HydrophobicContact CG-CG 3.85Å; L127-R279 HydrophobicContact CD2-CB 3.7Å; L127-R279 HydrophobicContact CD2-CG 4.19Å
128	P	96.4	Very high	94.5	Very high	60 Å²	60	68.7 Å²	68.7	39%	0.39	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-59.8	144.1	-177.4	23.8	-36.4	0	0	0	111.6	T126 Q212 W213 K214	T126-P128 WeakPolarHBondContact O-CD 3.21Å; P128-Q212 WeakPolarHBondContact CG-O 3.34Å; P128-W213 HydrophobicContact CG-CG 4.49Å; P128-W213 CarbonylContact O-C 3.58Å; P128-W213 VanDerWaalsContact O-CA 3.24Å; P128-W213 WeakPolarHBondContact O-CA 3.42Å; P128-K214 PolarHBondContact O-N 2.86Å
129	L	96.6	Very high	94.6	Very high	51 Å²	51	66.1 Å²	66.1	27%	0.267	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	-73.8	137.2	165.9	-163.9	67.9	0	0	0	108.6	K214 N216 P253	L129-K214 HydrophobicContact CD1-CB 3.82Å; L129-N216 HydrophobicContact CD1-CB 3.83Å; L129-N216 HydrophobicContact CD2-CB 4.05Å; L129-N216 HydrophobicContact CG-CB 4.01Å; L129-P253 HydrophobicContact CD1-CB 3.99Å; L129-P253 HydrophobicContact CD2-CB 3.91Å; L129-P253 HydrophobicContact CD2-CG 4.22Å
130	W	96.8	Very high	94.9	Very high	45 Å²	45	65.5 Å²	65.5	17%	0.17	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-69	132.3	168.8	169.2	-110.4	0	0	0	109.9	G132 D136 P139 C142 W213 K214 D220	W130-G132 VanDerWaalsContact CZ2-CA 3.48Å; W130-D136 HydrophobicContact CZ2-CB 4.43Å; W130-P139 VanDerWaalsContact CD2-CD 3.47Å; W130-P139 HydrophobicContact CD2-CG 4.05Å; W130-P139 VanDerWaalsContact CE2-CD 3.4Å; W130-P139 HydrophobicContact CE3-CG 3.73Å; W130-P139 HydrophobicContact CH2-CG 4.05Å; W130-P139 HydrophobicContact CZ2-CG 4.35Å; W130-P139 HydrophobicContact CZ3-CG 3.73Å; W130-C142 WeakPolarHBondContact CB-SG 3.24Å; W130-W213 HydrophobicContact CB-CB 3.92Å; W130-W213 HydrophobicContact CB-CG 4.3Å; W130-K214 PolarHBondContact N-O 3.06Å; W130-D220 PolarHBondContact NE1-OD1 3.35Å
131	I	94.5	Very high	95	Very high	82 Å²	82	65.4 Å²	65.4	42%	0.421	38%	0.381	S	S	.	.			trans	-134.3	82.7	178.1	-51.6	-171.8	0	0	0	109.1	R75 L78	R75-I131 PolarHBondContact NE-O 3.5Å; L78-I131 HydrophobicContact CD1-CD1 3.68Å; L78-I131 HydrophobicContact CD1-CG1 4.43Å
132	G	91.4	Very high	95.1	Very high	18 Å²	18	59.3 Å²	59.3	19%	0.186	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-68.3	170.1	178.3	0	0	0	0	0	114.1	R75 W130	R75-G132 PolarHBondContact NH2-O 3.43Å; W130-G132 VanDerWaalsContact CZ2-CA 3.48Å
133	K	91	Very high	95.2	Very high	129 Å²	129	54.4 Å²	54.4	56%	0.561	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-87.5	161.7	164.7	-60.5	177.4	-177.8	175.4	0	109.9	G135 D136	K133-G135 PolarHBondContact O-N 2.84Å; K133-G135 VanDerWaalsContact O-N 3.13Å; K133-D136 VanDerWaalsContact CB-OD2 3.25Å; K133-D136 WeakPolarHBondContact CB-OD2 3.43Å; K133-D136 PolarHBondContact N-OD2 2.88Å; K133-D136 WeakPolarHBondContact O-CB 3.42Å; K133-D136 PolarHBondContact O-N 2.91Å
134	P	88	Confident	95.4	Very high	129 Å²	129	53.9 Å²	53.9	84%	0.838	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	121.7	174	-26.1	35.4	0	0	0	111.7
135	G	90.6	Very high	95.5	Very high	82 Å²	82	56.3 Å²	56.3	85%	0.845	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.9	-8.7	-178.7	0	0	0	0	0	115.2	K133	K133-G135 PolarHBondContact O-N 2.84Å; K133-G135 VanDerWaalsContact O-N 3.13Å
136	D	94.4	Very high	95.5	Very high	82 Å²	82	54.7 Å²	54.7	44%	0.439	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-70.9	141.2	170.4	-68.1	-15.8	0	0	0	109.6	W130 K133	W130-D136 HydrophobicContact CZ2-CB 4.43Å; K133-D136 VanDerWaalsContact CB-OD2 3.25Å; K133-D136 WeakPolarHBondContact CB-OD2 3.43Å; K133-D136 PolarHBondContact N-OD2 2.88Å; K133-D136 WeakPolarHBondContact O-CB 3.42Å; K133-D136 PolarHBondContact O-N 2.91Å
137	S	95.7	Very high	95.7	Very high	97 Å²	97	53.2 Å²	53.2	68%	0.678	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-91.8	150.8	167.6	-54.8	0	0	0	0	110.3
138	P	97.5	Very high	95.6	Very high	7 Å²	7	55.1 Å²	55.1	5%	0.045	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-53.4	131.2	173.4	-28.4	36.8	0	0	0	111.5	C142 M145 D220 E222 A223	P138-C142 HydrophobicContact CB-CB 4.08Å; P138-M145 HydrophobicContact CB-CG 3.9Å; P138-D220 HydrophobicContact CG-CB 3.76Å; P138-D220 WeakPolarHBondContact CG-OD1 3.24Å; P138-E222 WeakPolarHBondContact CD-OE1 3.49Å; P138-E222 WeakPolarHBondContact CG-OE1 3.33Å; P138-A223 HydrophobicContact CB-CB 3.77Å; P138-A223 HydrophobicContact CG-CB 3.86Å
139	P	97.5	Very high	95.4	Very high	29 Å²	29	57.6 Å²	57.6	19%	0.188	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-72.7	165.8	-177.8	30.9	-36.7	0	0	0	111.2	W130 L141 C142 M145 W213	W130-P139 VanDerWaalsContact CD2-CD 3.47Å; W130-P139 HydrophobicContact CD2-CG 4.05Å; W130-P139 VanDerWaalsContact CE2-CD 3.4Å; W130-P139 HydrophobicContact CE3-CG 3.73Å; W130-P139 HydrophobicContact CH2-CG 4.05Å; W130-P139 HydrophobicContact CZ2-CG 4.35Å; W130-P139 HydrophobicContact CZ3-CG 3.73Å; P139-L141 PolarHBondContact O-N 3.34Å; P139-C142 HydrophobicContact CG-CB 4.08Å; P139-C142 VanDerWaalsContact O-CB 3.22Å; P139-C142 WeakPolarHBondContact O-CB 3.45Å; P139-C142 PolarHBondContact O-N 2.88Å; P139-C142 VanDerWaalsContact O-N 3.07Å; P139-M145 VanDerWaalsContact O-CB 3.32Å; P139-M145 WeakPolarHBondContact O-CB 3.41Å; P139-W213 HydrophobicContact CG-CE3 4.14Å; P139-W213 HydrophobicContact CG-CZ3 4.21Å
140	P	98.2	Very high	95.2	Very high	60 Å²	60	60.9 Å²	60.9	39%	0.39	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.4	139.9	166	-27.1	35.7	0	0	0	111.5	C142 P146	P140-C142 PolarHBondContact O-N 2.95Å; P140-P146 WeakPolarHBondContact CB-O 3.48Å
141	L	98.1	Very high	95.2	Very high	10 Å²	10	61 Å²	61	5%	0.052	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	12.7	-177.1	-48.8	174.5	0	0	0	115.3	P139 M145 A147 Y151 P209 P211 Q212 W213	P139-L141 PolarHBondContact O-N 3.34Å; L141-M145 WeakPolarHBondContact CA-O 3.42Å; L141-M145 PolarHBondContact N-O 3.42Å; L141-A147 HydrophobicContact CD2-CB 3.74Å; L141-A147 HydrophobicContact CG-CB 4.39Å; L141-Y151 HydrophobicContact CD1-CD2 4.29Å; L141-Y151 HydrophobicContact CD1-CE1 3.89Å; L141-Y151 HydrophobicContact CD1-CE2 3.63Å; L141-Y151 WeakPolarHBondContact CD1-OH 3.43Å; L141-P209 HydrophobicContact CD1-CB 4.38Å; L141-P209 HydrophobicContact CD2-CB 3.94Å; L141-P211 CarbonylContact O-C 3.58Å; L141-P211 VanDerWaalsContact O-CA 3.27Å; L141-P211 WeakPolarHBondContact O-CA 3.34Å; L141-P211 WeakPolarHBondContact O-CB 3.45Å; L141-Q212 HydrophobicContact CB-CB 4.21Å; L141-Q212 HydrophobicContact CB-CG 4.19Å; L141-Q212 HydrophobicContact CD1-CG 4Å; L141-Q212 PolarHBondContact O-N 3.32Å; L141-W213 PolarHBondContact O-N 3.02Å
142	C	98.5	Very high	95.3	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-83.6	114.6	161	-178.1	0	0	0	0	109.8	W130 P138 P139 P140 A144 M145 W213	W130-C142 WeakPolarHBondContact CB-SG 3.24Å; P138-C142 HydrophobicContact CB-CB 4.08Å; P139-C142 HydrophobicContact CG-CB 4.08Å; P139-C142 VanDerWaalsContact O-CB 3.22Å; P139-C142 WeakPolarHBondContact O-CB 3.45Å; P139-C142 PolarHBondContact O-N 2.88Å; P139-C142 VanDerWaalsContact O-N 3.07Å; P140-C142 PolarHBondContact O-N 2.95Å; C142-A144 PolarHBondContact O-N 2.78Å; C142-A144 VanDerWaalsContact O-N 3.11Å; C142-M145 HydrophobicContact CB-CG 4.41Å; C142-M145 WeakPolarHBondContact O-CB 3.32Å; C142-M145 VanDerWaalsContact O-CG 3.23Å; C142-M145 WeakPolarHBondContact O-CG 3.46Å; C142-M145 PolarHBondContact O-N 3.09Å; C142-W213 HydrophobicContact CB-CB 4.32Å
143	G	98.3	Very high	95.6	Very high	6 Å²	6	58.6 Å²	58.6	6%	0.062	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	-118.6	-178.3	0	0	0	0	0	112.4	M145 P211 W213 A223	G143-M145 VanDerWaalsContact C-N 3.34Å; G143-P211 WeakPolarHBondContact O-CG 3.44Å; G143-W213 PolarHBondContact N-O 2.79Å; G143-A223 CarbonylContact C-O 3.47Å; G143-A223 WeakPolarHBondContact CA-O 3.4Å
144	A	98.3	Very high	95.8	Very high	22 Å²	22	59.7 Å²	59.7	18%	0.182	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-5.5	-180	0	0	0	0	0	114.5	C142 A223 F225	C142-A144 PolarHBondContact O-N 2.78Å; C142-A144 VanDerWaalsContact O-N 3.11Å; A144-A223 WeakPolarHBondContact CB-O 3.39Å; A144-A223 PolarHBondContact N-O 3.08Å; A144-F225 HydrophobicContact CB-CD1 3.64Å; A144-F225 HydrophobicContact CB-CD2 3.86Å; A144-F225 HydrophobicContact CB-CE1 3.59Å; A144-F225 HydrophobicContact CB-CE2 3.8Å; A144-F225 HydrophobicContact CB-CG 3.78Å; A144-F225 HydrophobicContact CB-CZ 3.67Å
145	M	98.3	Very high	96.1	Very high	59 Å²	59	57.7 Å²	57.7	29%	0.291	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-63.9	123.7	-178.7	-64.8	-56.6	-69	0	0	110.9	P138 P139 L141 C142 G143 A223	P138-M145 HydrophobicContact CB-CG 3.9Å; P139-M145 VanDerWaalsContact O-CB 3.32Å; P139-M145 WeakPolarHBondContact O-CB 3.41Å; L141-M145 WeakPolarHBondContact CA-O 3.42Å; L141-M145 PolarHBondContact N-O 3.42Å; C142-M145 HydrophobicContact CB-CG 4.41Å; C142-M145 WeakPolarHBondContact O-CB 3.32Å; C142-M145 VanDerWaalsContact O-CG 3.23Å; C142-M145 WeakPolarHBondContact O-CG 3.46Å; C142-M145 PolarHBondContact O-N 3.09Å; G143-M145 VanDerWaalsContact C-N 3.34Å; M145-A223 HydrophobicContact CG-CB 3.83Å; M145-A223 HydrophobicContact SD-CB 4.26Å
146	P	96.4	Very high	96.2	Very high	100 Å²	100	54 Å²	54	65%	0.649	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-66.9	152.2	-176	28.5	-35.1	0	0	0	111.3	P140	P140-P146 WeakPolarHBondContact CB-O 3.48Å
147	A	96.2	Very high	96.3	Very high	37 Å²	37	51.9 Å²	51.9	31%	0.306	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-61.5	146.9	167.4	0	0	0	0	0	110.7	L141 Y151 P209	L141-A147 HydrophobicContact CD2-CB 3.74Å; L141-A147 HydrophobicContact CG-CB 4.39Å; A147-Y151 HydrophobicContact CB-CD1 4.01Å; A147-Y151 HydrophobicContact CB-CG 4.08Å; A147-P209 HydrophobicContact CB-CG 4.42Å
148	S	95.3	Very high	96.4	Very high	53 Å²	53	49 Å²	49	37%	0.371	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-56.6	149.6	168.9	-53.1	0	0	0	0	111.4	D150 Y151	S148-D150 WeakPolarHBondContact CB-OD1 3.42Å; S148-D150 PolarHBondContact O-N 2.88Å; S148-D150 VanDerWaalsContact O-N 3.1Å; S148-Y151 WeakPolarHBondContact O-CB 3.46Å; S148-Y151 PolarHBondContact O-N 3.33Å
149	S	91.2	Very high	96.4	Very high	112 Å²	112	48.6 Å²	48.6	78%	0.783	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-18.9	-175.8	53.2	0	0	0	0	114.4	R204	S149-R204 VanDerWaalsContact C-NH2 3.27Å; S149-R204 PolarHBondContact O-NH1 3.07Å; S149-R204 PolarHBondContact O-NH2 2.82Å
150	D	93	Very high	96.5	Very high	120 Å²	120	47.2 Å²	47.2	64%	0.642	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-0.8	177.3	63.3	-23.8	0	0	0	112.9	S148 V152	S148-D150 WeakPolarHBondContact CB-OD1 3.42Å; S148-D150 PolarHBondContact O-N 2.88Å; S148-D150 VanDerWaalsContact O-N 3.1Å; D150-V152 PolarHBondContact O-N 3.48Å
151	Y	96	Very high	96.4	Very high	47 Å²	47	44.4 Å²	44.4	18%	0.184	25%	0.252	C	S	.	.			trans	-58.8	130.8	-179	179.6	-94.7	0	0	0	112.5	L141 A147 S148 A153 D157 R204 P209 Q212	L141-Y151 HydrophobicContact CD1-CD2 4.29Å; L141-Y151 HydrophobicContact CD1-CE1 3.89Å; L141-Y151 HydrophobicContact CD1-CE2 3.63Å; L141-Y151 WeakPolarHBondContact CD1-OH 3.43Å; A147-Y151 HydrophobicContact CB-CD1 4.01Å; A147-Y151 HydrophobicContact CB-CG 4.08Å; S148-Y151 WeakPolarHBondContact O-CB 3.46Å; S148-Y151 PolarHBondContact O-N 3.33Å; Y151-A153 HydrophobicContact CE1-CB 3.94Å; Y151-D157 PolarHBondContact OH-OD2 3.38Å; Y151-R204 VanDerWaalsContact N-NH2 3.15Å; Y151-R204 PolarHBondContact O-NE 3.26Å; Y151-R204 PolarHBondContact O-NH2 2.85Å; Y151-P209 HydrophobicContact CD1-CB 4.43Å; Y151-P209 HydrophobicContact CD1-CG 3.7Å; Y151-P209 HydrophobicContact CE1-CB 3.79Å; Y151-P209 HydrophobicContact CE1-CG 3.48Å; Y151-P209 VanDerWaalsContact CE1-CG 3.48Å; Y151-Q212 PolarHBondContact OH-NE2 3.35Å
152	V	97.4	Very high	96.3	Very high	46 Å²	46	46.7 Å²	46.7	28%	0.279	26%	0.26	S	S	.	.			trans	-119.7	115.4	172.9	176.6	0	0	0	0	108.7	D150 Y180 Y187	D150-V152 PolarHBondContact O-N 3.48Å; V152-Y180 HydrophobicContact CB-CD1 4.42Å; V152-Y180 HydrophobicContact CG1-CD1 3.37Å; V152-Y180 HydrophobicContact CG1-CD2 4.39Å; V152-Y180 HydrophobicContact CG1-CE1 3.9Å; V152-Y180 HydrophobicContact CG1-CG 3.63Å; V152-Y180 HydrophobicContact CG2-CD1 4.1Å; V152-Y180 HydrophobicContact CG2-CE1 3.74Å; V152-Y187 VanDerWaalsContact CA-OH 3.24Å; V152-Y187 WeakPolarHBondContact CA-OH 3.45Å; V152-Y187 HydrophobicContact CG1-CE1 4.26Å; V152-Y187 WeakPolarHBondContact CG1-OH 3.4Å
