A0A087YI78_POEFO Loading...

Interferon regulatory factor 8

AlphaFold DB (A0A3B3TL26), UniProt , Accession A0A087YI78, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 422 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	34.1	Very low	59.1	Low	247 Å²	247	107.1 Å²	107.1	100%	1.217	60%	0.603	S	S	*	*				0	98.4	0	-62.1	170.7	91.1	0	0	107.2
2	S	33.6	Very low	62.1	Low	104 Å²	104	98.9 Å²	98.9	73%	0.727	56%	0.556	S	S	*	*			trans	-95.1	121.9	-178.9	43.5	0	0	0	0	110.2	S4	S2-S4 PolarHBondContact O-N 3.23Å; S2-S4 PolarHBondContact O-OG 3.12Å
3	N	34	Very low	64.6	Low	168 Å²	168	91.4 Å²	91.4	90%	0.898	51%	0.513	S	S	*	.			trans	-60.5	111.5	-178.2	-151.3	2.3	0	0	0	110.1	G5	N3-G5 VanDerWaalsContact C-N 3.32Å; N3-G5 PolarHBondContact O-N 2.9Å
4	S	43.2	Very low	66.6	Low	58 Å²	58	89.4 Å²	89.4	41%	0.406	50%	0.499	S	S	.	.			trans	-92.9	16.3	-172.2	-17.5	0	0	0	0	113.4	S2 G6	S2-S4 PolarHBondContact O-N 3.23Å; S2-S4 PolarHBondContact O-OG 3.12Å; S4-G6 PolarHBondContact O-N 3.43Å
5	G	40.3	Very low	68.4	Low	78 Å²	78	87.9 Å²	87.9	80%	0.804	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	87	-178.5	0	0	0	0	0	111.8	N3	N3-G5 VanDerWaalsContact C-N 3.32Å; N3-G5 PolarHBondContact O-N 2.9Å
6	G	48.9	Very low	70.1	Confident	72 Å²	72	84.2 Å²	84.2	74%	0.742	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	144.4	-6.6	169	0	0	0	0	0	116.4	S4 R8	S4-G6 PolarHBondContact O-N 3.43Å; G6-R8 PolarHBondContact O-N 3.5Å
7	R	59.9	Low	71.5	Confident	116 Å²	116	79.7 Å²	79.7	44%	0.438	44%	0.44	S	S	.	.			trans	-69.5	126.5	179.6	-80.4	-174.3	-168.3	-171.7	4.9	111.1	E15 F62	R7-E15 IonicContact NH1-OE1 3.9Å; R7-E15 IonicContact NH1-OE2 3.64Å; R7-E15 PolarHBondContact NH1-OE2 2.91Å; R7-F62 HydrophobicContact CB-CE1 4.41Å; R7-F62 HydrophobicContact CB-CE2 4.1Å; R7-F62 HydrophobicContact CB-CZ 3.43Å; R7-F62 VanDerWaalsContact CB-CZ 3.43Å; R7-F62 HydrophobicContact CG-CZ 4.44Å
8	R	82.9	Confident	72.7	Confident	175 Å²	175	82.8 Å²	82.8	66%	0.66	45%	0.451	S	S	*	.			trans	-66.6	147.8	178.7	-67	178.6	113.7	-171	0.6	110.7	G6 K10 Q11 W12	G6-R8 PolarHBondContact O-N 3.5Å; R8-K10 VanDerWaalsContact C-N 3.26Å; R8-K10 PolarHBondContact O-N 3.01Å; R8-Q11 PolarHBondContact O-N 3.26Å; R8-W12 PolarHBondContact O-N 3.21Å
9	L	91.2	Very high	73.7	Confident	19 Å²	19	80.8 Å²	80.8	10%	0.099	44%	0.443	C	S	.	.	H	α-helix	trans	-51.9	-43.1	-179.4	174	66	0	0	0	112.1	W12 L13 W59 L81 A84 L85 F91	L9-W12 HydrophobicContact CD1-CE3 4.45Å; L9-W12 PolarHBondContact O-N 3.43Å; L9-L13 WeakPolarHBondContact O-CB 3.42Å; L9-L13 PolarHBondContact O-N 2.82Å; L9-W59 HydrophobicContact CB-CH2 3.9Å; L9-W59 HydrophobicContact CB-CZ3 4.47Å; L9-W59 HydrophobicContact CD1-CD2 4.28Å; L9-W59 HydrophobicContact CD1-CE3 3.96Å; L9-W59 HydrophobicContact CD1-CH2 3.35Å; L9-W59 HydrophobicContact CD1-CZ2 3.71Å; L9-W59 HydrophobicContact CD1-CZ3 3.48Å; L9-W59 VanDerWaalsContact CD1-CZ3 3.48Å; L9-W59 HydrophobicContact CG-CH2 4.17Å; L9-L81 HydrophobicContact CD1-CD1 3.79Å; L9-A84 VanDerWaalsContact CD2-C 3.45Å; L9-A84 HydrophobicContact CD2-CB 3.77Å; L9-A84 WeakPolarHBondContact CD2-O 3.44Å; L9-L85 HydrophobicContact CD2-CD2 4.14Å; L9-L85 HydrophobicContact CD2-CG 4.4Å; L9-F91 HydrophobicContact CB-CE2 4.42Å; L9-F91 HydrophobicContact CD2-CD2 4.15Å; L9-F91 HydrophobicContact CD2-CE2 3.7Å; L9-F91 HydrophobicContact CG-CE2 3.72Å; L9-F91 HydrophobicContact CG-CZ 4.38Å
10	K	91.4	Very high	74.6	Confident	49 Å²	49	80.8 Å²	80.8	21%	0.213	45%	0.454	C	S	.	.	H	α-helix	trans	-52.9	-55.9	177	-179.9	173.6	176.6	169.7	0	113.1	R8 W12 L13 M14 D90 F91 I111	R8-K10 VanDerWaalsContact C-N 3.26Å; R8-K10 PolarHBondContact O-N 3.01Å; K10-W12 PolarHBondContact O-N 2.86Å; K10-L13 PolarHBondContact O-N 3.29Å; K10-M14 HydrophobicContact CG-CE 3.95Å; K10-M14 HydrophobicContact CG-SD 4.4Å; K10-M14 WeakPolarHBondContact O-CG 3.35Å; K10-M14 PolarHBondContact O-N 2.9Å; K10-M14 VanDerWaalsContact O-N 3.1Å; K10-D90 HydrophobicContact CB-CB 4.07Å; K10-D90 HydrophobicContact CD-CB 3.84Å; K10-D90 VanDerWaalsContact CD-CG 3.47Å; K10-D90 VanDerWaalsContact CD-OD1 3.27Å; K10-D90 WeakPolarHBondContact CD-OD1 3.26Å; K10-D90 HydrophobicContact CG-CB 4.36Å; K10-D90 IonicContact NZ-OD1 3.63Å; K10-F91 HydrophobicContact CB-CE2 4.35Å; K10-F91 HydrophobicContact CB-CZ 4.1Å; K10-I111 HydrophobicContact CD-CG2 4.35Å