153	A	97.2	Very high	96.1	Very high	3 Å²	3	47.3 Å²	47.3	3%	0.025	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-59.4	140.1	174.1	0	0	0	0	0	111.2	Y151 D157 V159 V177 Y187	Y151-A153 HydrophobicContact CE1-CB 3.94Å; A153-D157 HydrophobicContact CB-CB 4.15Å; A153-V159 HydrophobicContact CB-CG1 4.29Å; A153-V177 HydrophobicContact CB-CG2 3.98Å; A153-Y187 HydrophobicContact CB-CE1 4.17Å; A153-Y187 PolarHBondContact N-OH 3.16Å; A153-Y187 VanDerWaalsContact N-OH 3.11Å
154	K	95.3	Very high	95.7	Very high	152 Å²	152	53.5 Å²	53.5	66%	0.661	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-82.9	161.6	-178.4	-61.2	177.6	-177.5	177.7	0	110.8	G156 D157 V177	K154-G156 PolarHBondContact O-N 2.92Å; K154-D157 PolarHBondContact N-OD2 3.2Å; K154-D157 VanDerWaalsContact O-CB 3.25Å; K154-D157 WeakPolarHBondContact O-CB 3.49Å; K154-D157 PolarHBondContact O-N 3.45Å; K154-D157 VanDerWaalsContact O-N 3.09Å; K154-V177 WeakPolarHBondContact O-CB 3.45Å; K154-V177 WeakPolarHBondContact O-CG1 3.45Å
155	Q	94.7	Very high	94.7	Very high	87 Å²	87	54.6 Å²	54.6	41%	0.407	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	133.8	170	-176.1	175.4	44.8	0	0	110.3	I93 D157 V177 V178	I93-Q155 HydrophobicContact CD1-CG 4.44Å; I93-Q155 HydrophobicContact CG2-CG 4.05Å; Q155-D157 VanDerWaalsContact C-N 3.31Å; Q155-V177 WeakPolarHBondContact CA-O 3.36Å; Q155-V178 VanDerWaalsContact CG-O 3.27Å; Q155-V178 WeakPolarHBondContact CG-O 3.35Å; Q155-V178 PolarHBondContact NE2-O 3.15Å
156	G	93.3	Very high	93.4	Very high	5 Å²	5	59.4 Å²	59.4	5%	0.052	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.4	-19.4	-175.9	0	0	0	0	0	114.8	K154 K158 V177	K154-G156 PolarHBondContact O-N 2.92Å; G156-K158 PolarHBondContact O-NZ 3.31Å; G156-V177 PolarHBondContact N-O 3.36Å
157	D	96.4	Very high	92.4	Very high	38 Å²	38	60.5 Å²	60.5	20%	0.203	33%	0.331	C	S	.	.			trans	-60.1	141.6	177.9	-76.4	-15.5	0	0	0	110.4	Y151 A153 K154 Q155 V177	Y151-D157 PolarHBondContact OH-OD2 3.38Å; A153-D157 HydrophobicContact CB-CB 4.15Å; K154-D157 PolarHBondContact N-OD2 3.2Å; K154-D157 VanDerWaalsContact O-CB 3.25Å; K154-D157 WeakPolarHBondContact O-CB 3.49Å; K154-D157 PolarHBondContact O-N 3.45Å; K154-D157 VanDerWaalsContact O-N 3.09Å; Q155-D157 VanDerWaalsContact C-N 3.31Å; D157-V177 HydrophobicContact CB-CG2 4.45Å; D157-V177 PolarHBondContact O-N 2.95Å
158	K	97.4	Very high	91.4	Very high	35 Å²	35	61 Å²	61	15%	0.152	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	136	175.8	-59.6	-62.2	177.6	-75.7	0	109.3	G156 L174 A175 E176 I192 L210	G156-K158 PolarHBondContact O-NZ 3.31Å; K158-L174 HydrophobicContact CB-CD1 4.24Å; K158-A175 WeakPolarHBondContact CA-O 3.28Å; K158-E176 HydrophobicContact CD-CB 4.22Å; K158-E176 WeakPolarHBondContact CE-OE2 3.16Å; K158-E176 IonicContact NZ-OE2 2.83Å; K158-E176 PolarHBondContact NZ-OE2 3.43Å; K158-I192 HydrophobicContact CD-CD1 3.95Å; K158-L210 HydrophobicContact CB-CD1 4.37Å; K158-L210 HydrophobicContact CB-CD2 4.09Å; K158-L210 WeakPolarHBondContact O-CB 3.46Å; K158-L210 WeakPolarHBondContact O-CD1 3.26Å; K158-L210 PolarHBondContact O-N 3.49Å; K158-L210 VanDerWaalsContact O-N 3.14Å
159	V	98.3	Very high	91	Very high	0 Å²	0	64 Å²	64	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	151.9	-178.6	-60.1	0	0	0	0	110.9	A153 A161 A175 V177 V189 I207 I208	A153-V159 HydrophobicContact CB-CG1 4.29Å; V159-A161 HydrophobicContact CG2-CB 4.35Å; V159-A175 HydrophobicContact CG2-CB 4.05Å; V159-A175 PolarHBondContact N-O 2.98Å; V159-A175 PolarHBondContact O-N 3.45Å; V159-V177 HydrophobicContact CB-CG2 4.5Å; V159-V177 HydrophobicContact CG1-CG2 3.51Å; V159-V177 HydrophobicContact CG2-CG2 4.12Å; V159-V189 HydrophobicContact CG2-CG1 4.14Å; V159-I207 HydrophobicContact CB-CG2 3.85Å; V159-I207 HydrophobicContact CG1-CG2 3.74Å; V159-I207 HydrophobicContact CG2-CD1 4.32Å; V159-I207 HydrophobicContact CG2-CG2 4.2Å; V159-I208 CarbonylContact C-O 3.58Å; V159-I208 WeakPolarHBondContact CA-O 3.25Å
160	A	98.3	Very high	90.9	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	123.7	157.4	0	0	0	0	0	107.4	W172 I173 I208 L210 F241 V282	A160-W172 HydrophobicContact CB-CE3 4.02Å; A160-W172 WeakPolarHBondContact O-CZ3 3.38Å; A160-I173 CarbonylContact C-O 3.58Å; A160-I173 WeakPolarHBondContact CA-O 3.4Å; A160-I208 HydrophobicContact CB-CB 4.32Å; A160-I208 PolarHBondContact N-O 2.98Å; A160-I208 PolarHBondContact O-N 3.33Å; A160-L210 VanDerWaalsContact N-CD1 3.27Å; A160-F241 HydrophobicContact CB-CD1 4.47Å; A160-F241 HydrophobicContact CB-CD2 3.78Å; A160-F241 HydrophobicContact CB-CE1 4.38Å; A160-F241 HydrophobicContact CB-CE2 3.66Å; A160-F241 HydrophobicContact CB-CG 4.2Å; A160-F241 HydrophobicContact CB-CZ 3.99Å; A160-V282 HydrophobicContact CB-CG2 4.28Å
161	A	97.1	Very high	90.9	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	126.9	-175.1	0	0	0	0	0	110.8	V159 V163 W172 I173 A175 V189 L202 R206 I207	V159-A161 HydrophobicContact CG2-CB 4.35Å; A161-V163 PolarHBondContact O-N 2.96Å; A161-W172 CarbonylContact O-C 3.52Å; A161-W172 WeakPolarHBondContact O-CA 3.37Å; A161-I173 HydrophobicContact CB-CG1 4.18Å; A161-I173 PolarHBondContact N-O 2.99Å; A161-I173 WeakPolarHBondContact O-CG1 3.43Å; A161-I173 PolarHBondContact O-N 3.01Å; A161-A175 HydrophobicContact CB-CB 3.86Å; A161-V189 HydrophobicContact CB-CG2 4.14Å; A161-L202 HydrophobicContact CB-CD1 3.78Å; A161-R206 CarbonylContact C-O 3.57Å; A161-R206 WeakPolarHBondContact CA-O 3.48Å; A161-I207 HydrophobicContact CB-CD1 3.82Å
162	R	96.3	Very high	90.9	Very high	59 Å²	59	57.8 Å²	57.8	22%	0.223	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	93.5	178.9	-157.2	174.1	88.5	-172.1	7.1	111.5	E170 Q171 W172 R206 E286	R162-E170 HydrophobicContact CG-CB 4.27Å; R162-E170 IonicContact CZ-OE2 2.62Å; R162-E170 IonicContact NE-OE2 3.56Å; R162-E170 PolarHBondContact NE-OE2 2.84Å; R162-E170 IonicContact NH2-OE1 3.01Å; R162-E170 IonicContact NH2-OE2 3.74Å; R162-E170 PolarHBondContact NH2-OE2 3.36Å; R162-Q171 WeakPolarHBondContact CA-O 3.48Å; R162-W172 HydrophobicContact CB-CD2 3.71Å; R162-W172 HydrophobicContact CB-CE3 3.75Å; R162-W172 HydrophobicContact CB-CG 4.42Å; R162-W172 HydrophobicContact CB-CH2 3.8Å; R162-W172 HydrophobicContact CB-CZ2 3.77Å; R162-W172 HydrophobicContact CB-CZ3 3.79Å; R162-W172 VanDerWaalsContact CD-CE2 3.45Å; R162-W172 HydrophobicContact CG-CD2 3.93Å; R162-W172 HydrophobicContact CG-CE3 4.48Å; R162-W172 HydrophobicContact CG-CG 4.25Å; R162-W172 HydrophobicContact CG-CZ2 4.02Å; R162-R206 HydrophobicContact CB-CB 4.05Å; R162-R206 HydrophobicContact CB-CG 4.24Å; R162-R206 PolarHBondContact N-O 3.41Å; R162-R206 WeakPolarHBondContact O-CD 3.27Å; R162-R206 PolarHBondContact O-NH1 3.41Å; R162-R206 VanDerWaalsContact O-NH1 3.1Å; R162-E286 IonicContact CZ-OE1 3.23Å; R162-E286 IonicContact NH1-OE1 3.03Å; R162-E286 PolarHBondContact NH1-OE1 2.94Å
163	V	93.6	Very high	90.8	Very high	12 Å²	12	55.9 Å²	55.9	7%	0.073	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	160.7	178.9	-62.4	0	0	0	0	111.1	A161 E170 Q171 I173 H200 L202	A161-V163 PolarHBondContact O-N 2.96Å; V163-E170 WeakPolarHBondContact O-CA 3.44Å; V163-Q171 HydrophobicContact CG2-CB 4.48Å; V163-Q171 WeakPolarHBondContact CG2-O 3.32Å; V163-Q171 PolarHBondContact N-O 3.44Å; V163-Q171 PolarHBondContact O-N 3.46Å; V163-I173 HydrophobicContact CG1-CD1 3.67Å; V163-I173 HydrophobicContact CG1-CG1 3.95Å; V163-I173 HydrophobicContact CG2-CD1 4.04Å; V163-I173 HydrophobicContact CG2-CG1 4.04Å; V163-I173 HydrophobicContact CG2-CG2 3.89Å; V163-H200 HydrophobicContact CG1-CB 4.23Å; V163-L202 HydrophobicContact CG1-CD1 4Å
164	K	89.7	Confident	90.8	Very high	137 Å²	137	55.8 Å²	55.8	60%	0.596	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.9	123.8	170.3	-73.6	-174.2	171.4	-164.4	0	107.9	D169 E170	K164-D169 CarbonylContact C-O 3.5Å; K164-E170 WeakPolarHBondContact CE-OE1 3.38Å; K164-E170 HydrophobicContact CG-CG 4.15Å
165	A	76.6	Confident	90.9	Very high	45 Å²	45	48.6 Å²	48.6	37%	0.372	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-74	166.3	170.9	0	0	0	0	0	110.9	D167 G168 D169	A165-D167 VanDerWaalsContact C-N 3.27Å; A165-D167 WeakPolarHBondContact CB-OD1 3.46Å; A165-D167 PolarHBondContact O-N 3.39Å; A165-G168 PolarHBondContact O-N 3.24Å; A165-D169 WeakPolarHBondContact CB-O 3.23Å; A165-D169 PolarHBondContact N-O 3.04Å
166	V	71.2	Confident	90.9	Very high	160 Å²	160	45.2 Å²	45.2	97%	0.97	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-30.9	-174.5	-178	0	0	0	0	112.2	G168	V166-G168 PolarHBondContact O-N 3.24Å
167	D	75.4	Confident	91.1	Very high	122 Å²	122	45 Å²	45	65%	0.652	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76	-6.8	174.5	53.2	12.6	0	0	0	113.6	A165 D169	A165-D167 VanDerWaalsContact C-N 3.27Å; A165-D167 WeakPolarHBondContact CB-OD1 3.46Å; A165-D167 PolarHBondContact O-N 3.39Å; D167-D169 PolarHBondContact OD1-N 3.09Å; D167-D169 VanDerWaalsContact OD1-N 3.15Å
168	G	76.4	Confident	91	Very high	49 Å²	49	44.4 Å²	44.4	51%	0.505	24%	0.243	S	C	.	.	S	Bend	trans	96.2	-5.4	178.3	0	0	0	0	0	114.5	A165 V166	A165-G168 PolarHBondContact O-N 3.24Å; V166-G168 PolarHBondContact O-N 3.24Å
169	D	85.6	Confident	91	Very high	115 Å²	115	45 Å²	45	62%	0.615	25%	0.252	S	S	*	.			trans	-73.2	150.6	176.5	-75.9	-20.1	0	0	0	111.2	K164 A165 D167	K164-D169 CarbonylContact C-O 3.5Å; A165-D169 WeakPolarHBondContact CB-O 3.23Å; A165-D169 PolarHBondContact N-O 3.04Å; D167-D169 PolarHBondContact OD1-N 3.09Å; D167-D169 VanDerWaalsContact OD1-N 3.15Å
170	E	89.5	Confident	91	Very high	76 Å²	76	47.1 Å²	47.1	36%	0.355	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	126.6	179.3	-60.4	-160.4	140.1	0	0	110.2	R162 V163 K164 R206	R162-E170 HydrophobicContact CG-CB 4.27Å; R162-E170 IonicContact CZ-OE2 2.62Å; R162-E170 IonicContact NE-OE2 3.56Å; R162-E170 PolarHBondContact NE-OE2 2.84Å; R162-E170 IonicContact NH2-OE1 3.01Å; R162-E170 IonicContact NH2-OE2 3.74Å; R162-E170 PolarHBondContact NH2-OE2 3.36Å; V163-E170 WeakPolarHBondContact O-CA 3.44Å; K164-E170 WeakPolarHBondContact CE-OE1 3.38Å; K164-E170 HydrophobicContact CG-CG 4.15Å; E170-R206 IonicContact OE1-CZ 3.99Å; E170-R206 VanDerWaalsContact OE1-CZ 3.23Å; E170-R206 IonicContact OE1-NH1 3.55Å; E170-R206 PolarHBondContact OE1-NH1 3.02Å; E170-R206 IonicContact OE1-NH2 2.66Å; E170-R206 PolarHBondContact OE1-NH2 3.02Å; E170-R206 IonicContact OE2-NH1 3.25Å; E170-R206 IonicContact OE2-NH2 3.29Å
171	Q	92.9	Very high	90.9	Very high	54 Å²	54	49.2 Å²	49.2	25%	0.252	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	137.4	-180	-176.7	55.5	55.7	0	0	110	R162 V163 I173 C240 F241	R162-Q171 WeakPolarHBondContact CA-O 3.48Å; V163-Q171 HydrophobicContact CG2-CB 4.48Å; V163-Q171 WeakPolarHBondContact CG2-O 3.32Å; V163-Q171 PolarHBondContact N-O 3.44Å; V163-Q171 PolarHBondContact O-N 3.46Å; Q171-I173 HydrophobicContact CG-CG2 3.99Å; Q171-C240 HydrophobicContact CG-CB 4.5Å; Q171-F241 PolarHBondContact NE2-O 3.42Å
172	W	96.5	Very high	90.9	Very high	18 Å²	18	56.3 Å²	56.3	7%	0.068	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	120.7	167.5	-71.4	94.2	0	0	0	109	A160 A161 R162 R206 I208 L232 C240 F241	A160-W172 HydrophobicContact CB-CE3 4.02Å; A160-W172 WeakPolarHBondContact O-CZ3 3.38Å; A161-W172 CarbonylContact O-C 3.52Å; A161-W172 WeakPolarHBondContact O-CA 3.37Å; R162-W172 HydrophobicContact CB-CD2 3.71Å; R162-W172 HydrophobicContact CB-CE3 3.75Å; R162-W172 HydrophobicContact CB-CG 4.42Å; R162-W172 HydrophobicContact CB-CH2 3.8Å; R162-W172 HydrophobicContact CB-CZ2 3.77Å; R162-W172 HydrophobicContact CB-CZ3 3.79Å; R162-W172 VanDerWaalsContact CD-CE2 3.45Å; R162-W172 HydrophobicContact CG-CD2 3.93Å; R162-W172 HydrophobicContact CG-CE3 4.48Å; R162-W172 HydrophobicContact CG-CG 4.25Å; R162-W172 HydrophobicContact CG-CZ2 4.02Å; W172-R206 WeakPolarHBondContact CZ3-O 3.45Å; W172-I208 HydrophobicContact CE3-CD1 4.38Å; W172-I208 HydrophobicContact CH2-CD1 3.5Å; W172-I208 HydrophobicContact CH2-CG1 3.78Å; W172-I208 HydrophobicContact CZ2-CD1 4.08Å; W172-I208 HydrophobicContact CZ3-CB 4.47Å; W172-I208 HydrophobicContact CZ3-CD1 3.68Å; W172-I208 HydrophobicContact CZ3-CG1 3.76Å; W172-L232 HydrophobicContact CD2-CD1 3.78Å; W172-L232 HydrophobicContact CE3-CD1 4.41Å; W172-L232 HydrophobicContact CG-CD1 3.91Å; W172-L232 HydrophobicContact CG-CD2 4.5Å; W172-L232 HydrophobicContact CZ2-CD1 4.22Å; W172-C240 CarbonylContact O-C 3.15Å; W172-C240 WeakPolarHBondContact O-CA 3.24Å; W172-F241 HydrophobicContact CB-CB 3.78Å; W172-F241 PolarHBondContact O-N 3.29Å