11	Q	90.6	Very high	75.4	Confident	92 Å²	92	83.9 Å²	83.9	43%	0.43	47%	0.465	S	S	.	.	H	α-helix	trans	-61.7	-47.2	-178.7	-176.8	178.2	0.2	0	0	111.7	R8 L13 M14 E15	R8-Q11 PolarHBondContact O-N 3.26Å; Q11-L13 VanDerWaalsContact C-N 3.33Å; Q11-L13 PolarHBondContact O-N 3.41Å; Q11-M14 PolarHBondContact O-N 3.49Å; Q11-E15 PolarHBondContact NE2-OE1 3.09Å; Q11-E15 WeakPolarHBondContact O-CG 3.45Å; Q11-E15 PolarHBondContact O-N 3.19Å; Q11-E15 VanDerWaalsContact O-N 3.11Å
12	W	94.8	Very high	78.2	Confident	9 Å²	9	73.7 Å²	73.7	3%	0.034	41%	0.413	C	S	.	.	H	α-helix	trans	-59.3	-45.2	-179.7	177.4	77.1	0	0	0	112.1	R8 L9 K10 E15 Q16 I55 A58 W59 F62	R8-W12 PolarHBondContact O-N 3.21Å; L9-W12 HydrophobicContact CD1-CE3 4.45Å; L9-W12 PolarHBondContact O-N 3.43Å; K10-W12 PolarHBondContact O-N 2.86Å; W12-E15 WeakPolarHBondContact O-CB 3.4Å; W12-E15 PolarHBondContact O-N 3.45Å; W12-Q16 HydrophobicContact CD2-CG 3.89Å; W12-Q16 HydrophobicContact CE3-CG 4.1Å; W12-Q16 HydrophobicContact CH2-CG 3.77Å; W12-Q16 HydrophobicContact CZ2-CG 3.52Å; W12-Q16 HydrophobicContact CZ3-CG 4.04Å; W12-Q16 WeakPolarHBondContact O-CG 3.38Å; W12-Q16 PolarHBondContact O-N 3.37Å; W12-Q16 PolarHBondContact O-NE2 3.34Å; W12-I55 HydrophobicContact CH2-CD1 3.69Å; W12-I55 HydrophobicContact CZ3-CD1 4.19Å; W12-A58 HydrophobicContact CH2-CB 4.31Å; W12-A58 HydrophobicContact CZ2-CB 3.94Å; W12-W59 HydrophobicContact CB-CZ3 4.46Å; W12-W59 AromaticContact CD2-CE3 3.69Å; W12-W59 HydrophobicContact CD2-CE3 3.69Å; W12-W59 AromaticContact CD2-CZ3 3.92Å; W12-W59 HydrophobicContact CD2-CZ3 3.92Å; W12-W59 HydrophobicContact CE3-CD2 4.42Å; W12-W59 AromaticContact CE3-CE3 3.37Å; W12-W59 HydrophobicContact CE3-CE3 3.37Å; W12-W59 AromaticContact CE3-CZ3 3.73Å; W12-W59 HydrophobicContact CE3-CZ3 3.73Å; W12-W59 HydrophobicContact CG-CE3 4.44Å; W12-W59 HydrophobicContact CG-CZ3 4.26Å; W12-W59 HydrophobicContact CH2-CB 3.6Å; W12-W59 AromaticContact CH2-CE3 3.97Å; W12-W59 HydrophobicContact CH2-CE3 3.97Å; W12-W59 HydrophobicContact CH2-CG 4.45Å; W12-W59 HydrophobicContact CZ2-CB 4.26Å; W12-W59 HydrophobicContact CZ2-CE3 4.25Å; W12-W59 HydrophobicContact CZ3-CB 4.01Å; W12-W59 HydrophobicContact CZ3-CD2 4.2Å; W12-W59 AromaticContact CZ3-CE3 3.52Å; W12-W59 HydrophobicContact CZ3-CE3 3.52Å; W12-W59 HydrophobicContact CZ3-CG 4.44Å; W12-W59 HydrophobicContact CZ3-CZ3 4.32Å; W12-F62 HydrophobicContact CB-CD1 4.48Å; W12-F62 HydrophobicContact CB-CE1 3.8Å; W12-F62 HydrophobicContact CB-CE2 4.28Å; W12-F62 HydrophobicContact CB-CZ 3.62Å; W12-F62 AromaticContact CD1-CD1 3.77Å; W12-F62 AromaticContact CD1-CD2 3.2Å; W12-F62 AromaticContact CD1-CE1 3.73Å; W12-F62 AromaticContact CD1-CE2 3.15Å; W12-F62 AromaticContact CD1-CG 3.46Å; W12-F62 VanDerWaalsContact CD1-CG 3.46Å; W12-F62 AromaticContact CD1-CZ 3.36Å; W12-F62 HydrophobicContact CD2-CD1 4.18Å; W12-F62 HydrophobicContact CD2-CE1 4.37Å; W12-F62 HydrophobicContact CD2-CG 4.31Å; W12-F62 AromaticContact CE2-CG 3.91Å; W12-F62 AromaticContact CG-CD1 3.86Å; W12-F62 HydrophobicContact CG-CD1 3.86Å; W12-F62 HydrophobicContact CG-CD2 4.08Å; W12-F62 AromaticContact CG-CE1 3.65Å; W12-F62 HydrophobicContact CG-CE1 3.65Å; W12-F62 AromaticContact CG-CE2 3.88Å; W12-F62 HydrophobicContact CG-CE2 3.88Å; W12-F62 HydrophobicContact CG-CG 4.02Å; W12-F62 AromaticContact CG-CZ 3.59Å; W12-F62 HydrophobicContact CG-CZ 3.59Å; W12-F62 HydrophobicContact CZ2-CB 4.28Å; W12-F62 AromaticContact NE1-CD1 3.93Å; W12-F62 AromaticContact NE1-CD2 3.32Å; W12-F62 VanDerWaalsContact NE1-CD2 3.32Å; W12-F62 AromaticContact NE1-CE2 3.81Å; W12-F62 AromaticContact NE1-CG 3.33Å; W12-F62 VanDerWaalsContact NE1-CG 3.33Å
13	L	95.2	Very high	80.9	Confident	1 Å²	1	73 Å²	73	1%	0.005	41%	0.409	C	S	.	.	H	α-helix	trans	-68.3	-38.9	-176.9	-165.1	65.8	0	0	0	111.8	L9 K10 Q11 E15 Q16 I17 F35 L85 F91	L9-L13 WeakPolarHBondContact O-CB 3.42Å; L9-L13 PolarHBondContact O-N 2.82Å; K10-L13 PolarHBondContact O-N 3.29Å; Q11-L13 VanDerWaalsContact C-N 3.33Å; Q11-L13 PolarHBondContact O-N 3.41Å; L13-E15 VanDerWaalsContact C-N 3.35Å; L13-E15 PolarHBondContact O-N 3.48Å; L13-Q16 PolarHBondContact O-N 3.41Å; L13-Q16 VanDerWaalsContact O-N 3.16Å; L13-I17 HydrophobicContact CG-CD1 4.31Å; L13-I17 WeakPolarHBondContact O-CD1 3.45Å; L13-I17 VanDerWaalsContact O-CG1 3.26Å; L13-I17 WeakPolarHBondContact O-CG1 3.47Å; L13-I17 PolarHBondContact O-N 3.47Å; L13-F35 HydrophobicContact CD2-CE1 4.33Å; L13-F35 HydrophobicContact CD2-CE2 3.45Å; L13-F35 VanDerWaalsContact CD2-CE2 3.45Å; L13-F35 HydrophobicContact CD2-CZ 3.34Å; L13-F35 HydrophobicContact CG-CE2 4.19Å; L13-F35 HydrophobicContact CG-CZ 4.35Å; L13-L85 HydrophobicContact CD2-CD2 3.86Å; L13-F91 HydrophobicContact CB-CZ 4.43Å; L13-F91 HydrophobicContact CD2-CE1 3.97Å; L13-F91 HydrophobicContact CD2-CZ 3.75Å
14	M	92.4	Very high	83.6	Confident	64 Å²	64	66.3 Å²	66.3	32%	0.315	38%	0.38	S	S	.	.	H	α-helix	trans	-60.4	-43.2	173.5	-70.5	-173.2	-58.5	0	0	112.1	K10 Q11 Q16 I17 Q18 W27 I111	K10-M14 HydrophobicContact CG-CE 3.95Å; K10-M14 HydrophobicContact CG-SD 4.4Å; K10-M14 WeakPolarHBondContact O-CG 3.35Å; K10-M14 PolarHBondContact O-N 2.9Å; K10-M14 VanDerWaalsContact O-N 3.1Å; Q11-M14 PolarHBondContact O-N 3.49Å; M14-Q16 VanDerWaalsContact C-N 3.31Å; M14-Q16 PolarHBondContact O-N 3.01Å; M14-I17 PolarHBondContact O-N 3.25Å; M14-Q18 WeakPolarHBondContact O-CB 3.44Å; M14-Q18 PolarHBondContact O-N 3.47Å; M14-W27 HydrophobicContact CG-CH2 4.07Å; M14-W27 HydrophobicContact CG-CZ2 4.35Å; M14-I111 HydrophobicContact CG-CD1 4.18Å; M14-I111 HydrophobicContact SD-CD1 4.11Å
15	E	93.1	Very high	86.2	Confident	67 Å²	67	64 Å²	64	31%	0.313	36%	0.362	S	S	.	.	H	α-helix	trans	-60.4	-41.4	174.1	-70.4	171.1	-172.7	0	0	111.1	R7 Q11 W12 L13 Q18 S19	R7-E15 IonicContact NH1-OE1 3.9Å; R7-E15 IonicContact NH1-OE2 3.64Å; R7-E15 PolarHBondContact NH1-OE2 2.91Å; Q11-E15 PolarHBondContact NE2-OE1 3.09Å; Q11-E15 WeakPolarHBondContact O-CG 3.45Å; Q11-E15 PolarHBondContact O-N 3.19Å; Q11-E15 VanDerWaalsContact O-N 3.11Å; W12-E15 WeakPolarHBondContact O-CB 3.4Å; W12-E15 PolarHBondContact O-N 3.45Å; L13-E15 VanDerWaalsContact C-N 3.35Å; L13-E15 PolarHBondContact O-N 3.48Å; E15-Q18 PolarHBondContact O-N 3.1Å; E15-S19 WeakPolarHBondContact O-CB 3.42Å; E15-S19 PolarHBondContact O-N 3.22Å
16	Q	95.5	Very high	88.8	Confident	28 Å²	28	64.2 Å²	64.2	13%	0.131	34%	0.342	C	S	.	.	H	α-helix	trans	-66.5	-40.8	178.2	-62.5	-32.7	-80.7	0	0	112.2	W12 L13 M14 S19 Y22 L25 I55	W12-Q16 HydrophobicContact CD2-CG 3.89Å; W12-Q16 HydrophobicContact CE3-CG 4.1Å; W12-Q16 HydrophobicContact CH2-CG 3.77Å; W12-Q16 HydrophobicContact CZ2-CG 3.52Å; W12-Q16 HydrophobicContact CZ3-CG 4.04Å; W12-Q16 WeakPolarHBondContact O-CG 3.38Å; W12-Q16 PolarHBondContact O-N 3.37Å; W12-Q16 PolarHBondContact O-NE2 3.34Å; L13-Q16 PolarHBondContact O-N 3.41Å; L13-Q16 VanDerWaalsContact O-N 3.16Å; M14-Q16 VanDerWaalsContact C-N 3.31Å; M14-Q16 PolarHBondContact O-N 3.01Å; Q16-S19 PolarHBondContact O-N 3.05Å; Q16-S19 PolarHBondContact O-OG 3.4Å; Q16-Y22 HydrophobicContact CB-CD2 4.19Å; Q16-Y22 HydrophobicContact CB-CE2 3.81Å; Q16-Y22 HydrophobicContact CG-CE2 4.03Å; Q16-Y22 VanDerWaalsContact OE1-CE2 3.25Å; Q16-Y22 PolarHBondContact OE1-OH 3.06Å; Q16-L25 HydrophobicContact CB-CD2 3.95Å; Q16-I55 HydrophobicContact CB-CD1 3.93Å; Q16-I55 HydrophobicContact CG-CD1 4Å
17	I	94.5	Very high	91.1	Very high	8 Å²	8	63.3 Å²	63.3	4%	0.041	32%	0.317	C	S	.	.	H	α-helix	trans	-63.1	-45.2	175.6	-62.2	157.2	0	0	0	110	L13 M14 S19 A20 L25 W27 F35	L13-I17 HydrophobicContact CG-CD1 4.31Å; L13-I17 WeakPolarHBondContact O-CD1 3.45Å; L13-I17 VanDerWaalsContact O-CG1 3.26Å; L13-I17 WeakPolarHBondContact O-CG1 3.47Å; L13-I17 PolarHBondContact O-N 3.47Å; M14-I17 PolarHBondContact O-N 3.25Å; I17-S19 VanDerWaalsContact C-N 3.29Å; I17-S19 PolarHBondContact O-N 2.92Å; I17-A20 PolarHBondContact O-N 3.42Å; I17-L25 HydrophobicContact CB-CG 4.43Å; I17-L25 HydrophobicContact CG1-CD1 3.73Å; I17-L25 HydrophobicContact CG1-CD2 4.04Å; I17-L25 HydrophobicContact CG1-CG 3.73Å; I17-W27 HydrophobicContact CB-CZ2 4.44Å; I17-W27 HydrophobicContact CD1-CH2 4.21Å; I17-W27 HydrophobicContact CD1-CZ2 4.22Å; I17-W27 HydrophobicContact CG2-CD2 3.95Å; I17-W27 HydrophobicContact CG2-CG 3.95Å; I17-W27 HydrophobicContact CG2-CZ2 4.23Å; I17-F35 HydrophobicContact CD1-CB 3.65Å; I17-F35 HydrophobicContact CD1-CD1 3.96Å; I17-F35 HydrophobicContact CD1-CD2 3.63Å; I17-F35 HydrophobicContact CD1-CE2 4.27Å; I17-F35 HydrophobicContact CD1-CG 3.45Å; I17-F35 VanDerWaalsContact CD1-CG 3.45Å; I17-F35 HydrophobicContact CG1-CB 4.47Å; I17-F35 HydrophobicContact CG1-CD2 4.42Å