173	I	96	Very high	90.9	Very high	7 Å²	7	59.2 Å²	59.2	4%	0.036	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	158.4	179.5	62.8	164.8	0	0	0	111	A160 A161 V163 Q171 D191 T239	A160-I173 CarbonylContact C-O 3.58Å; A160-I173 WeakPolarHBondContact CA-O 3.4Å; A161-I173 HydrophobicContact CB-CG1 4.18Å; A161-I173 PolarHBondContact N-O 2.99Å; A161-I173 WeakPolarHBondContact O-CG1 3.43Å; A161-I173 PolarHBondContact O-N 3.01Å; V163-I173 HydrophobicContact CG1-CD1 3.67Å; V163-I173 HydrophobicContact CG1-CG1 3.95Å; V163-I173 HydrophobicContact CG2-CD1 4.04Å; V163-I173 HydrophobicContact CG2-CG1 4.04Å; V163-I173 HydrophobicContact CG2-CG2 3.89Å; Q171-I173 HydrophobicContact CG-CG2 3.99Å; I173-D191 HydrophobicContact CD1-CB 3.96Å; I173-D191 WeakPolarHBondContact CD1-OD2 3.33Å; I173-T239 CarbonylContact C-O 3.5Å; I173-T239 WeakPolarHBondContact CA-O 3.22Å
174	L	97.1	Very high	91	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.005	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	117.7	168.4	-179.6	58.6	0	0	0	109.3	L120 K158 I192 L210 L234 T239 F241 Y280	L120-L174 HydrophobicContact CD1-CD2 4.21Å; L120-L174 HydrophobicContact CD2-CD2 3.48Å; L120-L174 VanDerWaalsContact CD2-CD2 3.48Å; K158-L174 HydrophobicContact CB-CD1 4.24Å; L174-I192 HydrophobicContact CB-CG2 3.97Å; L174-I192 HydrophobicContact CD2-CD1 4.12Å; L174-I192 HydrophobicContact CD2-CG2 4.02Å; L174-I192 HydrophobicContact CG-CB 4.41Å; L174-I192 HydrophobicContact CG-CD1 4.22Å; L174-I192 HydrophobicContact CG-CG2 3.88Å; L174-I192 WeakPolarHBondContact O-CB 3.19Å; L174-I192 VanDerWaalsContact O-CG2 3.3Å; L174-I192 WeakPolarHBondContact O-CG2 3.36Å; L174-I192 PolarHBondContact O-N 3.04Å; L174-I192 VanDerWaalsContact O-N 3.16Å; L174-L210 HydrophobicContact CD1-CD1 4.07Å; L174-L210 HydrophobicContact CD1-CD2 3.84Å; L174-L234 HydrophobicContact CB-CD1 4.12Å; L174-L234 HydrophobicContact CD2-CD2 4.38Å; L174-T239 PolarHBondContact N-O 2.97Å; L174-F241 HydrophobicContact CB-CE2 3.81Å; L174-F241 HydrophobicContact CB-CZ 4.45Å; L174-F241 HydrophobicContact CD1-CE2 4.16Å; L174-F241 HydrophobicContact CD1-CZ 4.13Å; L174-Y280 HydrophobicContact CD2-CE1 4.03Å
175	A	96.3	Very high	91.3	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	160.6	-176.9	0	0	0	0	0	111.8	K158 V159 A161 V189 D190	K158-A175 WeakPolarHBondContact CA-O 3.28Å; V159-A175 HydrophobicContact CG2-CB 4.05Å; V159-A175 PolarHBondContact N-O 2.98Å; V159-A175 PolarHBondContact O-N 3.45Å; A161-A175 HydrophobicContact CB-CB 3.86Å; A175-V189 HydrophobicContact CB-CB 3.92Å; A175-V189 HydrophobicContact CB-CG2 3.94Å; A175-D190 CarbonylContact C-O 3.52Å; A175-D190 VanDerWaalsContact CA-O 3.22Å; A175-D190 WeakPolarHBondContact CA-O 3.47Å; A175-D190 VanDerWaalsContact CB-O 3.31Å; A175-D190 WeakPolarHBondContact CB-O 3.33Å
176	E	95.6	Very high	92.4	Very high	17 Å²	17	61 Å²	61	8%	0.079	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	129.9	173.3	179.7	172.7	117.2	0	0	109.9	R92 K96 K158 V178 V189 D190	R92-E176 IonicContact CZ-OE1 3.02Å; R92-E176 IonicContact CZ-OE2 3.67Å; R92-E176 IonicContact NH1-OE1 2.8Å; R92-E176 PolarHBondContact NH1-OE1 3.39Å; R92-E176 IonicContact NH1-OE2 3.46Å; R92-E176 PolarHBondContact NH1-OE2 3.09Å; R92-E176 IonicContact NH2-OE1 3.91Å; R92-E176 PolarHBondContact NH2-OE1 3.42Å; R92-E176 IonicContact NH2-OE2 2.88Å; R92-E176 PolarHBondContact NH2-OE2 2.75Å; K96-E176 IonicContact NZ-OE1 3.64Å; K158-E176 HydrophobicContact CD-CB 4.22Å; K158-E176 WeakPolarHBondContact CE-OE2 3.16Å; K158-E176 IonicContact NZ-OE2 2.83Å; K158-E176 PolarHBondContact NZ-OE2 3.43Å; E176-V178 PolarHBondContact O-N 2.87Å; E176-V189 CarbonylContact O-C 3.54Å; E176-V189 VanDerWaalsContact O-CA 3.24Å; E176-V189 WeakPolarHBondContact O-CA 3.38Å; E176-D190 PolarHBondContact N-O 2.87Å; E176-D190 PolarHBondContact O-N 2.62Å
177	V	96.8	Very high	93.7	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.006	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	130.1	177	175.4	0	0	0	0	110.3	A153 K154 Q155 G156 D157 V159 Y187 V189	A153-V177 HydrophobicContact CB-CG2 3.98Å; K154-V177 WeakPolarHBondContact O-CB 3.45Å; K154-V177 WeakPolarHBondContact O-CG1 3.45Å; Q155-V177 WeakPolarHBondContact CA-O 3.36Å; G156-V177 PolarHBondContact N-O 3.36Å; D157-V177 HydrophobicContact CB-CG2 4.45Å; D157-V177 PolarHBondContact O-N 2.95Å; V159-V177 HydrophobicContact CB-CG2 4.5Å; V159-V177 HydrophobicContact CG1-CG2 3.51Å; V159-V177 HydrophobicContact CG2-CG2 4.12Å; V177-Y187 HydrophobicContact CG1-CD1 3.96Å; V177-Y187 HydrophobicContact CG1-CE1 4.28Å; V177-Y187 HydrophobicContact CG2-CD1 4.39Å; V177-V189 HydrophobicContact CG2-CG1 4.31Å
178	V	95	Very high	94.7	Very high	25 Å²	25	51 Å²	51	15%	0.152	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-47.7	174.4	-175.2	0	0	0	0	111.2	Q155 E176 E188 D190	Q155-V178 VanDerWaalsContact CG-O 3.27Å; Q155-V178 WeakPolarHBondContact CG-O 3.35Å; Q155-V178 PolarHBondContact NE2-O 3.15Å; E176-V178 PolarHBondContact O-N 2.87Å; V178-E188 HydrophobicContact CB-CB 4.3Å; V178-E188 PolarHBondContact N-O 3.38Å; V178-D190 HydrophobicContact CG2-CB 4.27Å; V178-D190 VanDerWaalsContact CG2-CG 3.5Å; V178-D190 WeakPolarHBondContact CG2-OD2 3.47Å
179	S	96.4	Very high	95.7	Very high	48 Å²	48	48.7 Å²	48.7	34%	0.336	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	165.4	178.6	76.8	0	0	0	0	111.5	Y187 E188	S179-Y187 WeakPolarHBondContact O-CA 3.5Å; S179-E188 PolarHBondContact N-O 3.03Å; S179-E188 PolarHBondContact O-N 2.63Å; S179-E188 WeakPolarHBondContact OG-CB 3.38Å; S179-E188 PolarHBondContact OG-OE2 3.02Å
180	Y	98.1	Very high	96	Very high	44 Å²	44	43.9 Å²	43.9	17%	0.173	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	125.6	171.8	177.5	-105.4	0	0	0	110.2	V152 H182 N185 K186 Y187	V152-Y180 HydrophobicContact CB-CD1 4.42Å; V152-Y180 HydrophobicContact CG1-CD1 3.37Å; V152-Y180 HydrophobicContact CG1-CD2 4.39Å; V152-Y180 HydrophobicContact CG1-CE1 3.9Å; V152-Y180 HydrophobicContact CG1-CG 3.63Å; V152-Y180 HydrophobicContact CG2-CD1 4.1Å; V152-Y180 HydrophobicContact CG2-CE1 3.74Å; Y180-H182 AromaticContact CD1-CE1 3.65Å; Y180-H182 AromaticContact CD1-ND1 3.75Å; Y180-H182 AromaticContact CD1-NE2 3.91Å; Y180-H182 HydrophobicContact CE1-CB 4.47Å; Y180-H182 AromaticContact CE1-CD2 3.66Å; Y180-H182 AromaticContact CE1-CE1 3.89Å; Y180-H182 AromaticContact CE1-CG 3.8Å; Y180-H182 AromaticContact CE1-ND1 3.94Å; Y180-H182 AromaticContact CE1-NE2 3.7Å; Y180-N185 PolarHBondContact OH-OD1 3.33Å; Y180-K186 VanDerWaalsContact CD2-O 3.32Å; Y180-K186 WeakPolarHBondContact CD2-O 3.31Å; Y180-Y187 AromaticContact CD2-CD1 3.67Å; Y180-Y187 HydrophobicContact CD2-CD1 3.67Å; Y180-Y187 AromaticContact CD2-CD2 3.62Å; Y180-Y187 HydrophobicContact CD2-CD2 3.62Å; Y180-Y187 AromaticContact CD2-CE1 3.5Å; Y180-Y187 HydrophobicContact CD2-CE1 3.5Å; Y180-Y187 AromaticContact CD2-CE2 3.46Å; Y180-Y187 HydrophobicContact CD2-CE2 3.46Å; Y180-Y187 VanDerWaalsContact CD2-CE2 3.46Å; Y180-Y187 AromaticContact CD2-CG 3.72Å; Y180-Y187 HydrophobicContact CD2-CG 3.72Å; Y180-Y187 AromaticContact CD2-CZ 3.39Å; Y180-Y187 AromaticContact CE2-CD2 3.94Å; Y180-Y187 HydrophobicContact CE2-CD2 3.94Å; Y180-Y187 HydrophobicContact CE2-CE1 4.39Å; Y180-Y187 AromaticContact CE2-CE2 3.58Å; Y180-Y187 HydrophobicContact CE2-CE2 3.58Å; Y180-Y187 HydrophobicContact CE2-CG 4.48Å; Y180-Y187 AromaticContact CE2-CZ 3.83Å; Y180-Y187 HydrophobicContact CG-CD1 4.16Å; Y180-Y187 AromaticContact CG-CE1 3.82Å; Y180-Y187 HydrophobicContact CG-CE1 3.82Å; Y180-Y187 HydrophobicContact CG-CE2 4.48Å; Y180-Y187 AromaticContact CG-CZ 3.99Å
181	S	97.7	Very high	96.2	Very high	44 Å²	44	41.7 Å²	41.7	31%	0.308	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	113.1	175	174.3	0	0	0	0	110.2	S183 A184 N185 K186	S181-S183 VanDerWaalsContact C-N 3.33Å; S181-S183 PolarHBondContact OG-OG 2.79Å; S181-S183 VanDerWaalsContact OG-OG 3.09Å; S181-A184 PolarHBondContact O-N 2.78Å; S181-A184 PolarHBondContact OG-N 3.37Å; S181-N185 VanDerWaalsContact O-CA 3.32Å; S181-N185 WeakPolarHBondContact O-CA 3.12Å; S181-N185 PolarHBondContact O-N 2.91Å; S181-K186 PolarHBondContact N-O 2.77Å; S181-K186 PolarHBondContact O-N 2.87Å
182	H	96.3	Very high	96.1	Very high	148 Å²	148	40.5 Å²	40.5	69%	0.685	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-34.7	176	-71.4	82.7	0	0	0	112.3	Y180	Y180-H182 AromaticContact CD1-CE1 3.65Å; Y180-H182 AromaticContact CD1-ND1 3.75Å; Y180-H182 AromaticContact CD1-NE2 3.91Å; Y180-H182 HydrophobicContact CE1-CB 4.47Å; Y180-H182 AromaticContact CE1-CD2 3.66Å; Y180-H182 AromaticContact CE1-CE1 3.89Å; Y180-H182 AromaticContact CE1-CG 3.8Å; Y180-H182 AromaticContact CE1-ND1 3.94Å; Y180-H182 AromaticContact CE1-NE2 3.7Å
183	S	96.9	Very high	95.5	Very high	120 Å²	120	42.1 Å²	42.1	84%	0.839	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-37.4	179.1	55.8	0	0	0	0	112.3	S181	S181-S183 VanDerWaalsContact C-N 3.33Å; S181-S183 PolarHBondContact OG-OG 2.79Å; S181-S183 VanDerWaalsContact OG-OG 3.09Å
184	A	95.8	Very high	94.1	Very high	53 Å²	53	44.1 Å²	44.1	44%	0.438	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-15.2	178.7	0	0	0	0	0	113.6	S181 K186	S181-A184 PolarHBondContact O-N 2.78Å; S181-A184 PolarHBondContact OG-N 3.37Å; A184-K186 VanDerWaalsContact C-N 3.26Å; A184-K186 HydrophobicContact CB-CB 4.3Å; A184-K186 HydrophobicContact CB-CG 4.2Å; A184-K186 WeakPolarHBondContact O-CG 3.31Å; A184-K186 PolarHBondContact O-N 3.22Å
185	N	96.3	Very high	92.3	Very high	81 Å²	81	51.5 Å²	51.5	43%	0.433	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	44.1	-169.5	-170	17.8	0	0	0	112.2	Y180 S181 R204	Y180-N185 PolarHBondContact OH-OD1 3.33Å; S181-N185 VanDerWaalsContact O-CA 3.32Å; S181-N185 WeakPolarHBondContact O-CA 3.12Å; S181-N185 PolarHBondContact O-N 2.91Å; N185-R204 PolarHBondContact O-N 3.03Å; N185-R204 WeakPolarHBondContact OD1-CB 3.32Å
186	K	98.1	Very high	90.3	Very high	98 Å²	98	53.4 Å²	53.4	43%	0.426	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	143.3	-177.8	-63.8	-170.6	-171.8	179.9	0	111.5	Y180 S181 A184 T201 L202	Y180-K186 VanDerWaalsContact CD2-O 3.32Å; Y180-K186 WeakPolarHBondContact CD2-O 3.31Å; S181-K186 PolarHBondContact N-O 2.77Å; S181-K186 PolarHBondContact O-N 2.87Å; A184-K186 VanDerWaalsContact C-N 3.26Å; A184-K186 HydrophobicContact CB-CB 4.3Å; A184-K186 HydrophobicContact CB-CG 4.2Å; A184-K186 WeakPolarHBondContact O-CG 3.31Å; A184-K186 PolarHBondContact O-N 3.22Å; K186-T201 HydrophobicContact CB-CG2 4.11Å; K186-T201 HydrophobicContact CD-CG2 3.83Å; K186-L202 CarbonylContact C-O 3.52Å; K186-L202 VanDerWaalsContact CA-O 3.25Å; K186-L202 WeakPolarHBondContact CA-O 3.35Å
187	Y	98.4	Very high	88.8	Confident	5 Å²	5	57 Å²	57	2%	0.02	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	148.5	167.4	-73.8	-85	0	0	0	110.6	V152 A153 V177 S179 Y180 T201 L202 R204 I207	V152-Y187 VanDerWaalsContact CA-OH 3.24Å; V152-Y187 WeakPolarHBondContact CA-OH 3.45Å; V152-Y187 HydrophobicContact CG1-CE1 4.26Å; V152-Y187 WeakPolarHBondContact CG1-OH 3.4Å; A153-Y187 HydrophobicContact CB-CE1 4.17Å; A153-Y187 PolarHBondContact N-OH 3.16Å; A153-Y187 VanDerWaalsContact N-OH 3.11Å; V177-Y187 HydrophobicContact CG1-CD1 3.96Å; V177-Y187 HydrophobicContact CG1-CE1 4.28Å; V177-Y187 HydrophobicContact CG2-CD1 4.39Å; S179-Y187 WeakPolarHBondContact O-CA 3.5Å; Y180-Y187 AromaticContact CD2-CD1 3.67Å; Y180-Y187 HydrophobicContact CD2-CD1 3.67Å; Y180-Y187 AromaticContact CD2-CD2 3.62Å; Y180-Y187 HydrophobicContact CD2-CD2 3.62Å; Y180-Y187 AromaticContact CD2-CE1 3.5Å; Y180-Y187 HydrophobicContact CD2-CE1 3.5Å; Y180-Y187 AromaticContact CD2-CE2 3.46Å; Y180-Y187 HydrophobicContact CD2-CE2 3.46Å; Y180-Y187 VanDerWaalsContact CD2-CE2 3.46Å; Y180-Y187 AromaticContact CD2-CG 3.72Å; Y180-Y187 HydrophobicContact CD2-CG 3.72Å; Y180-Y187 AromaticContact CD2-CZ 3.39Å; Y180-Y187 AromaticContact CE2-CD2 3.94Å; Y180-Y187 HydrophobicContact CE2-CD2 3.94Å; Y180-Y187 HydrophobicContact CE2-CE1 4.39Å; Y180-Y187 AromaticContact CE2-CE2 3.58Å; Y180-Y187 HydrophobicContact CE2-CE2 3.58Å; Y180-Y187 HydrophobicContact CE2-CG 4.48Å; Y180-Y187 AromaticContact CE2-CZ 3.83Å; Y180-Y187 HydrophobicContact CG-CD1 4.16Å; Y180-Y187 AromaticContact CG-CE1 3.82Å; Y180-Y187 HydrophobicContact CG-CE1 3.82Å; Y180-Y187 HydrophobicContact CG-CE2 4.48Å; Y180-Y187 AromaticContact CG-CZ 3.99Å; Y187-T201 CarbonylContact O-C 3.49Å; Y187-T201 VanDerWaalsContact O-CA 3.31Å; Y187-T201 WeakPolarHBondContact O-CA 3.25Å; Y187-L202 PolarHBondContact N-O 2.9Å; Y187-L202 PolarHBondContact O-N 2.69Å; Y187-R204 HydrophobicContact CE2-CB 4.16Å; Y187-R204 HydrophobicContact CE2-CG 4.06Å; Y187-I207 HydrophobicContact CD2-CB 4.11Å; Y187-I207 HydrophobicContact CD2-CG1 3.59Å; Y187-I207 HydrophobicContact CD2-CG2 4.33Å; Y187-I207 HydrophobicContact CE2-CB 4.32Å; Y187-I207 HydrophobicContact CE2-CG1 4.29Å; Y187-I207 HydrophobicContact CE2-CG2 4.33Å; Y187-I207 HydrophobicContact CG-CG1 4Å