18	Q	92.1	Very high	92.6	Very high	136 Å²	136	60.9 Å²	60.9	64%	0.636	31%	0.31	S	S	*	.	H	α-helix	trans	-68.9	-27.1	-179.6	-172.7	163.2	1.2	0	0	113.1	M14 E15 A20	M14-Q18 WeakPolarHBondContact O-CB 3.44Å; M14-Q18 PolarHBondContact O-N 3.47Å; E15-Q18 PolarHBondContact O-N 3.1Å; Q18-A20 PolarHBondContact O-N 3.24Å
19	S	93	Very high	92.9	Very high	44 Å²	44	53.7 Å²	53.7	31%	0.308	29%	0.285	S	S	.	.	H	α-helix	trans	-65.1	-22.9	175.9	79.1	0	0	0	0	113.5	E15 Q16 I17 Q21	E15-S19 WeakPolarHBondContact O-CB 3.42Å; E15-S19 PolarHBondContact O-N 3.22Å; Q16-S19 PolarHBondContact O-N 3.05Å; Q16-S19 PolarHBondContact O-OG 3.4Å; I17-S19 VanDerWaalsContact C-N 3.29Å; I17-S19 PolarHBondContact O-N 2.92Å; S19-Q21 PolarHBondContact O-N 3.07Å; S19-Q21 PolarHBondContact OG-N 3.06Å
20	A	91.5	Very high	92.8	Very high	81 Å²	81	62.3 Å²	62.3	67%	0.669	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	22.3	-173.9	0	0	0	0	0	114.6	I17 Q18	I17-A20 PolarHBondContact O-N 3.42Å; Q18-A20 PolarHBondContact O-N 3.24Å
21	Q	91.1	Very high	92.7	Very high	146 Å²	146	64.2 Å²	64.2	68%	0.682	34%	0.344	S	S	*	.			trans	-79.6	-21.2	-177.3	-69.8	-178.5	-8.6	0	0	113.6	S19	S19-Q21 PolarHBondContact O-N 3.07Å; S19-Q21 PolarHBondContact OG-N 3.06Å
22	Y	93.7	Very high	92.7	Very high	32 Å²	32	66.1 Å²	66.1	13%	0.125	35%	0.348	C	S	.	.	S	Bend	trans	-108.2	114.9	-173.5	-50.8	-83	0	0	0	110	Q16 G24 L25 I55 A58	Q16-Y22 HydrophobicContact CB-CD2 4.19Å; Q16-Y22 HydrophobicContact CB-CE2 3.81Å; Q16-Y22 HydrophobicContact CG-CE2 4.03Å; Q16-Y22 VanDerWaalsContact OE1-CE2 3.25Å; Q16-Y22 PolarHBondContact OE1-OH 3.06Å; Y22-G24 PolarHBondContact O-N 3.36Å; Y22-L25 HydrophobicContact CD2-CD2 3.77Å; Y22-L25 HydrophobicContact CG-CD2 4.24Å; Y22-L25 WeakPolarHBondContact O-CB 3.37Å; Y22-L25 PolarHBondContact O-N 3.27Å; Y22-L25 VanDerWaalsContact O-N 3.08Å; Y22-I55 HydrophobicContact CD1-CB 4.02Å; Y22-I55 HydrophobicContact CD1-CD1 4.32Å; Y22-I55 HydrophobicContact CD2-CD1 3.87Å; Y22-I55 HydrophobicContact CE1-CD1 4.33Å; Y22-I55 HydrophobicContact CE2-CD1 3.91Å; Y22-I55 HydrophobicContact CG-CB 4.15Å; Y22-I55 HydrophobicContact CG-CD1 4.08Å; Y22-A58 HydrophobicContact CE1-CB 3.82Å; Y22-A58 WeakPolarHBondContact OH-CB 3.49Å
23	S	89.9	Confident	92.6	Very high	90 Å²	90	68.4 Å²	68.4	63%	0.629	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	125.9	-178.9	-173.7	0	0	0	0	111.2	L25 P38	S23-L25 VanDerWaalsContact C-N 3.31Å; S23-L25 PolarHBondContact O-N 3.34Å; S23-P38 WeakPolarHBondContact O-CG 3.2Å
24	G	90.9	Very high	92.6	Very high	28 Å²	28	69.7 Å²	69.7	29%	0.289	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.6	-6.8	179	0	0	0	0	0	115.9	Y22 R36	Y22-G24 PolarHBondContact O-N 3.36Å; G24-R36 WeakPolarHBondContact O-CG 3.44Å; G24-R36 PolarHBondContact O-NE 3.41Å
25	L	96.3	Very high	92.8	Very high	8 Å²	8	66.7 Å²	66.7	4%	0.042	35%	0.354	C	S	.	.			trans	-83.1	109.4	168.5	179.9	70.6	0	0	0	109.5	Q16 I17 Y22 S23 R36 I37 I55	Q16-L25 HydrophobicContact CB-CD2 3.95Å; I17-L25 HydrophobicContact CB-CG 4.43Å; I17-L25 HydrophobicContact CG1-CD1 3.73Å; I17-L25 HydrophobicContact CG1-CD2 4.04Å; I17-L25 HydrophobicContact CG1-CG 3.73Å; Y22-L25 HydrophobicContact CD2-CD2 3.77Å; Y22-L25 HydrophobicContact CG-CD2 4.24Å; Y22-L25 WeakPolarHBondContact O-CB 3.37Å; Y22-L25 PolarHBondContact O-N 3.27Å; Y22-L25 VanDerWaalsContact O-N 3.08Å; S23-L25 VanDerWaalsContact C-N 3.31Å; S23-L25 PolarHBondContact O-N 3.34Å; L25-R36 WeakPolarHBondContact CA-O 3.33Å; L25-R36 WeakPolarHBondContact CD1-O 3.47Å; L25-I37 HydrophobicContact CD1-CB 4.5Å; L25-I37 HydrophobicContact CD1-CG1 4.04Å; L25-I55 HydrophobicContact CD2-CD1 3.74Å; L25-I55 HydrophobicContact CD2-CG1 4.12Å
26	Q	96.1	Very high	93	Very high	83 Å²	83	66.1 Å²	66.1	39%	0.388	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	164.4	-176.2	61.1	179.3	65.4	0	0	112.5	F35 R36	Q26-F35 CarbonylContact O-C 3.45Å; Q26-F35 VanDerWaalsContact O-CA 3.26Å; Q26-F35 WeakPolarHBondContact O-CA 3.44Å; Q26-F35 WeakPolarHBondContact O-CB 3.48Å; Q26-R36 VanDerWaalsContact CD-NE 3.35Å; Q26-R36 HydrophobicContact CG-CG 3.75Å; Q26-R36 VanDerWaalsContact CG-NE 3.27Å; Q26-R36 PolarHBondContact N-O 3.1Å; Q26-R36 VanDerWaalsContact NE2-CZ 3.3Å; Q26-R36 PolarHBondContact O-N 2.8Å
27	W	96.3	Very high	93.1	Very high	53 Å²	53	64.8 Å²	64.8	20%	0.201	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	142.3	167.9	-61.5	109.8	0	0	0	111.1	M14 I17 R32 F35 I111	M14-W27 HydrophobicContact CG-CH2 4.07Å; M14-W27 HydrophobicContact CG-CZ2 4.35Å; I17-W27 HydrophobicContact CB-CZ2 4.44Å; I17-W27 HydrophobicContact CD1-CH2 4.21Å; I17-W27 HydrophobicContact CD1-CZ2 4.22Å; I17-W27 HydrophobicContact CG2-CD2 3.95Å; I17-W27 HydrophobicContact CG2-CG 3.95Å; I17-W27 HydrophobicContact CG2-CZ2 4.23Å; W27-R32 HydrophobicContact CD2-CB 3.7Å; W27-R32 HydrophobicContact CD2-CG 3.83Å; W27-R32 VanDerWaalsContact CE3-CA 3.43Å; W27-R32 HydrophobicContact CE3-CB 3.71Å; W27-R32 HydrophobicContact CE3-CG 4.33Å; W27-R32 HydrophobicContact CG-CB 4.31Å; W27-R32 HydrophobicContact CG-CG 3.94Å; W27-R32 HydrophobicContact CH2-CB 4.03Å; W27-R32 WeakPolarHBondContact CH2-O 3.46Å; W27-R32 HydrophobicContact CZ2-CB 4.02Å; W27-R32 HydrophobicContact CZ3-CB 3.9Å; W27-R32 WeakPolarHBondContact CZ3-O 3.49Å; W27-F35 HydrophobicContact CD2-CB 4.5Å; W27-F35 HydrophobicContact CE3-CB 3.84Å; W27-F35 HydrophobicContact CZ3-CB 4.08Å; W27-F35 HydrophobicContact CZ3-CD1 4.09Å; W27-I111 HydrophobicContact CH2-CD1 3.61Å; W27-I111 HydrophobicContact CZ3-CD1 3.71Å
28	E	92.1	Very high	93.1	Very high	65 Å²	65	65.2 Å²	65.2	30%	0.304	35%	0.346	S	S	.	.	S	Bend	trans	-97.9	-20.8	175.7	-74.6	-73.2	139.5	0	0	111.9	M34 R36 V108	E28-M34 HydrophobicContact CB-CB 4.15Å; E28-M34 PolarHBondContact N-O 2.92Å; E28-R36 HydrophobicContact CG-CB 4.14Å; E28-R36 HydrophobicContact CG-CG 4.29Å; E28-R36 WeakPolarHBondContact OE1-CD 3.46Å; E28-R36 WeakPolarHBondContact OE1-CG 3.49Å; E28-R36 IonicContact OE1-CZ 2.8Å; E28-R36 IonicContact OE1-NE 3.92Å; E28-R36 IonicContact OE1-NH1 3.44Å; E28-R36 PolarHBondContact OE1-NH1 2.99Å; E28-V108 HydrophobicContact CG-CG1 4.35Å; E28-V108 HydrophobicContact CG-CG2 4.38Å
29	D	89.6	Confident	93.2	Very high	25 Å²	25	59.4 Å²	59.4	13%	0.134	32%	0.318	C	S	.	.	S	Bend	trans	-130	151.2	-179.6	66.9	-46.4	0	0	0	111.8	S31 R32 T33 M34	D29-S31 PolarHBondContact O-N 3.33Å; D29-S31 WeakPolarHBondContact OD2-CB 3.26Å; D29-S31 PolarHBondContact OD2-OG 3.27Å; D29-R32 PolarHBondContact O-N 2.89Å; D29-R32 VanDerWaalsContact O-N 3.12Å; D29-R32 PolarHBondContact OD2-N 3.35Å; D29-T33 PolarHBondContact OD1-N 2.88Å; D29-T33 WeakPolarHBondContact OD2-CB 3.38Å; D29-T33 PolarHBondContact OD2-N 3.02Å; D29-T33 PolarHBondContact OD2-OG1 2.96Å; D29-M34 HydrophobicContact CB-CE 4.12Å; D29-M34 WeakPolarHBondContact OD1-CA 3.39Å; D29-M34 PolarHBondContact OD1-N 3.36Å
30	E	88	Confident	93.3	Very high	199 Å²	199	57.9 Å²	57.9	93%	0.93	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-30.2	177.9	-64.9	-176.4	178.2	0	0	112.4	R32	E30-R32 PolarHBondContact O-N 3.42Å
31	S	89.5	Confident	93.1	Very high	89 Å²	89	58.8 Å²	58.8	62%	0.622	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-3.9	175.7	38.2	0	0	0	0	114.3	D29 T33	D29-S31 PolarHBondContact O-N 3.33Å; D29-S31 WeakPolarHBondContact OD2-CB 3.26Å; D29-S31 PolarHBondContact OD2-OG 3.27Å; S31-T33 PolarHBondContact O-N 3.5Å
32	R	91.3	Very high	92.7	Very high	133 Å²	133	55 Å²	55	50%	0.502	29%	0.289	S	S	.	.	S	Bend	trans	53	41.1	178.3	-56.6	-176.7	-175.2	-172.5	0.6	112.9	W27 D29 E30	W27-R32 HydrophobicContact CD2-CB 3.7Å; W27-R32 HydrophobicContact CD2-CG 3.83Å; W27-R32 VanDerWaalsContact CE3-CA 3.43Å; W27-R32 HydrophobicContact CE3-CB 3.71Å; W27-R32 HydrophobicContact CE3-CG 4.33Å; W27-R32 HydrophobicContact CG-CB 4.31Å; W27-R32 HydrophobicContact CG-CG 3.94Å; W27-R32 HydrophobicContact CH2-CB 4.03Å; W27-R32 WeakPolarHBondContact CH2-O 3.46Å; W27-R32 HydrophobicContact CZ2-CB 4.02Å; W27-R32 HydrophobicContact CZ3-CB 3.9Å; W27-R32 WeakPolarHBondContact CZ3-O 3.49Å; D29-R32 PolarHBondContact O-N 2.89Å; D29-R32 VanDerWaalsContact O-N 3.12Å; D29-R32 PolarHBondContact OD2-N 3.35Å; E30-R32 PolarHBondContact O-N 3.42Å