188	E	97.4	Very high	88	Confident	68 Å²	68	62.6 Å²	62.6	32%	0.318	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	126.8	156.5	-78.9	-174.6	-176.5	0	0	108.3	V178 S179 R199 H200	V178-E188 HydrophobicContact CB-CB 4.3Å; V178-E188 PolarHBondContact N-O 3.38Å; S179-E188 PolarHBondContact N-O 3.03Å; S179-E188 PolarHBondContact O-N 2.63Å; S179-E188 WeakPolarHBondContact OG-CB 3.38Å; S179-E188 PolarHBondContact OG-OE2 3.02Å; E188-R199 IonicContact OE2-CZ 2.96Å; E188-R199 IonicContact OE2-NH1 3.39Å; E188-R199 PolarHBondContact OE2-NH1 2.9Å; E188-H200 WeakPolarHBondContact CA-O 3.41Å
189	V	96.4	Very high	87.8	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	144	180	-55.3	0	0	0	0	110.2	V159 A161 A175 E176 V177 R199 H200 L202 I207	V159-V189 HydrophobicContact CG2-CG1 4.14Å; A161-V189 HydrophobicContact CB-CG2 4.14Å; A175-V189 HydrophobicContact CB-CB 3.92Å; A175-V189 HydrophobicContact CB-CG2 3.94Å; E176-V189 CarbonylContact O-C 3.54Å; E176-V189 VanDerWaalsContact O-CA 3.24Å; E176-V189 WeakPolarHBondContact O-CA 3.38Å; V177-V189 HydrophobicContact CG2-CG1 4.31Å; V189-R199 WeakPolarHBondContact O-CA 3.45Å; V189-H200 HydrophobicContact CG2-CB 4.08Å; V189-H200 PolarHBondContact N-O 2.9Å; V189-H200 PolarHBondContact O-N 2.88Å; V189-L202 HydrophobicContact CG2-CD1 3.92Å; V189-I207 HydrophobicContact CG1-CD1 3.97Å
190	D	93.3	Very high	87.7	Confident	13 Å²	13	65.1 Å²	65.1	7%	0.07	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	134.2	170.2	-67.7	-19	0	0	0	108.7	K96 A175 E176 V178 R199	K96-D190 IonicContact NZ-OD2 3.47Å; K96-D190 PolarHBondContact NZ-OD2 3.2Å; A175-D190 CarbonylContact C-O 3.52Å; A175-D190 VanDerWaalsContact CA-O 3.22Å; A175-D190 WeakPolarHBondContact CA-O 3.47Å; A175-D190 VanDerWaalsContact CB-O 3.31Å; A175-D190 WeakPolarHBondContact CB-O 3.33Å; E176-D190 PolarHBondContact N-O 2.87Å; E176-D190 PolarHBondContact O-N 2.62Å; V178-D190 HydrophobicContact CG2-CB 4.27Å; V178-D190 VanDerWaalsContact CG2-CG 3.5Å; V178-D190 WeakPolarHBondContact CG2-OD2 3.47Å; D190-R199 IonicContact OD1-CZ 3.5Å; D190-R199 VanDerWaalsContact OD1-CZ 3.25Å; D190-R199 IonicContact OD1-NE 2.73Å; D190-R199 PolarHBondContact OD1-NE 2.81Å; D190-R199 IonicContact OD1-NH2 2.96Å; D190-R199 PolarHBondContact OD1-NH2 3.3Å; D190-R199 IonicContact OD2-NH2 3.55Å
191	D	92.6	Very high	87.7	Confident	30 Å²	30	66.9 Å²	66.9	16%	0.16	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56	140.4	163.4	-164.1	-28.2	0	0	0	109.7	I173 D193 E198	I173-D191 HydrophobicContact CD1-CB 3.96Å; I173-D191 WeakPolarHBondContact CD1-OD2 3.33Å; D191-D193 VanDerWaalsContact C-N 3.32Å; D191-D193 PolarHBondContact OD1-N 3.48Å; D191-E198 PolarHBondContact N-O 2.97Å
192	I	90.4	Very high	87.7	Confident	29 Å²	29	65.6 Å²	65.6	15%	0.149	34%	0.344	C	S	.	.	S	Bend	trans	-77.8	-19.3	177.4	-153.4	159.1	0	0	0	112.7	L116 L120 K158 L174 E194 T239	L116-I192 HydrophobicContact CD1-CG1 4.17Å; L120-I192 HydrophobicContact CD2-CD1 3.9Å; K158-I192 HydrophobicContact CD-CD1 3.95Å; L174-I192 HydrophobicContact CB-CG2 3.97Å; L174-I192 HydrophobicContact CD2-CD1 4.12Å; L174-I192 HydrophobicContact CD2-CG2 4.02Å; L174-I192 HydrophobicContact CG-CB 4.41Å; L174-I192 HydrophobicContact CG-CD1 4.22Å; L174-I192 HydrophobicContact CG-CG2 3.88Å; L174-I192 WeakPolarHBondContact O-CB 3.19Å; L174-I192 VanDerWaalsContact O-CG2 3.3Å; L174-I192 WeakPolarHBondContact O-CG2 3.36Å; L174-I192 PolarHBondContact O-N 3.04Å; L174-I192 VanDerWaalsContact O-N 3.16Å; I192-E194 PolarHBondContact O-N 3.39Å; I192-T239 HydrophobicContact CG2-CG2 3.51Å
193	D	85.3	Confident	87.7	Confident	53 Å²	53	59.9 Å²	59.9	28%	0.283	32%	0.321	S	S	.	.			trans	-74.3	115.2	173.1	-159.3	-10.7	0	0	0	110.2	D191 E195 G196 T239	D191-D193 VanDerWaalsContact C-N 3.32Å; D191-D193 PolarHBondContact OD1-N 3.48Å; D193-E195 VanDerWaalsContact C-N 3.29Å; D193-E195 PolarHBondContact O-N 3.39Å; D193-G196 CarbonylContact O-C 3.55Å; D193-G196 PolarHBondContact O-N 2.85Å; D193-T239 HydrophobicContact CB-CG2 4.25Å
194	E	65.5	Low	87.6	Confident	48 Å²	48	57.6 Å²	57.6	22%	0.224	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-74.7	-16.8	-170.1	-66	-151.6	143	0	0	114	T110 M111 I192 G196 K197	T110-E194 HydrophobicContact CG2-CB 4.19Å; M111-E194 WeakPolarHBondContact CA-OE2 3.25Å; M111-E194 HydrophobicContact CB-CB 4.34Å; M111-E194 HydrophobicContact CB-CG 3.96Å; M111-E194 WeakPolarHBondContact CB-OE2 3.15Å; M111-E194 PolarHBondContact N-OE2 2.92Å; I192-E194 PolarHBondContact O-N 3.39Å; E194-G196 PolarHBondContact O-N 2.75Å; E194-K197 WeakPolarHBondContact OE1-CE 3.39Å; E194-K197 IonicContact OE1-NZ 2.83Å; E194-K197 PolarHBondContact OE1-NZ 2.82Å; E194-K197 IonicContact OE2-NZ 3.98Å
195	E	59.6	Low	87.5	Confident	156 Å²	156	64.7 Å²	64.7	73%	0.729	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-66.8	-17.2	176.2	-78.2	-179.1	-169.1	0	0	112.4	T110 D193	T110-E195 HydrophobicContact CG2-CB 4.26Å; T110-E195 HydrophobicContact CG2-CG 3.37Å; D193-E195 VanDerWaalsContact C-N 3.29Å; D193-E195 PolarHBondContact O-N 3.39Å
196	G	53.8	Low	87.5	Confident	40 Å²	40	62.4 Å²	62.4	41%	0.412	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-146.4	69.6	174.9	0	0	0	0	0	111.4	D193 E194 E198	D193-G196 CarbonylContact O-C 3.55Å; D193-G196 PolarHBondContact O-N 2.85Å; E194-G196 PolarHBondContact O-N 2.75Å; G196-E198 PolarHBondContact O-N 2.83Å
197	K	63.9	Low	87.5	Confident	94 Å²	94	58 Å²	58	41%	0.409	28%	0.276	S	S	.	.			trans	-61.9	72.1	169.3	-75.1	-177	176.7	159.8	0	110.5	E194	E194-K197 WeakPolarHBondContact OE1-CE 3.39Å; E194-K197 IonicContact OE1-NZ 2.83Å; E194-K197 PolarHBondContact OE1-NZ 2.82Å; E194-K197 IonicContact OE2-NZ 3.98Å
198	E	81.2	Confident	87.5	Confident	118 Å²	118	58.3 Å²	58.3	55%	0.551	28%	0.277	S	S	*	.			trans	-89.3	115.4	176	-165.7	180	158.4	0	0	106.8	D191 G196 H200	D191-E198 PolarHBondContact N-O 2.97Å; G196-E198 PolarHBondContact O-N 2.83Å; E198-H200 PolarHBondContact O-CD2 3.45Å; E198-H200 VanDerWaalsContact O-CD2 3.28Å; E198-H200 PolarHBondContact O-N 3.28Å; E198-H200 IonicContact OE1-CE1 2.96Å; E198-H200 PolarHBondContact OE1-CE1 2.95Å; E198-H200 VanDerWaalsContact OE1-CE1 3.25Å; E198-H200 IonicContact OE1-ND1 3.71Å; E198-H200 IonicContact OE2-CE1 3.68Å
199	R	91.3	Very high	87.5	Confident	104 Å²	104	56.1 Å²	56.1	39%	0.392	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	117.7	171.3	169.1	60.2	59.8	71.6	25	107.6	E188 V189 D190	E188-R199 IonicContact OE2-CZ 2.96Å; E188-R199 IonicContact OE2-NH1 3.39Å; E188-R199 PolarHBondContact OE2-NH1 2.9Å; V189-R199 WeakPolarHBondContact O-CA 3.45Å; D190-R199 IonicContact OD1-CZ 3.5Å; D190-R199 VanDerWaalsContact OD1-CZ 3.25Å; D190-R199 IonicContact OD1-NE 2.73Å; D190-R199 PolarHBondContact OD1-NE 2.81Å; D190-R199 IonicContact OD1-NH2 2.96Å; D190-R199 PolarHBondContact OD1-NH2 3.3Å; D190-R199 IonicContact OD2-NH2 3.55Å
200	H	94.3	Very high	87.6	Confident	22 Å²	22	56.4 Å²	56.4	10%	0.102	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	136.1	174.5	-56.3	-78.9	0	0	0	111.4	V163 E188 V189 E198 L202	V163-H200 HydrophobicContact CG1-CB 4.23Å; E188-H200 WeakPolarHBondContact CA-O 3.41Å; V189-H200 HydrophobicContact CG2-CB 4.08Å; V189-H200 PolarHBondContact N-O 2.9Å; V189-H200 PolarHBondContact O-N 2.88Å; E198-H200 PolarHBondContact O-CD2 3.45Å; E198-H200 VanDerWaalsContact O-CD2 3.28Å; E198-H200 PolarHBondContact O-N 3.28Å; E198-H200 IonicContact OE1-CE1 2.96Å; E198-H200 PolarHBondContact OE1-CE1 2.95Å; E198-H200 VanDerWaalsContact OE1-CE1 3.25Å; E198-H200 IonicContact OE1-ND1 3.71Å; E198-H200 IonicContact OE2-CE1 3.68Å; H200-L202 HydrophobicContact CB-CD1 4.15Å; H200-L202 HydrophobicContact CB-CD2 4.27Å; H200-L202 HydrophobicContact CB-CG 3.95Å
201	T	97	Very high	87.9	Confident	80 Å²	80	56 Å²	56	49%	0.491	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	103.9	172.4	-53	0	0	0	0	109.9	K186 Y187	K186-T201 HydrophobicContact CB-CG2 4.11Å; K186-T201 HydrophobicContact CD-CG2 3.83Å; Y187-T201 CarbonylContact O-C 3.49Å; Y187-T201 VanDerWaalsContact O-CA 3.31Å; Y187-T201 WeakPolarHBondContact O-CA 3.25Å
202	L	97.1	Very high	88.1	Confident	17 Å²	17	57.6 Å²	57.6	9%	0.089	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	142	-168.5	-59.7	175.8	0	0	0	112	A161 V163 K186 Y187 V189 H200 R206 I207	A161-L202 HydrophobicContact CB-CD1 3.78Å; V163-L202 HydrophobicContact CG1-CD1 4Å; K186-L202 CarbonylContact C-O 3.52Å; K186-L202 VanDerWaalsContact CA-O 3.25Å; K186-L202 WeakPolarHBondContact CA-O 3.35Å; Y187-L202 PolarHBondContact N-O 2.9Å; Y187-L202 PolarHBondContact O-N 2.69Å; V189-L202 HydrophobicContact CG2-CD1 3.92Å; H200-L202 HydrophobicContact CB-CD1 4.15Å; H200-L202 HydrophobicContact CB-CD2 4.27Å; H200-L202 HydrophobicContact CB-CG 3.95Å; L202-R206 HydrophobicContact CB-CB 4.27Å; L202-I207 HydrophobicContact CB-CD1 4.17Å; L202-I207 HydrophobicContact CD1-CD1 3.92Å
203	S	96.6	Very high	88.5	Confident	29 Å²	29	59.7 Å²	59.7	20%	0.203	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	149	171.2	59.1	0	0	0	0	111.4	R205 R206	S203-R205 PolarHBondContact O-N 3.14Å; S203-R205 WeakPolarHBondContact OG-CG 3.41Å; S203-R206 WeakPolarHBondContact O-CB 3.44Å; S203-R206 PolarHBondContact O-N 3.39Å
204	R	95.5	Very high	89.1	Confident	72 Å²	72	58.3 Å²	58.3	27%	0.272	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-47.8	-35.2	177.4	-177.5	165	-174.4	-127.5	-9.2	115.3	S149 Y151 N185 Y187 R206 I207	S149-R204 VanDerWaalsContact C-NH2 3.27Å; S149-R204 PolarHBondContact O-NH1 3.07Å; S149-R204 PolarHBondContact O-NH2 2.82Å; Y151-R204 VanDerWaalsContact N-NH2 3.15Å; Y151-R204 PolarHBondContact O-NE 3.26Å; Y151-R204 PolarHBondContact O-NH2 2.85Å; N185-R204 PolarHBondContact O-N 3.03Å; N185-R204 WeakPolarHBondContact OD1-CB 3.32Å; Y187-R204 HydrophobicContact CE2-CB 4.16Å; Y187-R204 HydrophobicContact CE2-CG 4.06Å; R204-R206 PolarHBondContact O-N 3.03Å; R204-I207 PolarHBondContact O-N 2.65Å; R204-I207 VanDerWaalsContact O-N 3.17Å
205	R	94.3	Very high	90.6	Very high	201 Å²	201	56 Å²	56	76%	0.758	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-65.1	-17.9	176.8	62.7	175.1	177.7	-178.8	0.3	115.3	S203 I207	S203-R205 PolarHBondContact O-N 3.14Å; S203-R205 WeakPolarHBondContact OG-CG 3.41Å; R205-I207 VanDerWaalsContact C-N 3.35Å
206	R	96.2	Very high	92.4	Very high	33 Å²	33	49.4 Å²	49.4	13%	0.125	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-94.5	5.5	178.3	-69.4	178.3	173.5	-94.6	-5.5	112.2	A161 R162 E170 W172 L202 S203 R204	A161-R206 CarbonylContact C-O 3.57Å; A161-R206 WeakPolarHBondContact CA-O 3.48Å; R162-R206 HydrophobicContact CB-CB 4.05Å; R162-R206 HydrophobicContact CB-CG 4.24Å; R162-R206 PolarHBondContact N-O 3.41Å; R162-R206 WeakPolarHBondContact O-CD 3.27Å; R162-R206 PolarHBondContact O-NH1 3.41Å; R162-R206 VanDerWaalsContact O-NH1 3.1Å; E170-R206 IonicContact OE1-CZ 3.99Å; E170-R206 VanDerWaalsContact OE1-CZ 3.23Å; E170-R206 IonicContact OE1-NH1 3.55Å; E170-R206 PolarHBondContact OE1-NH1 3.02Å; E170-R206 IonicContact OE1-NH2 2.66Å; E170-R206 PolarHBondContact OE1-NH2 3.02Å; E170-R206 IonicContact OE2-NH1 3.25Å; E170-R206 IonicContact OE2-NH2 3.29Å; W172-R206 WeakPolarHBondContact CZ3-O 3.45Å; L202-R206 HydrophobicContact CB-CB 4.27Å; S203-R206 WeakPolarHBondContact O-CB 3.44Å; S203-R206 PolarHBondContact O-N 3.39Å; R204-R206 PolarHBondContact O-N 3.03Å
207	I	97.4	Very high	94.5	Very high	7 Å²	7	48.4 Å²	48.4	4%	0.036	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	128.9	-178.2	-59.6	-59	0	0	0	108.5	V159 A161 Y187 V189 L202 R204 R205	V159-I207 HydrophobicContact CB-CG2 3.85Å; V159-I207 HydrophobicContact CG1-CG2 3.74Å; V159-I207 HydrophobicContact CG2-CD1 4.32Å; V159-I207 HydrophobicContact CG2-CG2 4.2Å; A161-I207 HydrophobicContact CB-CD1 3.82Å; Y187-I207 HydrophobicContact CD2-CB 4.11Å; Y187-I207 HydrophobicContact CD2-CG1 3.59Å; Y187-I207 HydrophobicContact CD2-CG2 4.33Å; Y187-I207 HydrophobicContact CE2-CB 4.32Å; Y187-I207 HydrophobicContact CE2-CG1 4.29Å; Y187-I207 HydrophobicContact CE2-CG2 4.33Å; Y187-I207 HydrophobicContact CG-CG1 4Å; V189-I207 HydrophobicContact CG1-CD1 3.97Å; L202-I207 HydrophobicContact CB-CD1 4.17Å; L202-I207 HydrophobicContact CD1-CD1 3.92Å; R204-I207 PolarHBondContact O-N 2.65Å; R204-I207 VanDerWaalsContact O-N 3.17Å; R205-I207 VanDerWaalsContact C-N 3.35Å
208	I	97.9	Very high	96	Very high	10 Å²	10	50.3 Å²	50.3	5%	0.051	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	112.8	170.2	-57.5	172	0	0	0	107	V159 A160 W172 L232 V282	V159-I208 CarbonylContact C-O 3.58Å; V159-I208 WeakPolarHBondContact CA-O 3.25Å; A160-I208 HydrophobicContact CB-CB 4.32Å; A160-I208 PolarHBondContact N-O 2.98Å; A160-I208 PolarHBondContact O-N 3.33Å; W172-I208 HydrophobicContact CE3-CD1 4.38Å; W172-I208 HydrophobicContact CH2-CD1 3.5Å; W172-I208 HydrophobicContact CH2-CG1 3.78Å; W172-I208 HydrophobicContact CZ2-CD1 4.08Å; W172-I208 HydrophobicContact CZ3-CB 4.47Å; W172-I208 HydrophobicContact CZ3-CD1 3.68Å; W172-I208 HydrophobicContact CZ3-CG1 3.76Å; I208-L232 HydrophobicContact CD1-CD1 4.07Å; I208-V282 HydrophobicContact CD1-CG2 4.44Å; I208-V282 HydrophobicContact CG2-CB 3.84Å; I208-V282 HydrophobicContact CG2-CG1 4.25Å; I208-V282 HydrophobicContact CG2-CG2 3.97Å
209	P	98.3	Very high	96.7	Very high	23 Å²	23	48.9 Å²	48.9	15%	0.149	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	137.9	173.9	-19.8	31.4	0	0	0	111.3	L141 A147 Y151	L141-P209 HydrophobicContact CD1-CB 4.38Å; L141-P209 HydrophobicContact CD2-CB 3.94Å; A147-P209 HydrophobicContact CB-CG 4.42Å; Y151-P209 HydrophobicContact CD1-CB 4.43Å; Y151-P209 HydrophobicContact CD1-CG 3.7Å; Y151-P209 HydrophobicContact CE1-CB 3.79Å; Y151-P209 HydrophobicContact CE1-CG 3.48Å; Y151-P209 VanDerWaalsContact CE1-CG 3.48Å
210	L	98.6	Very high	97	Very high	6 Å²	6	44.5 Å²	44.5	3%	0.031	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-71.5	156.6	170.2	-85.9	73.7	0	0	0	109.8	K158 A160 L174 F241 R279 Y280	K158-L210 HydrophobicContact CB-CD1 4.37Å; K158-L210 HydrophobicContact CB-CD2 4.09Å; K158-L210 WeakPolarHBondContact O-CB 3.46Å; K158-L210 WeakPolarHBondContact O-CD1 3.26Å; K158-L210 PolarHBondContact O-N 3.49Å; K158-L210 VanDerWaalsContact O-N 3.14Å; A160-L210 VanDerWaalsContact N-CD1 3.27Å; L174-L210 HydrophobicContact CD1-CD1 4.07Å; L174-L210 HydrophobicContact CD1-CD2 3.84Å; L210-F241 HydrophobicContact CD1-CZ 4.23Å; L210-F241 HydrophobicContact CD2-CZ 4.5Å; L210-R279 HydrophobicContact CD2-CG 4.07Å; L210-R279 WeakPolarHBondContact CD2-O 3.45Å; L210-R279 VanDerWaalsContact CG-O 3.31Å; L210-R279 WeakPolarHBondContact CG-O 3.46Å; L210-Y280 HydrophobicContact CD2-CD1 3.71Å; L210-Y280 HydrophobicContact CD2-CE1 3.9Å
211	P	98.4	Very high	97.2	Very high	5 Å²	5	47 Å²	47	3%	0.032	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-56.6	140.6	173.6	-24.5	35.7	0	0	0	111.9	L127 L141 G143 R279	L127-P211 WeakPolarHBondContact CD1-O 3.34Å; L141-P211 CarbonylContact O-C 3.58Å; L141-P211 VanDerWaalsContact O-CA 3.27Å; L141-P211 WeakPolarHBondContact O-CA 3.34Å; L141-P211 WeakPolarHBondContact O-CB 3.45Å; G143-P211 WeakPolarHBondContact O-CG 3.44Å; P211-R279 WeakPolarHBondContact CD-O 3.33Å; P211-R279 PolarHBondContact O-NH1 2.9Å
212	Q	97.3	Very high	97.2	Very high	62 Å²	62	48.6 Å²	48.6	29%	0.29	23%	0.232	S	C	.	.	S	Bend	trans	-93.2	-19.2	173.9	-69.9	-170.3	-16.1	0	0	112	L127 P128 L141 Y151	L127-Q212 VanDerWaalsContact CD1-C 3.46Å; L127-Q212 WeakPolarHBondContact CD1-O 3.47Å; P128-Q212 WeakPolarHBondContact CG-O 3.34Å; L141-Q212 HydrophobicContact CB-CB 4.21Å; L141-Q212 HydrophobicContact CB-CG 4.19Å; L141-Q212 HydrophobicContact CD1-CG 4Å; L141-Q212 PolarHBondContact O-N 3.32Å; Y151-Q212 PolarHBondContact OH-NE2 3.35Å
213	W	98.3	Very high	97.2	Very high	73 Å²	73	47.8 Å²	47.8	28%	0.277	23%	0.228	S	C	.	.	B	Isolated β-bridge	trans	-133.2	150.2	171.9	-59.3	-92.8	0	0	0	111.4	P128 W130 P139 L141 C142 G143	P128-W213 HydrophobicContact CG-CG 4.49Å; P128-W213 CarbonylContact O-C 3.58Å; P128-W213 VanDerWaalsContact O-CA 3.24Å; P128-W213 WeakPolarHBondContact O-CA 3.42Å; W130-W213 HydrophobicContact CB-CB 3.92Å; W130-W213 HydrophobicContact CB-CG 4.3Å; P139-W213 HydrophobicContact CG-CE3 4.14Å; P139-W213 HydrophobicContact CG-CZ3 4.21Å; L141-W213 PolarHBondContact O-N 3.02Å; C142-W213 HydrophobicContact CB-CB 4.32Å; G143-W213 PolarHBondContact N-O 2.79Å
214	K	97.9	Very high	97.3	Very high	25 Å²	25	47.1 Å²	47.1	11%	0.109	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-75.2	137.3	159.9	-63.6	-177.7	-176.5	-177.2	0	108.6	A124 L127 P128 L129 W130 Q278	A124-K214 WeakPolarHBondContact O-CE 3.46Å; A124-K214 PolarHBondContact O-NZ 3.29Å; A124-K214 VanDerWaalsContact O-NZ 3.11Å; L127-K214 HydrophobicContact CB-CG 4.12Å; L127-K214 HydrophobicContact CD2-CG 3.6Å; L127-K214 HydrophobicContact CG-CG 3.85Å; P128-K214 PolarHBondContact O-N 2.86Å; L129-K214 HydrophobicContact CD1-CB 3.82Å; W130-K214 PolarHBondContact N-O 3.06Å; K214-Q278 HydrophobicContact CG-CB 4.4Å
215	A	98.4	Very high	97.5	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-77.2	137.5	164.9	0	0	0	0	0	109.1	P217 A223 L224 Q278	A215-P217 WeakPolarHBondContact O-CD 3.36Å; A215-A223 HydrophobicContact CB-CB 3.61Å; A215-A223 WeakPolarHBondContact CB-O 3.44Å; A215-L224 HydrophobicContact CB-CD2 3.78Å; A215-L224 HydrophobicContact CB-CG 4.1Å; A215-Q278 PolarHBondContact O-NE2 3.5Å; A215-Q278 PolarHBondContact O-OE1 3.13Å
216	N	97.4	Very high	97.6	Very high	17 Å²	17	37.7 Å²	37.7	9%	0.091	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-87	117.9	175.3	178.8	1.1	0	0	0	109.2	L129 E218 T219 D220 P253	L129-N216 HydrophobicContact CD1-CB 3.83Å; L129-N216 HydrophobicContact CD2-CB 4.05Å; L129-N216 HydrophobicContact CG-CB 4.01Å; N216-E218 PolarHBondContact O-N 3.45Å; N216-E218 VanDerWaalsContact O-N 3.1Å; N216-E218 WeakPolarHBondContact OD1-CB 3.24Å; N216-E218 PolarHBondContact OD1-N 3.02Å; N216-T219 VanDerWaalsContact CB-OG1 3.27Å; N216-T219 WeakPolarHBondContact CB-OG1 3.35Å; N216-T219 PolarHBondContact ND2-OG1 2.89Å; N216-T219 VanDerWaalsContact ND2-OG1 3.14Å; N216-T219 PolarHBondContact O-N 3.03Å; N216-D220 CarbonylContact O-C 3.55Å; N216-D220 WeakPolarHBondContact O-CA 3.48Å; N216-D220 PolarHBondContact O-N 3.48Å; N216-P253 WeakPolarHBondContact OD1-CG 3.34Å
217	P	97.4	Very high	97.7	Very high	18 Å²	18	42 Å²	42	12%	0.117	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-25	179.7	-22	32.6	0	0	0	114.4	A215 L224 P250	A215-P217 WeakPolarHBondContact O-CD 3.36Å; P217-L224 HydrophobicContact CB-CD1 3.9Å; P217-L224 HydrophobicContact CG-CD1 3.89Å; P217-P250 VanDerWaalsContact CB-O 3.23Å; P217-P250 WeakPolarHBondContact CB-O 3.47Å; P217-P250 HydrophobicContact CG-CB 3.92Å; P217-P250 WeakPolarHBondContact CG-O 3.36Å
218	E	96.1	Very high	97.7	Very high	135 Å²	135	46.6 Å²	46.6	63%	0.631	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-26.3	-177.1	-60.5	174.4	-174.8	0	0	112.9	N216	N216-E218 PolarHBondContact O-N 3.45Å; N216-E218 VanDerWaalsContact O-N 3.1Å; N216-E218 WeakPolarHBondContact OD1-CB 3.24Å; N216-E218 PolarHBondContact OD1-N 3.02Å
219	T	95.5	Very high	97.7	Very high	88 Å²	88	49.6 Å²	49.6	54%	0.54	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.9	-30.4	-174.3	53.1	0	0	0	0	113.9	N216 P221	N216-T219 VanDerWaalsContact CB-OG1 3.27Å; N216-T219 WeakPolarHBondContact CB-OG1 3.35Å; N216-T219 PolarHBondContact ND2-OG1 2.89Å; N216-T219 VanDerWaalsContact ND2-OG1 3.14Å; N216-T219 PolarHBondContact O-N 3.03Å; T219-P221 VanDerWaalsContact C-CD 3.48Å
220	D	97.5	Very high	97.7	Very high	11 Å²	11	50.3 Å²	50.3	6%	0.059	26%	0.257	C	S	.	.			trans	-135.7	51.4	-171.8	-48.1	-92.8	0	0	0	111.8	W130 P138 N216 E222 A223	W130-D220 PolarHBondContact NE1-OD1 3.35Å; P138-D220 HydrophobicContact CG-CB 3.76Å; P138-D220 WeakPolarHBondContact CG-OD1 3.24Å; N216-D220 CarbonylContact O-C 3.55Å; N216-D220 WeakPolarHBondContact O-CA 3.48Å; N216-D220 PolarHBondContact O-N 3.48Å; D220-E222 VanDerWaalsContact C-OE2 3.23Å; D220-E222 WeakPolarHBondContact CA-OE2 3.41Å; D220-E222 PolarHBondContact O-N 3.09Å; D220-A223 HydrophobicContact CB-CB 4.47Å; D220-A223 PolarHBondContact O-N 3.5Å; D220-A223 VanDerWaalsContact O-N 3.08Å
221	P	97.3	Very high	97.7	Very high	74 Å²	74	50 Å²	50	48%	0.481	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-62.8	-23.8	-176.9	27.9	-36.2	0	0	0	113.5	T219 A223 L224	T219-P221 VanDerWaalsContact C-CD 3.48Å; P221-A223 PolarHBondContact O-N 3.22Å; P221-L224 PolarHBondContact O-N 2.73Å
222	E	97.1	Very high	97.7	Very high	114 Å²	114	50 Å²	50	53%	0.533	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-67.4	-18.9	175.6	75.3	-75.1	-178.6	0	0	113.4	P138 D220 L224	P138-E222 WeakPolarHBondContact CD-OE1 3.49Å; P138-E222 WeakPolarHBondContact CG-OE1 3.33Å; D220-E222 VanDerWaalsContact C-OE2 3.23Å; D220-E222 WeakPolarHBondContact CA-OE2 3.41Å; D220-E222 PolarHBondContact O-N 3.09Å; E222-L224 VanDerWaalsContact C-N 3.28Å
223	A	98.4	Very high	97.8	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-90.3	15.9	174.4	0	0	0	0	0	112.7	P138 G143 A144 M145 A215 D220 P221	P138-A223 HydrophobicContact CB-CB 3.77Å; P138-A223 HydrophobicContact CG-CB 3.86Å; G143-A223 CarbonylContact C-O 3.47Å; G143-A223 WeakPolarHBondContact CA-O 3.4Å; A144-A223 WeakPolarHBondContact CB-O 3.39Å; A144-A223 PolarHBondContact N-O 3.08Å; M145-A223 HydrophobicContact CG-CB 3.83Å; M145-A223 HydrophobicContact SD-CB 4.26Å; A215-A223 HydrophobicContact CB-CB 3.61Å; A215-A223 WeakPolarHBondContact CB-O 3.44Å; D220-A223 HydrophobicContact CB-CB 4.47Å; D220-A223 PolarHBondContact O-N 3.5Å; D220-A223 VanDerWaalsContact O-N 3.08Å; P221-A223 PolarHBondContact O-N 3.22Å
224	L	98.7	Very high	97.8	Very high	15 Å²	15	44.2 Å²	44.2	8%	0.079	23%	0.232	C	C	.	.	S	Bend	trans	-108.9	149.7	172.3	-63.2	169.8	0	0	0	111.4	A215 P217 P221 E222 P250 Y257	A215-L224 HydrophobicContact CB-CD2 3.78Å; A215-L224 HydrophobicContact CB-CG 4.1Å; P217-L224 HydrophobicContact CB-CD1 3.9Å; P217-L224 HydrophobicContact CG-CD1 3.89Å; P221-L224 PolarHBondContact O-N 2.73Å; E222-L224 VanDerWaalsContact C-N 3.28Å; L224-P250 HydrophobicContact CD2-CG 4.49Å; L224-Y257 VanDerWaalsContact CA-OH 3.28Å; L224-Y257 WeakPolarHBondContact CA-OH 3.47Å; L224-Y257 WeakPolarHBondContact CD2-OH 3.47Å
225	F	98.6	Very high	97.8	Very high	8 Å²	8	46.5 Å²	46.5	4%	0.035	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-68.6	133.9	170.2	-65.3	-69.6	0	0	0	109.9	A144 V231 I246 Y257 V281 A283	A144-F225 HydrophobicContact CB-CD1 3.64Å; A144-F225 HydrophobicContact CB-CD2 3.86Å; A144-F225 HydrophobicContact CB-CE1 3.59Å; A144-F225 HydrophobicContact CB-CE2 3.8Å; A144-F225 HydrophobicContact CB-CG 3.78Å; A144-F225 HydrophobicContact CB-CZ 3.67Å; F225-V231 HydrophobicContact CB-CG1 4.2Å; F225-V231 HydrophobicContact CD1-CG1 3.8Å; F225-V231 HydrophobicContact CD2-CG1 4.1Å; F225-V231 HydrophobicContact CE1-CG1 4.16Å; F225-V231 HydrophobicContact CE2-CG1 4.45Å; F225-V231 HydrophobicContact CG-CG1 3.77Å; F225-V231 HydrophobicContact CZ-CG1 4.47Å; F225-I246 HydrophobicContact CB-CD1 3.96Å; F225-I246 HydrophobicContact CB-CG1 3.71Å; F225-Y257 HydrophobicContact CB-CE1 3.99Å; F225-Y257 HydrophobicContact CD2-CE2 4.4Å; F225-Y257 AromaticContact CD2-CZ 4Å; F225-Y257 PolarHBondContact N-OH 2.86Å; F225-V281 HydrophobicContact CD2-CB 4.44Å; F225-V281 HydrophobicContact CD2-CG1 3.68Å; F225-V281 HydrophobicContact CE2-CB 4.39Å; F225-V281 HydrophobicContact CE2-CG1 3.83Å; F225-A283 HydrophobicContact CE1-CB 4.21Å; F225-A283 HydrophobicContact CZ-CB 4.35Å
226	S	97.6	Very high	97.7	Very high	67 Å²	67	48.8 Å²	48.8	47%	0.469	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-80.3	158.5	-177.8	60.2	0	0	0	0	112.1	Q229 I246	S226-Q229 WeakPolarHBondContact O-CB 3.36Å; S226-Q229 PolarHBondContact O-N 3.3Å; S226-Q229 VanDerWaalsContact O-N 3.16Å; S226-Q229 PolarHBondContact OG-OE1 3.42Å; S226-Q229 VanDerWaalsContact OG-OE1 3.07Å; S226-I246 WeakPolarHBondContact O-CB 3.43Å; S226-I246 WeakPolarHBondContact O-CG1 3.3Å
227	K	98	Very high	97.5	Very high	125 Å²	125	53.8 Å²	53.8	54%	0.543	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	142.8	175.1	-177.7	179.3	-180	-171.2	0	111	Q229 H247	K227-Q229 PolarHBondContact O-N 3.03Å; K227-Q229 VanDerWaalsContact O-N 3.12Å; K227-H247 WeakPolarHBondContact CG-O 3.43Å
228	D	97.3	Very high	97.4	Very high	102 Å²	102	54.4 Å²	54.4	55%	0.545	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.5	6.5	-178.1	-52.2	-42.6	0	0	0	114.4	I246	D228-I246 PolarHBondContact N-O 2.96Å
229	Q	97.6	Very high	97.4	Very high	73 Å²	73	48.6 Å²	48.6	34%	0.341	26%	0.255	S	S	.	.			trans	-71.4	133.7	173.4	-171.4	168.3	-6.3	0	0	110.7	S226 K227 L245 I246	S226-Q229 WeakPolarHBondContact O-CB 3.36Å; S226-Q229 PolarHBondContact O-N 3.3Å; S226-Q229 VanDerWaalsContact O-N 3.16Å; S226-Q229 PolarHBondContact OG-OE1 3.42Å; S226-Q229 VanDerWaalsContact OG-OE1 3.07Å; K227-Q229 PolarHBondContact O-N 3.03Å; K227-Q229 VanDerWaalsContact O-N 3.12Å; Q229-L245 WeakPolarHBondContact O-CA 3.24Å; Q229-I246 HydrophobicContact CB-CG1 4.31Å; Q229-I246 PolarHBondContact O-N 3.38Å; Q229-I246 VanDerWaalsContact O-N 3.07Å