33	T	92.1	Very high	92.1	Very high	57 Å²	57	57.3 Å²	57.3	35%	0.35	32%	0.323	S	S	.	.			trans	-102.9	-16.9	176.3	67	0	0	0	0	112	D29 S31 R110 I111	D29-T33 PolarHBondContact OD1-N 2.88Å; D29-T33 WeakPolarHBondContact OD2-CB 3.38Å; D29-T33 PolarHBondContact OD2-N 3.02Å; D29-T33 PolarHBondContact OD2-OG1 2.96Å; S31-T33 PolarHBondContact O-N 3.5Å; T33-R110 CarbonylContact O-C 3.49Å; T33-R110 WeakPolarHBondContact O-CA 3.43Å; T33-I111 PolarHBondContact O-N 2.8Å
34	M	95.1	Very high	91.7	Very high	28 Å²	28	56.1 Å²	56.1	14%	0.138	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	136.9	179.3	-70.7	178.7	-75.3	0	0	110.9	E28 D29 V108 Y109 R110	E28-M34 HydrophobicContact CB-CB 4.15Å; E28-M34 PolarHBondContact N-O 2.92Å; D29-M34 HydrophobicContact CB-CE 4.12Å; D29-M34 WeakPolarHBondContact OD1-CA 3.39Å; D29-M34 PolarHBondContact OD1-N 3.36Å; M34-V108 HydrophobicContact CB-CG1 4.44Å; M34-Y109 VanDerWaalsContact CA-O 3.29Å; M34-Y109 WeakPolarHBondContact CA-O 3.47Å; M34-R110 HydrophobicContact CG-CB 4.05Å; M34-R110 HydrophobicContact CG-CG 4.06Å
35	F	96.8	Very high	91.3	Very high	1 Å²	1	64.6 Å²	64.6	0%	0.004	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	157.2	176.7	64.4	-85.1	0	0	0	110.2	L13 I17 Q26 W27 I37 F91 V108 Y109 I111	L13-F35 HydrophobicContact CD2-CE1 4.33Å; L13-F35 HydrophobicContact CD2-CE2 3.45Å; L13-F35 VanDerWaalsContact CD2-CE2 3.45Å; L13-F35 HydrophobicContact CD2-CZ 3.34Å; L13-F35 HydrophobicContact CG-CE2 4.19Å; L13-F35 HydrophobicContact CG-CZ 4.35Å; I17-F35 HydrophobicContact CD1-CB 3.65Å; I17-F35 HydrophobicContact CD1-CD1 3.96Å; I17-F35 HydrophobicContact CD1-CD2 3.63Å; I17-F35 HydrophobicContact CD1-CE2 4.27Å; I17-F35 HydrophobicContact CD1-CG 3.45Å; I17-F35 VanDerWaalsContact CD1-CG 3.45Å; I17-F35 HydrophobicContact CG1-CB 4.47Å; I17-F35 HydrophobicContact CG1-CD2 4.42Å; Q26-F35 CarbonylContact O-C 3.45Å; Q26-F35 VanDerWaalsContact O-CA 3.26Å; Q26-F35 WeakPolarHBondContact O-CA 3.44Å; Q26-F35 WeakPolarHBondContact O-CB 3.48Å; W27-F35 HydrophobicContact CD2-CB 4.5Å; W27-F35 HydrophobicContact CE3-CB 3.84Å; W27-F35 HydrophobicContact CZ3-CB 4.08Å; W27-F35 HydrophobicContact CZ3-CD1 4.09Å; F35-I37 HydrophobicContact CD2-CG1 3.98Å; F35-I37 HydrophobicContact CE2-CD1 3.85Å; F35-I37 HydrophobicContact CE2-CG1 3.67Å; F35-F91 AromaticContact CE1-CD1 3.76Å; F35-F91 HydrophobicContact CE1-CD1 3.76Å; F35-F91 AromaticContact CE1-CE1 3.58Å; F35-F91 HydrophobicContact CE1-CE1 3.58Å; F35-F91 AromaticContact CZ-CD1 3.8Å; F35-F91 HydrophobicContact CZ-CD1 3.8Å; F35-F91 AromaticContact CZ-CE1 3.59Å; F35-F91 HydrophobicContact CZ-CE1 3.59Å; F35-F91 HydrophobicContact CZ-CZ 4.5Å; F35-V108 WeakPolarHBondContact O-CA 3.1Å; F35-Y109 HydrophobicContact CE2-CD2 4.2Å; F35-Y109 HydrophobicContact CE2-CG 4.44Å; F35-Y109 HydrophobicContact CZ-CD2 4.45Å; F35-Y109 HydrophobicContact CZ-CG 4.24Å; F35-Y109 PolarHBondContact N-O 3.05Å; F35-Y109 PolarHBondContact O-N 3.31Å; F35-I111 HydrophobicContact CD1-CD1 4.38Å; F35-I111 HydrophobicContact CD1-CG1 4.16Å; F35-I111 HydrophobicContact CE1-CD1 4.42Å; F35-I111 HydrophobicContact CE1-CG1 3.91Å
36	R	97.1	Very high	90.8	Very high	55 Å²	55	68.4 Å²	68.4	21%	0.208	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	145.1	174.6	62.3	160.9	-179.4	-146.8	8.3	112	G24 L25 Q26 E28 Y106 K107 V108	G24-R36 WeakPolarHBondContact O-CG 3.44Å; G24-R36 PolarHBondContact O-NE 3.41Å; L25-R36 WeakPolarHBondContact CA-O 3.33Å; L25-R36 WeakPolarHBondContact CD1-O 3.47Å; Q26-R36 VanDerWaalsContact CD-NE 3.35Å; Q26-R36 HydrophobicContact CG-CG 3.75Å; Q26-R36 VanDerWaalsContact CG-NE 3.27Å; Q26-R36 PolarHBondContact N-O 3.1Å; Q26-R36 VanDerWaalsContact NE2-CZ 3.3Å; Q26-R36 PolarHBondContact O-N 2.8Å; E28-R36 HydrophobicContact CG-CB 4.14Å; E28-R36 HydrophobicContact CG-CG 4.29Å; E28-R36 WeakPolarHBondContact OE1-CD 3.46Å; E28-R36 WeakPolarHBondContact OE1-CG 3.49Å; E28-R36 IonicContact OE1-CZ 2.8Å; E28-R36 IonicContact OE1-NE 3.92Å; E28-R36 IonicContact OE1-NH1 3.44Å; E28-R36 PolarHBondContact OE1-NH1 2.99Å; R36-Y106 HydrophobicContact CB-CD2 3.71Å; R36-Y106 HydrophobicContact CB-CE2 4.36Å; R36-Y106 HydrophobicContact CB-CG 4.18Å; R36-Y106 HydrophobicContact CG-CD2 4.46Å; R36-K107 CarbonylContact C-O 3.48Å; R36-K107 WeakPolarHBondContact CA-O 3.18Å; R36-V108 HydrophobicContact CB-CG2 4.2Å