230	L	98	Very high	97.4	Very high	39 Å²	39	45.5 Å²	45.5	20%	0.204	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	124.8	174.6	-179	70.5	0	0	0	110.7	R243 A244 L245 C284 K288	L230-R243 HydrophobicContact CD1-CB 4.31Å; L230-R243 VanDerWaalsContact CD2-NH2 3.28Å; L230-A244 WeakPolarHBondContact CA-O 3.4Å; L230-L245 HydrophobicContact CB-CD2 4.27Å; L230-L245 HydrophobicContact CD1-CD2 4.24Å; L230-C284 HydrophobicContact CD2-CB 4.19Å; L230-C284 HydrophobicContact CG-CB 3.9Å; L230-K288 HydrophobicContact CD2-CG 4.46Å
231	V	98.5	Very high	97.4	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	166.6	-179.4	-64.3	0	0	0	0	111.1	F225 R243 A244 I246 V281 V282	F225-V231 HydrophobicContact CB-CG1 4.2Å; F225-V231 HydrophobicContact CD1-CG1 3.8Å; F225-V231 HydrophobicContact CD2-CG1 4.1Å; F225-V231 HydrophobicContact CE1-CG1 4.16Å; F225-V231 HydrophobicContact CE2-CG1 4.45Å; F225-V231 HydrophobicContact CG-CG1 3.77Å; F225-V231 HydrophobicContact CZ-CG1 4.47Å; V231-R243 WeakPolarHBondContact O-CA 3.31Å; V231-A244 HydrophobicContact CG2-CB 4.24Å; V231-A244 WeakPolarHBondContact CG2-O 3.4Å; V231-A244 PolarHBondContact N-O 3.31Å; V231-A244 PolarHBondContact O-N 2.87Å; V231-I246 HydrophobicContact CB-CD1 4.45Å; V231-I246 HydrophobicContact CG1-CD1 3.94Å; V231-I246 HydrophobicContact CG1-CG1 4.08Å; V231-I246 HydrophobicContact CG2-CD1 3.68Å; V231-I246 HydrophobicContact CG2-CG1 4.34Å; V231-V281 HydrophobicContact CB-CG1 3.8Å; V231-V281 HydrophobicContact CG1-CG1 4Å; V231-V281 HydrophobicContact CG2-CG1 3.76Å; V231-V282 WeakPolarHBondContact CB-O 3.49Å
232	L	98.6	Very high	97.4	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.016	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	124.3	159.2	-72.6	171.4	0	0	0	107.6	W172 I208 F241 Y242 R243 V281 V282 C284	W172-L232 HydrophobicContact CD2-CD1 3.78Å; W172-L232 HydrophobicContact CE3-CD1 4.41Å; W172-L232 HydrophobicContact CG-CD1 3.91Å; W172-L232 HydrophobicContact CG-CD2 4.5Å; W172-L232 HydrophobicContact CZ2-CD1 4.22Å; I208-L232 HydrophobicContact CD1-CD1 4.07Å; L232-F241 HydrophobicContact CB-CB 4.28Å; L232-Y242 WeakPolarHBondContact CA-O 3.41Å; L232-R243 HydrophobicContact CD2-CG 4.11Å; L232-V281 WeakPolarHBondContact O-CA 3.36Å; L232-V282 HydrophobicContact CB-CG2 3.83Å; L232-V282 PolarHBondContact N-O 3.39Å; L232-V282 PolarHBondContact O-N 2.96Å; L232-C284 HydrophobicContact CG-CB 4.22Å
233	A	98.8	Very high	97.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	142.4	179.8	0	0	0	0	0	110.2	Y235 F241 Y242 A244 V259 F261 V276 Y280 V281	A233-Y235 PolarHBondContact O-N 3.48Å; A233-F241 CarbonylContact O-C 3.6Å; A233-F241 VanDerWaalsContact O-CA 3.24Å; A233-F241 WeakPolarHBondContact O-CA 3.41Å; A233-Y242 PolarHBondContact N-O 2.86Å; A233-Y242 PolarHBondContact O-N 3.45Å; A233-A244 HydrophobicContact CB-CB 4.19Å; A233-V259 HydrophobicContact CB-CG2 4.29Å; A233-F261 HydrophobicContact CB-CE1 3.75Å; A233-F261 HydrophobicContact CB-CZ 3.76Å; A233-F261 WeakPolarHBondContact O-CE1 3.46Å; A233-V276 HydrophobicContact CB-CG1 4.3Å; A233-V276 HydrophobicContact CB-CG2 4.32Å; A233-Y280 WeakPolarHBondContact CA-O 3.46Å; A233-V281 HydrophobicContact CB-CG2 4.27Å
234	L	98.6	Very high	97.5	Very high	14 Å²	14	42.6 Å²	42.6	7%	0.073	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	121.8	175.2	-167.3	78.7	0	0	0	109.2	L120 L174 C240 F241 Y280	L120-L234 HydrophobicContact CD1-CD2 4.47Å; L174-L234 HydrophobicContact CB-CD1 4.12Å; L174-L234 HydrophobicContact CD2-CD2 4.38Å; L234-C240 WeakPolarHBondContact CA-O 3.31Å; L234-F241 HydrophobicContact CB-CD1 4.11Å; L234-F241 HydrophobicContact CB-CE1 3.96Å; L234-F241 HydrophobicContact CB-CZ 4.39Å; L234-F241 HydrophobicContact CD1-CD1 4.42Å; L234-F241 HydrophobicContact CD1-CD2 3.96Å; L234-F241 HydrophobicContact CD1-CE1 4.25Å; L234-F241 HydrophobicContact CD1-CE2 3.78Å; L234-F241 HydrophobicContact CD1-CG 4.27Å; L234-F241 HydrophobicContact CD1-CZ 3.93Å; L234-Y280 HydrophobicContact CB-CG 4.21Å; L234-Y280 HydrophobicContact CD2-CD1 3.94Å; L234-Y280 HydrophobicContact CD2-CD2 4.15Å; L234-Y280 HydrophobicContact CD2-CE1 4.37Å; L234-Y280 HydrophobicContact CD2-CG 3.86Å; L234-Y280 PolarHBondContact N-O 2.88Å
235	Y	98.1	Very high	97.4	Very high	74 Å²	74	43.2 Å²	43.2	29%	0.29	21%	0.214	S	C	.	.	P	Polyproline II helix	trans	-70.1	135.8	-179.6	-166.2	-96.5	0	0	0	110.3	A233 Q237 T238 C240 Y242 F261 L274	A233-Y235 PolarHBondContact O-N 3.48Å; Y235-Q237 PolarHBondContact O-N 2.9Å; Y235-T238 HydrophobicContact CD1-CG2 3.91Å; Y235-T238 PolarHBondContact O-N 3.35Å; Y235-T238 VanDerWaalsContact O-N 3.09Å; Y235-T238 PolarHBondContact O-OG1 3.19Å; Y235-C240 PolarHBondContact N-O 2.9Å; Y235-Y242 HydrophobicContact CG-CD2 4.34Å; Y235-Y242 HydrophobicContact CG-CE2 4.4Å; Y235-F261 HydrophobicContact CD2-CB 4.44Å; Y235-F261 AromaticContact CD2-CD1 3.86Å; Y235-F261 HydrophobicContact CD2-CD1 3.86Å; Y235-F261 AromaticContact CD2-CD2 3.77Å; Y235-F261 HydrophobicContact CD2-CD2 3.77Å; Y235-F261 AromaticContact CD2-CE1 3.95Å; Y235-F261 HydrophobicContact CD2-CE1 3.95Å; Y235-F261 AromaticContact CD2-CE2 3.85Å; Y235-F261 HydrophobicContact CD2-CE2 3.85Å; Y235-F261 AromaticContact CD2-CG 3.75Å; Y235-F261 HydrophobicContact CD2-CG 3.75Å; Y235-F261 AromaticContact CD2-CZ 3.93Å; Y235-F261 HydrophobicContact CD2-CZ 3.93Å; Y235-F261 HydrophobicContact CE2-CB 4.33Å; Y235-F261 AromaticContact CE2-CD2 3.91Å; Y235-F261 HydrophobicContact CE2-CD2 3.91Å; Y235-F261 HydrophobicContact CE2-CE2 4.33Å; Y235-F261 HydrophobicContact CE2-CG 4.01Å; Y235-L274 HydrophobicContact CE2-CD1 4.01Å
236	P	96.8	Very high	97.4	Very high	47 Å²	47	42.8 Å²	42.8	31%	0.305	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	137.9	-176.2	-30.1	37	0	0	0	113.1	T238 L274	P236-T238 PolarHBondContact O-N 3.44Å; P236-L274 HydrophobicContact CG-CB 4.3Å; P236-L274 HydrophobicContact CG-CD1 4.13Å
237	Q	93.9	Very high	97.5	Very high	123 Å²	123	42.8 Å²	42.8	58%	0.575	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.3	20	-179	-55.3	-61.6	-51	0	0	115.1	R113 M117 Y235	R113-Q237 PolarHBondContact NH2-O 3.06Å; M117-Q237 VanDerWaalsContact SD-C 3.58Å; M117-Q237 VanDerWaalsContact SD-CA 3.58Å; Y235-Q237 PolarHBondContact O-N 2.9Å
238	T	94.8	Very high	97.5	Very high	31 Å²	31	39.4 Å²	39.4	19%	0.19	20%	0.195	C	C	.	.	S	Bend	trans	-128.3	173.3	175.8	78.1	0	0	0	0	111.9	Y235 P236 C240	Y235-T238 HydrophobicContact CD1-CG2 3.91Å; Y235-T238 PolarHBondContact O-N 3.35Å; Y235-T238 VanDerWaalsContact O-N 3.09Å; Y235-T238 PolarHBondContact O-OG1 3.19Å; P236-T238 PolarHBondContact O-N 3.44Å; T238-C240 PolarHBondContact OG1-N 3.25Å; T238-C240 PolarHBondContact OG1-O 3.28Å
239	T	95	Very high	97.5	Very high	12 Å²	12	38 Å²	38	7%	0.074	19%	0.185	C	C	.	.	S	Bend	trans	-106.6	19.1	170.1	53	0	0	0	0	111.8	L116 M117 L120 I173 L174 I192 D193	L116-T239 HydrophobicContact CD2-CG2 3.88Å; M117-T239 HydrophobicContact CE-CG2 4.18Å; L120-T239 HydrophobicContact CD1-CG2 4.41Å; I173-T239 CarbonylContact C-O 3.5Å; I173-T239 WeakPolarHBondContact CA-O 3.22Å; L174-T239 PolarHBondContact N-O 2.97Å; I192-T239 HydrophobicContact CG2-CG2 3.51Å; D193-T239 HydrophobicContact CB-CG2 4.25Å
240	C	96.1	Very high	97.5	Very high	23 Å²	23	34.5 Å²	34.5	16%	0.155	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	139.7	-173.3	-71.8	0	0	0	0	112.1	Q171 W172 L234 Y235 T238 Y242	Q171-C240 HydrophobicContact CG-CB 4.5Å; W172-C240 CarbonylContact O-C 3.15Å; W172-C240 WeakPolarHBondContact O-CA 3.24Å; L234-C240 WeakPolarHBondContact CA-O 3.31Å; Y235-C240 PolarHBondContact N-O 2.9Å; T238-C240 PolarHBondContact OG1-N 3.25Å; T238-C240 PolarHBondContact OG1-O 3.28Å; C240-Y242 HydrophobicContact CB-CD2 4.31Å; C240-Y242 HydrophobicContact CB-CE2 3.4Å; C240-Y242 WeakPolarHBondContact O-CD2 3.34Å
241	F	98.1	Very high	97.4	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.009	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	138	174.5	-62.7	-99.5	0	0	0	111.1	A160 Q171 W172 L174 L210 L232 A233 L234 Y280	A160-F241 HydrophobicContact CB-CD1 4.47Å; A160-F241 HydrophobicContact CB-CD2 3.78Å; A160-F241 HydrophobicContact CB-CE1 4.38Å; A160-F241 HydrophobicContact CB-CE2 3.66Å; A160-F241 HydrophobicContact CB-CG 4.2Å; A160-F241 HydrophobicContact CB-CZ 3.99Å; Q171-F241 PolarHBondContact NE2-O 3.42Å; W172-F241 HydrophobicContact CB-CB 3.78Å; W172-F241 PolarHBondContact O-N 3.29Å; L174-F241 HydrophobicContact CB-CE2 3.81Å; L174-F241 HydrophobicContact CB-CZ 4.45Å; L174-F241 HydrophobicContact CD1-CE2 4.16Å; L174-F241 HydrophobicContact CD1-CZ 4.13Å; L210-F241 HydrophobicContact CD1-CZ 4.23Å; L210-F241 HydrophobicContact CD2-CZ 4.5Å; L232-F241 HydrophobicContact CB-CB 4.28Å; A233-F241 CarbonylContact O-C 3.6Å; A233-F241 VanDerWaalsContact O-CA 3.24Å; A233-F241 WeakPolarHBondContact O-CA 3.41Å; L234-F241 HydrophobicContact CB-CD1 4.11Å; L234-F241 HydrophobicContact CB-CE1 3.96Å; L234-F241 HydrophobicContact CB-CZ 4.39Å; L234-F241 HydrophobicContact CD1-CD1 4.42Å; L234-F241 HydrophobicContact CD1-CD2 3.96Å; L234-F241 HydrophobicContact CD1-CE1 4.25Å; L234-F241 HydrophobicContact CD1-CE2 3.78Å; L234-F241 HydrophobicContact CD1-CG 4.27Å; L234-F241 HydrophobicContact CD1-CZ 3.93Å; F241-Y280 WeakPolarHBondContact CE1-O 3.2Å
242	Y	97.4	Very high	97.3	Very high	88 Å²	88	44.8 Å²	44.8	35%	0.345	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	160.4	179.5	-60.1	-94	0	0	0	110.4	L232 A233 Y235 C240 A244	L232-Y242 WeakPolarHBondContact CA-O 3.41Å; A233-Y242 PolarHBondContact N-O 2.86Å; A233-Y242 PolarHBondContact O-N 3.45Å; Y235-Y242 HydrophobicContact CG-CD2 4.34Å; Y235-Y242 HydrophobicContact CG-CE2 4.4Å; C240-Y242 HydrophobicContact CB-CD2 4.31Å; C240-Y242 HydrophobicContact CB-CE2 3.4Å; C240-Y242 WeakPolarHBondContact O-CD2 3.34Å; Y242-A244 PolarHBondContact O-N 2.78Å
243	R	97.8	Very high	97.2	Very high	49 Å²	49	46 Å²	46	19%	0.185	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	131.2	177.2	-67.5	167.5	57.6	82.9	15.5	109.1	L230 V231 L232 E262 E286 K288	L230-R243 HydrophobicContact CD1-CB 4.31Å; L230-R243 VanDerWaalsContact CD2-NH2 3.28Å; V231-R243 WeakPolarHBondContact O-CA 3.31Å; L232-R243 HydrophobicContact CD2-CG 4.11Å; R243-E262 HydrophobicContact CB-CB 4.42Å; R243-E262 HydrophobicContact CB-CG 4.17Å; R243-E262 WeakPolarHBondContact CB-OE2 3.43Å; R243-E262 WeakPolarHBondContact CD-OE2 3.47Å; R243-E262 IonicContact CZ-OE1 3.99Å; R243-E262 IonicContact CZ-OE2 3.59Å; R243-E262 IonicContact NE-OE1 3.81Å; R243-E262 PolarHBondContact NE-OE1 3.25Å; R243-E262 IonicContact NE-OE2 3.23Å; R243-E262 PolarHBondContact NE-OE2 2.88Å; R243-E262 IonicContact NH2-OE1 2.68Å; R243-E262 PolarHBondContact NH2-OE1 3.18Å; R243-E262 IonicContact NH2-OE2 2.76Å; R243-E262 PolarHBondContact O-N 3.42Å; R243-E286 PolarHBondContact NH1-O 2.73Å; R243-K288 VanDerWaalsContact NH2-CG 3.34Å
244	A	98.4	Very high	96.9	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	155.9	177.8	0	0	0	0	0	111.1	L230 V231 A233 Y242 V259 L260 F261	L230-A244 WeakPolarHBondContact CA-O 3.4Å; V231-A244 HydrophobicContact CG2-CB 4.24Å; V231-A244 WeakPolarHBondContact CG2-O 3.4Å; V231-A244 PolarHBondContact N-O 3.31Å; V231-A244 PolarHBondContact O-N 2.87Å; A233-A244 HydrophobicContact CB-CB 4.19Å; Y242-A244 PolarHBondContact O-N 2.78Å; A244-V259 HydrophobicContact CB-CB 4.02Å; A244-V259 HydrophobicContact CB-CG2 4.12Å; A244-L260 CarbonylContact C-O 3.49Å; A244-L260 WeakPolarHBondContact CA-O 3.35Å; A244-L260 WeakPolarHBondContact CB-O 3.41Å; A244-F261 HydrophobicContact CB-CD1 3.8Å; A244-F261 HydrophobicContact CB-CE1 4.08Å; A244-F261 HydrophobicContact CB-CG 4.16Å
245	L	98.4	Very high	96.9	Very high	27 Å²	27	52.8 Å²	52.8	14%	0.141	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	138.5	167.8	-62.3	177.5	0	0	0	109.4	Q229 L230 H247 V259 L260 Y270	Q229-L245 WeakPolarHBondContact O-CA 3.24Å; L230-L245 HydrophobicContact CB-CD2 4.27Å; L230-L245 HydrophobicContact CD1-CD2 4.24Å; L245-H247 PolarHBondContact O-N 3.47Å; L245-V259 CarbonylContact O-C 3.58Å; L245-V259 VanDerWaalsContact O-CA 3.26Å; L245-V259 WeakPolarHBondContact O-CA 2.84Å; L245-L260 PolarHBondContact N-O 3.02Å; L245-L260 PolarHBondContact O-N 2.95Å; L245-Y270 HydrophobicContact CD1-CD1 4.36Å; L245-Y270 HydrophobicContact CD1-CE1 3.59Å; L245-Y270 HydrophobicContact CD1-CE2 4.29Å; L245-Y270 HydrophobicContact CG-CE1 3.81Å
246	I	98.7	Very high	96.9	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	118.9	170.8	-58.2	-56.9	0	0	0	109.4	F225 S226 D228 Q229 V231 Y257 V259 V281	F225-I246 HydrophobicContact CB-CD1 3.96Å; F225-I246 HydrophobicContact CB-CG1 3.71Å; S226-I246 WeakPolarHBondContact O-CB 3.43Å; S226-I246 WeakPolarHBondContact O-CG1 3.3Å; D228-I246 PolarHBondContact N-O 2.96Å; Q229-I246 HydrophobicContact CB-CG1 4.31Å; Q229-I246 PolarHBondContact O-N 3.38Å; Q229-I246 VanDerWaalsContact O-N 3.07Å; V231-I246 HydrophobicContact CB-CD1 4.45Å; V231-I246 HydrophobicContact CG1-CD1 3.94Å; V231-I246 HydrophobicContact CG1-CG1 4.08Å; V231-I246 HydrophobicContact CG2-CD1 3.68Å; V231-I246 HydrophobicContact CG2-CG1 4.34Å; I246-Y257 HydrophobicContact CD1-CD1 3.87Å; I246-Y257 HydrophobicContact CD1-CE1 4.33Å; I246-Y257 HydrophobicContact CD1-CG 4.36Å; I246-Y257 HydrophobicContact CG2-CD1 4.16Å; I246-V259 HydrophobicContact CD1-CG1 3.83Å; I246-V281 HydrophobicContact CD1-CG1 4.17Å
247	H	98.4	Very high	97	Very high	66 Å²	66	50.2 Å²	50.2	31%	0.306	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	-52.1	171.6	-175	62	0	0	0	110.8	K227 L245 S258 L260	K227-H247 WeakPolarHBondContact CG-O 3.43Å; L245-H247 PolarHBondContact O-N 3.47Å; H247-S258 WeakPolarHBondContact CA-O 3.33Å; H247-S258 WeakPolarHBondContact CB-O 3.45Å; H247-S258 PolarHBondContact N-O 2.88Å; H247-L260 HydrophobicContact CB-CD2 4.19Å; H247-L260 HydrophobicContact CB-CG 4.05Å
248	T	98.4	Very high	97.2	Very high	55 Å²	55	44.9 Å²	44.9	34%	0.337	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	141.7	175.1	57.9	0	0	0	0	110.4	S258	T248-S258 PolarHBondContact N-O 3.46Å; T248-S258 VanDerWaalsContact N-O 3.13Å; T248-S258 PolarHBondContact O-N 2.8Å; T248-S258 WeakPolarHBondContact OG1-CB 3.27Å
249	H	96.7	Very high	97.4	Very high	71 Å²	71	43.4 Å²	43.4	33%	0.329	21%	0.206	S	C	.	.			trans	-82.9	160.5	170.5	60	-84.3	0	0	0	110.5	H251 Y257	H249-H251 AromaticContact NE2-CD2 3.96Å; H249-H251 PolarHBondContact O-N 2.88Å; H249-Y257 HydrophobicContact CB-CD1 4.22Å; H249-Y257 HydrophobicContact CB-CE1 3.93Å
250	P	97.8	Very high	97.6	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.006	21%	0.211	C	C	.	.			trans	-57.7	134.8	173.3	-22.7	31.7	0	0	0	111.4	P217 L224 D255 Y257 Q278	P217-P250 VanDerWaalsContact CB-O 3.23Å; P217-P250 WeakPolarHBondContact CB-O 3.47Å; P217-P250 HydrophobicContact CG-CB 3.92Å; P217-P250 WeakPolarHBondContact CG-O 3.36Å; L224-P250 HydrophobicContact CD2-CG 4.49Å; P250-D255 HydrophobicContact CB-CB 4.05Å; P250-D255 WeakPolarHBondContact CB-O 3.49Å; P250-Y257 HydrophobicContact CG-CD2 4.38Å; P250-Y257 HydrophobicContact CG-CE2 4.48Å; P250-Y257 HydrophobicContact CG-CG 4.39Å; P250-Q278 HydrophobicContact CG-CG 4.18Å
251	H	96.4	Very high	97.7	Very high	126 Å²	126	43.5 Å²	43.5	58%	0.583	20%	0.204	S	C	*	.	S	Bend	trans	-95.1	-20.4	173	-62.3	136.3	0	0	0	112.8	H249	H249-H251 AromaticContact NE2-CD2 3.96Å; H249-H251 PolarHBondContact O-N 2.88Å
252	R	97.1	Very high	97.7	Very high	129 Å²	129	46.7 Å²	46.7	49%	0.487	22%	0.219	S	C	.	.	S	Bend	trans	-128.1	158.2	174.7	-58	174.7	-63	176.2	5.3	110.5	Q254 D255	R252-Q254 PolarHBondContact O-N 3.36Å; R252-Q254 VanDerWaalsContact O-N 3.07Å; R252-D255 WeakPolarHBondContact CB-OD2 3.37Å; R252-D255 IonicContact CZ-OD1 2.69Å; R252-D255 IonicContact CZ-OD2 2.77Å; R252-D255 PolarHBondContact N-OD2 3.01Å; R252-D255 VanDerWaalsContact N-OD2 3.14Å; R252-D255 IonicContact NE-OD1 2.9Å; R252-D255 PolarHBondContact NE-OD1 2.94Å; R252-D255 IonicContact NE-OD2 3.66Å; R252-D255 PolarHBondContact NE-OD2 3.34Å; R252-D255 IonicContact NH2-OD1 3.86Å; R252-D255 PolarHBondContact NH2-OD1 3.07Å; R252-D255 IonicContact NH2-OD2 2.86Å; R252-D255 PolarHBondContact O-N 3.45Å
253	P	94.7	Very high	97.6	Very high	29 Å²	29	44.4 Å²	44.4	19%	0.188	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-29.5	-177	-27.6	33.8	0	0	0	115.9	L129 N216	L129-P253 HydrophobicContact CD1-CB 3.99Å; L129-P253 HydrophobicContact CD2-CB 3.91Å; L129-P253 HydrophobicContact CD2-CG 4.22Å; N216-P253 WeakPolarHBondContact OD1-CG 3.34Å
254	Q	94.3	Very high	97.4	Very high	114 Å²	114	49.1 Å²	49.1	53%	0.533	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-12	-179.2	69	-84.6	16.8	0	0	114.3	R252	R252-Q254 PolarHBondContact O-N 3.36Å; R252-Q254 VanDerWaalsContact O-N 3.07Å
255	D	97.6	Very high	97.3	Very high	42 Å²	42	53.5 Å²	53.5	23%	0.225	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-78.4	153.2	-176.6	-61.3	-24.2	0	0	0	110.3	P250 R252	P250-D255 HydrophobicContact CB-CB 4.05Å; P250-D255 WeakPolarHBondContact CB-O 3.49Å; R252-D255 WeakPolarHBondContact CB-OD2 3.37Å; R252-D255 IonicContact CZ-OD1 2.69Å; R252-D255 IonicContact CZ-OD2 2.77Å; R252-D255 PolarHBondContact N-OD2 3.01Å; R252-D255 VanDerWaalsContact N-OD2 3.14Å; R252-D255 IonicContact NE-OD1 2.9Å; R252-D255 PolarHBondContact NE-OD1 2.94Å; R252-D255 IonicContact NE-OD2 3.66Å; R252-D255 PolarHBondContact NE-OD2 3.34Å; R252-D255 IonicContact NH2-OD1 3.86Å; R252-D255 PolarHBondContact NH2-OD1 3.07Å; R252-D255 IonicContact NH2-OD2 2.86Å; R252-D255 PolarHBondContact O-N 3.45Å
256	D	98.5	Very high	97.1	Very high	65 Å²	65	56.8 Å²	56.8	35%	0.348	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-93.4	165.7	176.3	-71	-24.5	0	0	0	111.1	N275 A277	D256-N275 HydrophobicContact CB-CB 4.11Å; D256-A277 WeakPolarHBondContact OD1-CA 3.41Å; D256-A277 WeakPolarHBondContact OD1-CB 3.37Å
257	Y	98.8	Very high	96.8	Very high	1 Å²	1	62.4 Å²	62.4	0%	0.004	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	145.2	162.7	-73.1	-84.2	0	0	0	109	L224 F225 I246 H249 P250 N275 V276 Q278 V281	L224-Y257 VanDerWaalsContact CA-OH 3.28Å; L224-Y257 WeakPolarHBondContact CA-OH 3.47Å; L224-Y257 WeakPolarHBondContact CD2-OH 3.47Å; F225-Y257 HydrophobicContact CB-CE1 3.99Å; F225-Y257 HydrophobicContact CD2-CE2 4.4Å; F225-Y257 AromaticContact CD2-CZ 4Å; F225-Y257 PolarHBondContact N-OH 2.86Å; I246-Y257 HydrophobicContact CD1-CD1 3.87Å; I246-Y257 HydrophobicContact CD1-CE1 4.33Å; I246-Y257 HydrophobicContact CD1-CG 4.36Å; I246-Y257 HydrophobicContact CG2-CD1 4.16Å; H249-Y257 HydrophobicContact CB-CD1 4.22Å; H249-Y257 HydrophobicContact CB-CE1 3.93Å; P250-Y257 HydrophobicContact CG-CD2 4.38Å; P250-Y257 HydrophobicContact CG-CE2 4.48Å; P250-Y257 HydrophobicContact CG-CG 4.39Å; Y257-N275 CarbonylContact O-C 3.47Å; Y257-N275 VanDerWaalsContact O-CA 3.25Å; Y257-N275 WeakPolarHBondContact O-CA 3.31Å; Y257-V276 WeakPolarHBondContact CB-O 3.32Å; Y257-V276 PolarHBondContact N-O 3.5Å; Y257-V276 PolarHBondContact O-N 3.46Å; Y257-Q278 HydrophobicContact CD2-CB 4.47Å; Y257-Q278 HydrophobicContact CD2-CG 4.11Å; Y257-Q278 HydrophobicContact CE2-CB 4.01Å; Y257-Q278 HydrophobicContact CE2-CG 3.67Å; Y257-V281 HydrophobicContact CD2-CB 4.15Å; Y257-V281 HydrophobicContact CD2-CG2 3.81Å; Y257-V281 HydrophobicContact CE2-CB 4.35Å; Y257-V281 HydrophobicContact CE2-CG2 4.49Å; Y257-V281 HydrophobicContact CG-CG2 4.33Å
258	S	98.8	Very high	96.5	Very high	11 Å²	11	65 Å²	65	8%	0.077	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	130.4	159.7	-162.8	0	0	0	0	108.5	H247 T248 P273 L274	H247-S258 WeakPolarHBondContact CA-O 3.33Å; H247-S258 WeakPolarHBondContact CB-O 3.45Å; H247-S258 PolarHBondContact N-O 2.88Å; T248-S258 PolarHBondContact N-O 3.46Å; T248-S258 VanDerWaalsContact N-O 3.13Å; T248-S258 PolarHBondContact O-N 2.8Å; T248-S258 WeakPolarHBondContact OG1-CB 3.27Å; S258-P273 VanDerWaalsContact OG-CB 3.24Å; S258-P273 WeakPolarHBondContact OG-CB 3.48Å; S258-L274 CarbonylContact C-O 3.57Å; S258-L274 WeakPolarHBondContact CA-O 3.47Å
259	V	98.8	Very high	96.4	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	153.8	-175.2	-54.1	0	0	0	0	111.9	A233 A244 L245 I246 F261 P273 L274 V276	A233-V259 HydrophobicContact CB-CG2 4.29Å; A244-V259 HydrophobicContact CB-CB 4.02Å; A244-V259 HydrophobicContact CB-CG2 4.12Å; L245-V259 CarbonylContact O-C 3.58Å; L245-V259 VanDerWaalsContact O-CA 3.26Å; L245-V259 WeakPolarHBondContact O-CA 2.84Å; I246-V259 HydrophobicContact CD1-CG1 3.83Å; V259-F261 HydrophobicContact CG2-CD2 3.95Å; V259-F261 HydrophobicContact CG2-CE2 3.43Å; V259-F261 VanDerWaalsContact CG2-CE2 3.43Å; V259-F261 HydrophobicContact CG2-CZ 3.82Å; V259-P273 WeakPolarHBondContact O-CA 3.18Å; V259-L274 PolarHBondContact N-O 2.92Å; V259-L274 PolarHBondContact O-N 3.42Å; V259-V276 HydrophobicContact CG2-CG2 3.72Å
260	L	98.6	Very high	96.5	Very high	34 Å²	34	62.5 Å²	62.5	18%	0.178	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	109	173.5	-50	176	0	0	0	108.1	A244 L245 H247 Y270 S271 P273	A244-L260 CarbonylContact C-O 3.49Å; A244-L260 WeakPolarHBondContact CA-O 3.35Å; A244-L260 WeakPolarHBondContact CB-O 3.41Å; L245-L260 PolarHBondContact N-O 3.02Å; L245-L260 PolarHBondContact O-N 2.95Å; H247-L260 HydrophobicContact CB-CD2 4.19Å; H247-L260 HydrophobicContact CB-CG 4.05Å; L260-Y270 HydrophobicContact CB-CD1 4.07Å; L260-Y270 HydrophobicContact CB-CG 4.47Å; L260-S271 WeakPolarHBondContact CD2-O 3.3Å; L260-P273 HydrophobicContact CD2-CB 4.17Å; L260-P273 HydrophobicContact CD2-CG 3.86Å
261	F	98.6	Very high	96.5	Very high	3 Å²	3	62.7 Å²	62.7	1%	0.013	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	141.7	178.4	-73.5	-85	0	0	0	110.8	A233 Y235 A244 V259 D263 Y270 S271 L274 V276	A233-F261 HydrophobicContact CB-CE1 3.75Å; A233-F261 HydrophobicContact CB-CZ 3.76Å; A233-F261 WeakPolarHBondContact O-CE1 3.46Å; Y235-F261 HydrophobicContact CD2-CB 4.44Å; Y235-F261 AromaticContact CD2-CD1 3.86Å; Y235-F261 HydrophobicContact CD2-CD1 3.86Å; Y235-F261 AromaticContact CD2-CD2 3.77Å; Y235-F261 HydrophobicContact CD2-CD2 3.77Å; Y235-F261 AromaticContact CD2-CE1 3.95Å; Y235-F261 HydrophobicContact CD2-CE1 3.95Å; Y235-F261 AromaticContact CD2-CE2 3.85Å; Y235-F261 HydrophobicContact CD2-CE2 3.85Å; Y235-F261 AromaticContact CD2-CG 3.75Å; Y235-F261 HydrophobicContact CD2-CG 3.75Å; Y235-F261 AromaticContact CD2-CZ 3.93Å; Y235-F261 HydrophobicContact CD2-CZ 3.93Å; Y235-F261 HydrophobicContact CE2-CB 4.33Å; Y235-F261 AromaticContact CE2-CD2 3.91Å; Y235-F261 HydrophobicContact CE2-CD2 3.91Å; Y235-F261 HydrophobicContact CE2-CE2 4.33Å; Y235-F261 HydrophobicContact CE2-CG 4.01Å; A244-F261 HydrophobicContact CB-CD1 3.8Å; A244-F261 HydrophobicContact CB-CE1 4.08Å; A244-F261 HydrophobicContact CB-CG 4.16Å; V259-F261 HydrophobicContact CG2-CD2 3.95Å; V259-F261 HydrophobicContact CG2-CE2 3.43Å; V259-F261 VanDerWaalsContact CG2-CE2 3.43Å; V259-F261 HydrophobicContact CG2-CZ 3.82Å; F261-D263 PolarHBondContact O-N 3.04Å; F261-Y270 CarbonylContact O-C 3.51Å; F261-Y270 VanDerWaalsContact O-CA 3.23Å; F261-Y270 WeakPolarHBondContact O-CA 3.42Å; F261-S271 PolarHBondContact N-OG 3.1Å; F261-S271 PolarHBondContact O-N 2.62Å; F261-L274 HydrophobicContact CD2-CB 4.4Å; F261-L274 HydrophobicContact CD2-CD1 3.89Å; F261-L274 HydrophobicContact CE2-CB 4.14Å; F261-L274 HydrophobicContact CE2-CD1 4.08Å; F261-V276 HydrophobicContact CE2-CG2 4.18Å; F261-V276 HydrophobicContact CZ-CG2 3.99Å
262	E	97.5	Very high	96.6	Very high	69 Å²	69	59.9 Å²	59.9	32%	0.322	34%	0.336	S	S	.	.	B	Isolated β-bridge	trans	-64.7	116.4	168	-70.2	179.3	178.4	0	0	108.5	R243 Y270	R243-E262 HydrophobicContact CB-CB 4.42Å; R243-E262 HydrophobicContact CB-CG 4.17Å; R243-E262 WeakPolarHBondContact CB-OE2 3.43Å; R243-E262 WeakPolarHBondContact CD-OE2 3.47Å; R243-E262 IonicContact CZ-OE1 3.99Å; R243-E262 IonicContact CZ-OE2 3.59Å; R243-E262 IonicContact NE-OE1 3.81Å; R243-E262 PolarHBondContact NE-OE1 3.25Å; R243-E262 IonicContact NE-OE2 3.23Å; R243-E262 PolarHBondContact NE-OE2 2.88Å; R243-E262 IonicContact NH2-OE1 2.68Å; R243-E262 PolarHBondContact NH2-OE1 3.18Å; R243-E262 IonicContact NH2-OE2 2.76Å; R243-E262 PolarHBondContact O-N 3.42Å; E262-Y270 HydrophobicContact CB-CE1 4.44Å; E262-Y270 HydrophobicContact CG-CD1 4.33Å; E262-Y270 HydrophobicContact CG-CE1 3.57Å
263	D	95.4	Very high	96.6	Very high	40 Å²	40	56.9 Å²	56.9	21%	0.214	33%	0.333	C	S	.	.			trans	-147.8	109.7	-176.4	-175.5	-20.8	0	0	0	110.4	F261 S265 Y266 G269	F261-D263 PolarHBondContact O-N 3.04Å; D263-S265 VanDerWaalsContact CG-OG 3.26Å; D263-S265 PolarHBondContact O-N 3.23Å; D263-S265 VanDerWaalsContact OD1-CB 3.24Å; D263-S265 WeakPolarHBondContact OD1-CB 3.49Å; D263-S265 PolarHBondContact OD1-N 2.92Å; D263-S265 PolarHBondContact OD1-OG 3.37Å; D263-S265 PolarHBondContact OD2-OG 3.28Å; D263-Y266 HydrophobicContact CB-CD2 3.77Å; D263-Y266 HydrophobicContact CB-CE2 4.14Å; D263-Y266 PolarHBondContact O-N 3.37Å; D263-Y266 WeakPolarHBondContact OD2-CE2 3.36Å; D263-G269 PolarHBondContact N-O 2.82Å; D263-G269 CarbonylContact O-C 3.52Å; D263-G269 VanDerWaalsContact O-CA 3.32Å; D263-G269 WeakPolarHBondContact O-CA 3.37Å
264	T	94.1	Very high	96.8	Very high	148 Å²	148	57.9 Å²	57.9	91%	0.908	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-7.1	-176.2	54.2	0	0	0	0	114.1	Y266	T264-Y266 VanDerWaalsContact C-N 3.25Å