37	I	97.3	Very high	90.5	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	128.5	172.5	-50.7	-178.2	0	0	0	108.8	L25 F35 W39 I55 F56 L85 Y106 K107 Y109	L25-I37 HydrophobicContact CD1-CB 4.5Å; L25-I37 HydrophobicContact CD1-CG1 4.04Å; F35-I37 HydrophobicContact CD2-CG1 3.98Å; F35-I37 HydrophobicContact CE2-CD1 3.85Å; F35-I37 HydrophobicContact CE2-CG1 3.67Å; I37-W39 HydrophobicContact CB-CE3 4.41Å; I37-W39 HydrophobicContact CG2-CE3 4.2Å; I37-W39 HydrophobicContact CG2-CZ3 4.26Å; I37-W39 PolarHBondContact O-N 3.46Å; I37-I55 HydrophobicContact CG2-CG2 4.18Å; I37-F56 HydrophobicContact CG2-CE1 4.38Å; I37-F56 HydrophobicContact CG2-CZ 4.36Å; I37-L85 HydrophobicContact CD1-CD1 3.6Å; I37-Y106 CarbonylContact O-C 3.59Å; I37-Y106 WeakPolarHBondContact O-CA 3.48Å; I37-Y106 WeakPolarHBondContact O-CB 3.11Å; I37-K107 PolarHBondContact N-O 3.34Å; I37-K107 PolarHBondContact O-N 3.25Å; I37-Y109 HydrophobicContact CD1-CD2 3.98Å; I37-Y109 HydrophobicContact CD1-CE2 3.81Å; I37-Y109 HydrophobicContact CG1-CD2 4.14Å; I37-Y109 HydrophobicContact CG1-CE2 4.19Å
38	P	95.1	Very high	90.2	Very high	16 Å²	16	67.8 Å²	67.8	10%	0.104	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.9	136.3	170.3	-19.7	28.4	0	0	0	111.7	S23 F56 P105	S23-P38 WeakPolarHBondContact O-CG 3.2Å; P38-F56 WeakPolarHBondContact O-CZ 3.36Å; P38-P105 CarbonylContact C-O 3.55Å; P38-P105 WeakPolarHBondContact CA-O 3.32Å
39	W	95.1	Very high	90.1	Very high	15 Å²	15	68.8 Å²	68.8	6%	0.057	36%	0.364	C	S	.	.			trans	-133.1	29.9	-170.1	-146.4	-98.4	0	0	0	114.3	I37 F56 K78 R82 L100 P105 K107	I37-W39 HydrophobicContact CB-CE3 4.41Å; I37-W39 HydrophobicContact CG2-CE3 4.2Å; I37-W39 HydrophobicContact CG2-CZ3 4.26Å; I37-W39 PolarHBondContact O-N 3.46Å; W39-F56 HydrophobicContact CD2-CZ 4.49Å; W39-F56 HydrophobicContact CE3-CE1 4.19Å; W39-F56 AromaticContact CE3-CZ 3.84Å; W39-F56 HydrophobicContact CE3-CZ 3.84Å; W39-F56 HydrophobicContact CH2-CE1 4.22Å; W39-F56 AromaticContact CZ3-CE1 3.73Å; W39-F56 HydrophobicContact CZ3-CE1 3.73Å; W39-F56 AromaticContact CZ3-CZ 3.87Å; W39-F56 HydrophobicContact CZ3-CZ 3.87Å; W39-K78 HydrophobicContact CZ2-CG 4.29Å; W39-K78 VanDerWaalsContact NE1-CE 3.26Å; W39-K78 PolarHBondContact O-NZ 3.38Å; W39-R82 HydrophobicContact CH2-CB 3.93Å; W39-R82 HydrophobicContact CH2-CG 4.34Å; W39-R82 HydrophobicContact CZ2-CB 4.07Å; W39-R82 HydrophobicContact CZ2-CG 4.19Å; W39-L100 HydrophobicContact CB-CD2 3.78Å; W39-L100 HydrophobicContact CG-CD2 3.96Å; W39-P105 PolarHBondContact N-O 2.87Å; W39-K107 HydrophobicContact CB-CG 4.2Å; W39-K107 HydrophobicContact CD2-CD 3.65Å; W39-K107 HydrophobicContact CD2-CG 3.9Å; W39-K107 HydrophobicContact CE3-CB 4.38Å; W39-K107 HydrophobicContact CE3-CD 3.96Å; W39-K107 HydrophobicContact CE3-CG 4.19Å; W39-K107 HydrophobicContact CG-CD 4.05Å; W39-K107 HydrophobicContact CG-CG 3.89Å; W39-K107 HydrophobicContact CH2-CD 4.31Å; W39-K107 HydrophobicContact CZ2-CD 4.04Å; W39-K107 HydrophobicContact CZ3-CD 4.27Å
40	K	93.6	Very high	90	Very high	11 Å²	11	75.5 Å²	75.5	5%	0.048	40%	0.395	C	S	.	.			trans	-57.2	142.9	-178.1	-150.3	173.9	-165.3	168.9	0	112.4	K44 D46 Y47 D52 K78 E104 P105	K40-K44 HydrophobicContact CG-CD 4.11Å; K40-D46 WeakPolarHBondContact CE-O 3.15Å; K40-D46 WeakPolarHBondContact CE-OD1 3.41Å; K40-D46 WeakPolarHBondContact CE-OD2 3.42Å; K40-D46 PolarHBondContact NZ-O 2.93Å; K40-D46 IonicContact NZ-OD1 2.9Å; K40-D46 IonicContact NZ-OD2 2.61Å; K40-D46 PolarHBondContact NZ-OD2 3.13Å; K40-Y47 HydrophobicContact CB-CD2 4.18Å; K40-Y47 HydrophobicContact CB-CE2 4.43Å; K40-Y47 HydrophobicContact CD-CD2 4.32Å; K40-Y47 HydrophobicContact CG-CD2 4.19Å; K40-D52 HydrophobicContact CB-CB 4.21Å; K40-D52 VanDerWaalsContact CD-CG 3.46Å; K40-D52 VanDerWaalsContact CD-OD1 3.23Å; K40-D52 WeakPolarHBondContact CD-OD1 3.39Å; K40-D52 WeakPolarHBondContact CD-OD2 3.44Å; K40-K78 PolarHBondContact O-NZ 2.98Å; K40-E104 IonicContact NZ-OE1 3.17Å; K40-P105 HydrophobicContact CB-CG 4.08Å; K40-P105 HydrophobicContact CG-CG 4.18Å