265	S	95.3	Very high	97	Very high	92 Å²	92	57.7 Å²	57.7	64%	0.643	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-19.9	172.9	71.4	0	0	0	0	112.5	D263	D263-S265 VanDerWaalsContact CG-OG 3.26Å; D263-S265 PolarHBondContact O-N 3.23Å; D263-S265 VanDerWaalsContact OD1-CB 3.24Å; D263-S265 WeakPolarHBondContact OD1-CB 3.49Å; D263-S265 PolarHBondContact OD1-N 2.92Å; D263-S265 PolarHBondContact OD1-OG 3.37Å; D263-S265 PolarHBondContact OD2-OG 3.28Å
266	Y	94.3	Very high	97.1	Very high	97 Å²	97	56 Å²	56	38%	0.38	33%	0.331	S	S	.	.	S	Bend	trans	-91.7	147.2	174.7	-64.1	-84.4	0	0	0	111.7	D263 T264 D268 G269 Y270 P272	D263-Y266 HydrophobicContact CB-CD2 3.77Å; D263-Y266 HydrophobicContact CB-CE2 4.14Å; D263-Y266 PolarHBondContact O-N 3.37Å; D263-Y266 WeakPolarHBondContact OD2-CE2 3.36Å; T264-Y266 VanDerWaalsContact C-N 3.25Å; Y266-D268 VanDerWaalsContact C-N 3.3Å; Y266-D268 PolarHBondContact O-N 3.37Å; Y266-G269 PolarHBondContact O-N 3.35Å; Y266-Y270 VanDerWaalsContact CB-O 3.27Å; Y266-Y270 WeakPolarHBondContact CB-O 3.31Å; Y266-Y270 WeakPolarHBondContact CD2-O 3.47Å; Y266-Y270 VanDerWaalsContact CG-O 3.25Å; Y266-P272 HydrophobicContact CE1-CG 4.23Å; Y266-P272 VanDerWaalsContact CZ-CD 3.47Å; Y266-P272 WeakPolarHBondContact OH-CD 3.49Å
267	A	92	Very high	97.1	Very high	118 Å²	118	53.5 Å²	53.5	98%	0.975	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-32.2	-175.1	0	0	0	0	0	113.7	G269	A267-G269 VanDerWaalsContact C-N 3.34Å
268	D	93	Very high	97.1	Very high	119 Å²	119	53.6 Å²	53.6	64%	0.636	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-1.1	174.9	61	-7.5	0	0	0	112.8	Y266 Y270	Y266-D268 VanDerWaalsContact C-N 3.3Å; Y266-D268 PolarHBondContact O-N 3.37Å; D268-Y270 VanDerWaalsContact C-N 3.31Å; D268-Y270 WeakPolarHBondContact O-CD2 3.32Å; D268-Y270 PolarHBondContact OD1-N 3.19Å
269	G	96.5	Very high	97.1	Very high	25 Å²	25	54.9 Å²	54.9	26%	0.258	32%	0.322	S	S	.	.	S	Bend	trans	76.1	13.8	179.7	0	0	0	0	0	114.5	D263 Y266 A267	D263-G269 PolarHBondContact N-O 2.82Å; D263-G269 CarbonylContact O-C 3.52Å; D263-G269 VanDerWaalsContact O-CA 3.32Å; D263-G269 WeakPolarHBondContact O-CA 3.37Å; Y266-G269 PolarHBondContact O-N 3.35Å; A267-G269 VanDerWaalsContact C-N 3.34Å
270	Y	97.7	Very high	97.1	Very high	49 Å²	49	55.6 Å²	55.6	19%	0.192	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-133.2	144.6	-178.3	-72.2	-79.2	0	0	0	112.9	L245 L260 F261 E262 Y266 D268 K288	L245-Y270 HydrophobicContact CD1-CD1 4.36Å; L245-Y270 HydrophobicContact CD1-CE1 3.59Å; L245-Y270 HydrophobicContact CD1-CE2 4.29Å; L245-Y270 HydrophobicContact CG-CE1 3.81Å; L260-Y270 HydrophobicContact CB-CD1 4.07Å; L260-Y270 HydrophobicContact CB-CG 4.47Å; F261-Y270 CarbonylContact O-C 3.51Å; F261-Y270 VanDerWaalsContact O-CA 3.23Å; F261-Y270 WeakPolarHBondContact O-CA 3.42Å; E262-Y270 HydrophobicContact CB-CE1 4.44Å; E262-Y270 HydrophobicContact CG-CD1 4.33Å; E262-Y270 HydrophobicContact CG-CE1 3.57Å; Y266-Y270 VanDerWaalsContact CB-O 3.27Å; Y266-Y270 WeakPolarHBondContact CB-O 3.31Å; Y266-Y270 WeakPolarHBondContact CD2-O 3.47Å; Y266-Y270 VanDerWaalsContact CG-O 3.25Å; D268-Y270 VanDerWaalsContact C-N 3.31Å; D268-Y270 WeakPolarHBondContact O-CD2 3.32Å; D268-Y270 PolarHBondContact OD1-N 3.19Å; Y270-K288 PolarHBondContact OH-NZ 3.03Å
271	S	98.1	Very high	97.1	Very high	5 Å²	5	54 Å²	54	4%	0.035	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-66.5	161.3	172	77.9	0	0	0	0	111.7	L260 F261	L260-S271 WeakPolarHBondContact CD2-O 3.3Å; F261-S271 PolarHBondContact N-OG 3.1Å; F261-S271 PolarHBondContact O-N 2.62Å
272	P	98.1	Very high	97.1	Very high	67 Å²	67	54 Å²	54	44%	0.435	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-54.7	162.2	159.2	-22.5	33.2	0	0	0	111.4	Y266 L274	Y266-P272 HydrophobicContact CE1-CG 4.23Å; Y266-P272 VanDerWaalsContact CZ-CD 3.47Å; Y266-P272 WeakPolarHBondContact OH-CD 3.49Å; P272-L274 PolarHBondContact O-N 2.83Å
273	P	98.4	Very high	97.1	Very high	67 Å²	67	52.8 Å²	52.8	44%	0.435	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-58.6	121.5	174.8	-19.3	29.2	0	0	0	111.9	S258 V259 L260	S258-P273 VanDerWaalsContact OG-CB 3.24Å; S258-P273 WeakPolarHBondContact OG-CB 3.48Å; V259-P273 WeakPolarHBondContact O-CA 3.18Å; L260-P273 HydrophobicContact CD2-CB 4.17Å; L260-P273 HydrophobicContact CD2-CG 3.86Å
274	L	98.6	Very high	97	Very high	50 Å²	50	52 Å²	52	26%	0.262	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	143.1	177	-64.2	-179.4	0	0	0	110.5	Y235 P236 S258 V259 F261 P272	Y235-L274 HydrophobicContact CE2-CD1 4.01Å; P236-L274 HydrophobicContact CG-CB 4.3Å; P236-L274 HydrophobicContact CG-CD1 4.13Å; S258-L274 CarbonylContact C-O 3.57Å; S258-L274 WeakPolarHBondContact CA-O 3.47Å; V259-L274 PolarHBondContact N-O 2.92Å; V259-L274 PolarHBondContact O-N 3.42Å; F261-L274 HydrophobicContact CD2-CB 4.4Å; F261-L274 HydrophobicContact CD2-CD1 3.89Å; F261-L274 HydrophobicContact CE2-CB 4.14Å; F261-L274 HydrophobicContact CE2-CD1 4.08Å; P272-L274 PolarHBondContact O-N 2.83Å
275	N	98.6	Very high	96.2	Very high	110 Å²	110	51.8 Å²	51.8	59%	0.588	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	132	-178.8	-68.7	-14.4	0	0	0	111.5	D256 Y257	D256-N275 HydrophobicContact CB-CB 4.11Å; Y257-N275 CarbonylContact O-C 3.47Å; Y257-N275 VanDerWaalsContact O-CA 3.25Å; Y257-N275 WeakPolarHBondContact O-CA 3.31Å
276	V	98.8	Very high	94.8	Very high	7 Å²	7	50.5 Å²	50.5	4%	0.042	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	122.2	176.2	-173	0	0	0	0	109.5	A233 Y257 V259 F261 V281	A233-V276 HydrophobicContact CB-CG1 4.3Å; A233-V276 HydrophobicContact CB-CG2 4.32Å; Y257-V276 WeakPolarHBondContact CB-O 3.32Å; Y257-V276 PolarHBondContact N-O 3.5Å; Y257-V276 PolarHBondContact O-N 3.46Å; V259-V276 HydrophobicContact CG2-CG2 3.72Å; F261-V276 HydrophobicContact CE2-CG2 4.18Å; F261-V276 HydrophobicContact CZ-CG2 3.99Å; V276-V281 HydrophobicContact CB-CG2 3.92Å; V276-V281 HydrophobicContact CG1-CG2 3.61Å
277	A	98.7	Very high	92.7	Very high	11 Å²	11	53.1 Å²	53.1	9%	0.091	31%	0.307	C	S	.	.			trans	-61.2	149.1	179.4	0	0	0	0	0	112.2	A124 D256 R279 Y280	A124-A277 HydrophobicContact CB-CB 3.59Å; D256-A277 WeakPolarHBondContact OD1-CA 3.41Å; D256-A277 WeakPolarHBondContact OD1-CB 3.37Å; A277-R279 PolarHBondContact O-N 3.33Å; A277-Y280 HydrophobicContact CB-CD2 4.37Å; A277-Y280 PolarHBondContact O-N 3.44Å
278	Q	98.8	Very high	90.6	Very high	4 Å²	4	52.9 Å²	52.9	2%	0.019	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-51.4	-35.4	-178.7	-57	-167.9	27.5	0	0	113.4	K214 A215 P250 Y257 Y280 V281	K214-Q278 HydrophobicContact CG-CB 4.4Å; A215-Q278 PolarHBondContact O-NE2 3.5Å; A215-Q278 PolarHBondContact O-OE1 3.13Å; P250-Q278 HydrophobicContact CG-CG 4.18Å; Y257-Q278 HydrophobicContact CD2-CB 4.47Å; Y257-Q278 HydrophobicContact CD2-CG 4.11Å; Y257-Q278 HydrophobicContact CE2-CB 4.01Å; Y257-Q278 HydrophobicContact CE2-CG 3.67Å; Q278-Y280 PolarHBondContact O-N 3.25Å; Q278-Y280 VanDerWaalsContact O-N 3.1Å; Q278-V281 PolarHBondContact O-N 3.14Å
279	R	98.6	Very high	88.2	Confident	37 Å²	37	57.3 Å²	57.3	14%	0.14	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-53.4	-32.3	176.8	-173.7	164.4	-177.5	71.3	-7.6	112.9	S123 A124 L127 L210 P211 A277	S123-R279 VanDerWaalsContact O-CD 3.31Å; S123-R279 WeakPolarHBondContact O-CD 3.01Å; S123-R279 PolarHBondContact OG-NE 3.13Å; S123-R279 PolarHBondContact OG-NH2 3.36Å; A124-R279 HydrophobicContact CB-CB 4.17Å; L127-R279 HydrophobicContact CD2-CB 3.7Å; L127-R279 HydrophobicContact CD2-CG 4.19Å; L210-R279 HydrophobicContact CD2-CG 4.07Å; L210-R279 WeakPolarHBondContact CD2-O 3.45Å; L210-R279 VanDerWaalsContact CG-O 3.31Å; L210-R279 WeakPolarHBondContact CG-O 3.46Å; P211-R279 WeakPolarHBondContact CD-O 3.33Å; P211-R279 PolarHBondContact O-NH1 2.9Å; A277-R279 PolarHBondContact O-N 3.33Å
280	Y	98.8	Very high	85.3	Confident	15 Å²	15	69.1 Å²	69.1	6%	0.059	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-111.7	18.3	-169.3	-60.8	-49	0	0	0	113.4	L120 A124 L174 L210 A233 L234 F241 A277 Q278	L120-Y280 WeakPolarHBondContact CA-OH 3.43Å; L120-Y280 HydrophobicContact CB-CE2 4.49Å; L120-Y280 WeakPolarHBondContact O-CE2 3.42Å; L120-Y280 PolarHBondContact O-OH 3.3Å; A124-Y280 HydrophobicContact CB-CD2 4.11Å; A124-Y280 HydrophobicContact CB-CE2 3.55Å; L174-Y280 HydrophobicContact CD2-CE1 4.03Å; L210-Y280 HydrophobicContact CD2-CD1 3.71Å; L210-Y280 HydrophobicContact CD2-CE1 3.9Å; A233-Y280 WeakPolarHBondContact CA-O 3.46Å; L234-Y280 HydrophobicContact CB-CG 4.21Å; L234-Y280 HydrophobicContact CD2-CD1 3.94Å; L234-Y280 HydrophobicContact CD2-CD2 4.15Å; L234-Y280 HydrophobicContact CD2-CE1 4.37Å; L234-Y280 HydrophobicContact CD2-CG 3.86Å; L234-Y280 PolarHBondContact N-O 2.88Å; F241-Y280 WeakPolarHBondContact CE1-O 3.2Å; A277-Y280 HydrophobicContact CB-CD2 4.37Å; A277-Y280 PolarHBondContact O-N 3.44Å; Q278-Y280 PolarHBondContact O-N 3.25Å; Q278-Y280 VanDerWaalsContact O-N 3.1Å
281	V	98.8	Very high	84.6	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	123.9	171.7	-174.7	0	0	0	0	108.1	F225 V231 L232 A233 I246 Y257 V276 Q278	F225-V281 HydrophobicContact CD2-CB 4.44Å; F225-V281 HydrophobicContact CD2-CG1 3.68Å; F225-V281 HydrophobicContact CE2-CB 4.39Å; F225-V281 HydrophobicContact CE2-CG1 3.83Å; V231-V281 HydrophobicContact CB-CG1 3.8Å; V231-V281 HydrophobicContact CG1-CG1 4Å; V231-V281 HydrophobicContact CG2-CG1 3.76Å; L232-V281 WeakPolarHBondContact O-CA 3.36Å; A233-V281 HydrophobicContact CB-CG2 4.27Å; I246-V281 HydrophobicContact CD1-CG1 4.17Å; Y257-V281 HydrophobicContact CD2-CB 4.15Å; Y257-V281 HydrophobicContact CD2-CG2 3.81Å; Y257-V281 HydrophobicContact CE2-CB 4.35Å; Y257-V281 HydrophobicContact CE2-CG2 4.49Å; Y257-V281 HydrophobicContact CG-CG2 4.33Å; V276-V281 HydrophobicContact CB-CG2 3.92Å; V276-V281 HydrophobicContact CG1-CG2 3.61Å; Q278-V281 PolarHBondContact O-N 3.14Å
282	V	98.6	Very high	83.9	Confident	5 Å²	5	73.6 Å²	73.6	3%	0.03	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	160.1	-178.7	-59.6	0	0	0	0	111.1	A160 I208 V231 L232 C284	A160-V282 HydrophobicContact CB-CG2 4.28Å; I208-V282 HydrophobicContact CD1-CG2 4.44Å; I208-V282 HydrophobicContact CG2-CB 3.84Å; I208-V282 HydrophobicContact CG2-CG1 4.25Å; I208-V282 HydrophobicContact CG2-CG2 3.97Å; V231-V282 WeakPolarHBondContact CB-O 3.49Å; L232-V282 HydrophobicContact CB-CG2 3.83Å; L232-V282 PolarHBondContact N-O 3.39Å; L232-V282 PolarHBondContact O-N 2.96Å; V282-C284 PolarHBondContact O-N 3.19Å
283	A	96.9	Very high	83.2	Confident	43 Å²	43	73.9 Å²	73.9	36%	0.355	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	131.1	-179.1	0	0	0	0	0	111.7	F225 K285	F225-A283 HydrophobicContact CE1-CB 4.21Å; F225-A283 HydrophobicContact CZ-CB 4.35Å; A283-K285 PolarHBondContact O-N 2.82Å
284	C	94	Very high	82.3	Confident	22 Å²	22	74.4 Å²	74.4	15%	0.149	36%	0.358	C	S	.	.			trans	-80.3	109.7	170.4	-169.3	0	0	0	0	109.2	L230 L232 V282 E286	L230-C284 HydrophobicContact CD2-CB 4.19Å; L230-C284 HydrophobicContact CG-CB 3.9Å; L232-C284 HydrophobicContact CG-CB 4.22Å; V282-C284 PolarHBondContact O-N 3.19Å; C284-E286 PolarHBondContact O-N 3.17Å
285	K	76.6	Confident	81.2	Confident	144 Å²	144	75.9 Å²	75.9	63%	0.626	36%	0.364	S	S	*	.			trans	-79.8	1.6	178.1	-67.1	-177.2	179.1	176.9	0	113.6	A283	A283-K285 PolarHBondContact O-N 2.82Å
286	E	67.6	Low	80.1	Confident	65 Å²	65	73.6 Å²	73.6	30%	0.304	35%	0.349	S	S	.	.	S	Bend	trans	-101.9	112.1	-176.4	-66.4	178.6	-175.7	0	0	110	R162 R243 C284 K288	R162-E286 IonicContact CZ-OE1 3.23Å; R162-E286 IonicContact NH1-OE1 3.03Å; R162-E286 PolarHBondContact NH1-OE1 2.94Å; R243-E286 PolarHBondContact NH1-O 2.73Å; C284-E286 PolarHBondContact O-N 3.17Å; E286-K288 PolarHBondContact O-N 3.43Å
287	N	50.4	Low	78.7	Confident	153 Å²	153	78.4 Å²	78.4	82%	0.818	37%	0.371	S	S	*	.			trans	-57.3	134.5	168.6	-73.9	-16.2	0	0	0	108.6	K289	N287-K289 PolarHBondContact O-N 3Å
288	K	46.9	Very low	77.2	Confident	112 Å²	112	83.5 Å²	83.5	49%	0.487	39%	0.392	S	S	.	.			trans	-46.4	120.2	163.3	-87.8	-175.6	171.9	-176.8	0	106.4	L230 R243 Y270 E286 K290	L230-K288 HydrophobicContact CD2-CG 4.46Å; R243-K288 VanDerWaalsContact NH2-CG 3.34Å; Y270-K288 PolarHBondContact OH-NZ 3.03Å; E286-K288 PolarHBondContact O-N 3.43Å; K288-K290 VanDerWaalsContact C-N 3.34Å; K288-K290 PolarHBondContact O-N 3.05Å
289	K	42.7	Very low	75.4	Confident	212 Å²	212	90.2 Å²	90.2	92%	0.922	42%	0.423	S	S	*	.			trans	-55.6	108.9	163.1	-81.2	-179.6	176.2	175.7	0	104.9	N287	N287-K289 PolarHBondContact O-N 3Å
290	K	34.9	Very low	73.3	Confident	274 Å²	274	95 Å²	95	100%	1.191	45%	0.449	S	S	*	.			trans	-67.6	0	164	-81.6	-171.9	175	-176.3	0	108.5	K288	K288-K290 VanDerWaalsContact C-N 3.34Å; K288-K290 PolarHBondContact O-N 3.05Å

Retrieved 290 of 290 residues in 1672.6 ms (Link to these results)

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