41	H	87.4	Confident	90.1	Very high	101 Å²	101	69.5 Å²	69.5	47%	0.468	37%	0.371	S	S	.	.			trans	-88.9	133.5	178.9	-78.3	-86.9	0	0	0	110	G43 K44 Y47	H41-G43 PolarHBondContact O-N 3.36Å; H41-G43 VanDerWaalsContact O-N 3.09Å; H41-K44 HydrophobicContact CB-CG 4.42Å; H41-K44 PolarHBondContact O-N 3.43Å; H41-Y47 WeakPolarHBondContact O-CD2 3.33Å
42	A	83	Confident	90.3	Very high	65 Å²	65	65.8 Å²	65.8	54%	0.537	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-18.7	-179.2	0	0	0	0	0	114.2	Y47	A42-Y47 HydrophobicContact CB-CD1 4.15Å; A42-Y47 HydrophobicContact CB-CE1 3.84Å; A42-Y47 HydrophobicContact CB-CE2 4.28Å; A42-Y47 HydrophobicContact CB-CG 4.49Å
43	G	81	Confident	90.4	Very high	81 Å²	81	59.5 Å²	59.5	84%	0.835	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-1.1	175.6	0	0	0	0	0	115.2	H41	H41-G43 PolarHBondContact O-N 3.36Å; H41-G43 VanDerWaalsContact O-N 3.09Å
44	K	82.7	Confident	90.5	Very high	66 Å²	66	58.1 Å²	58.1	29%	0.287	31%	0.314	S	S	.	.	S	Bend	trans	-77.1	141.2	174.2	-70.1	-165.1	175.2	-174.7	0	110.2	K40 H41 D46 Y47 I102	K40-K44 HydrophobicContact CG-CD 4.11Å; H41-K44 HydrophobicContact CB-CG 4.42Å; H41-K44 PolarHBondContact O-N 3.43Å; K44-D46 WeakPolarHBondContact CB-OD1 3.24Å; K44-D46 PolarHBondContact O-N 3.38Å; K44-Y47 WeakPolarHBondContact O-CB 3.47Å; K44-Y47 PolarHBondContact O-N 3.06Å; K44-Y47 VanDerWaalsContact O-N 3.08Å; K44-I102 PolarHBondContact NZ-O 2.8Å; K44-I102 VanDerWaalsContact NZ-O 3.16Å
45	Q	81.3	Confident	90.5	Very high	206 Å²	206	56.9 Å²	56.9	96%	0.963	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-30.1	-179.3	-173.8	-176.9	-3.3	0	0	113	Y47	Q45-Y47 VanDerWaalsContact C-N 3.33Å
46	D	86.9	Confident	90.4	Very high	88 Å²	88	57 Å²	57	47%	0.471	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	18.7	179.2	69	-30.7	0	0	0	112.8	K40 K44 N48	K40-D46 WeakPolarHBondContact CE-O 3.15Å; K40-D46 WeakPolarHBondContact CE-OD1 3.41Å; K40-D46 WeakPolarHBondContact CE-OD2 3.42Å; K40-D46 PolarHBondContact NZ-O 2.93Å; K40-D46 IonicContact NZ-OD1 2.9Å; K40-D46 IonicContact NZ-OD2 2.61Å; K40-D46 PolarHBondContact NZ-OD2 3.13Å; K44-D46 WeakPolarHBondContact CB-OD1 3.24Å; K44-D46 PolarHBondContact O-N 3.38Å; D46-N48 PolarHBondContact O-N 3.34Å
47	Y	89.1	Confident	90.3	Very high	45 Å²	45	58.2 Å²	58.2	18%	0.176	32%	0.315	C	S	.	.			trans	-75.7	118.9	175.1	-176.2	-100.2	0	0	0	110.7	K40 H41 A42 K44 Q45 Q49 D52	K40-Y47 HydrophobicContact CB-CD2 4.18Å; K40-Y47 HydrophobicContact CB-CE2 4.43Å; K40-Y47 HydrophobicContact CD-CD2 4.32Å; K40-Y47 HydrophobicContact CG-CD2 4.19Å; H41-Y47 WeakPolarHBondContact O-CD2 3.33Å; A42-Y47 HydrophobicContact CB-CD1 4.15Å; A42-Y47 HydrophobicContact CB-CE1 3.84Å; A42-Y47 HydrophobicContact CB-CE2 4.28Å; A42-Y47 HydrophobicContact CB-CG 4.49Å; K44-Y47 WeakPolarHBondContact O-CB 3.47Å; K44-Y47 PolarHBondContact O-N 3.06Å; K44-Y47 VanDerWaalsContact O-N 3.08Å; Q45-Y47 VanDerWaalsContact C-N 3.33Å; Y47-Q49 HydrophobicContact CE1-CB 4.1Å; Y47-D52 WeakPolarHBondContact CA-OD2 2.99Å; Y47-D52 HydrophobicContact CD2-CB 3.69Å; Y47-D52 HydrophobicContact CE2-CB 3.34Å
48	N	90.6	Very high	90.1	Very high	77 Å²	77	59 Å²	59	41%	0.412	32%	0.322	S	S	.	.			trans	-106.5	108.8	171.2	-178.1	-31.1	0	0	0	108.9	D46 E50 V51 D52	D46-N48 PolarHBondContact O-N 3.34Å; N48-E50 VanDerWaalsContact C-N 3.26Å; N48-E50 PolarHBondContact O-N 3.44Å; N48-E50 WeakPolarHBondContact OD1-CB 3.25Å; N48-E50 PolarHBondContact OD1-N 2.89Å; N48-V51 HydrophobicContact CB-CB 4.28Å; N48-V51 HydrophobicContact CB-CG2 4.41Å; N48-V51 PolarHBondContact O-N 3.33Å; N48-V51 VanDerWaalsContact O-N 3.15Å; N48-V51 PolarHBondContact OD1-N 3.35Å; N48-D52 PolarHBondContact N-OD2 3.44Å; N48-D52 VanDerWaalsContact O-CB 3.24Å; N48-D52 WeakPolarHBondContact O-CB 3.31Å; N48-D52 PolarHBondContact O-N 3.21Å
49	Q	89.1	Confident	90.1	Very high	87 Å²	87	59.2 Å²	59.2	41%	0.407	32%	0.32	S	S	.	.	H	α-helix	trans	-54.4	-38.6	-179.3	174.9	173.7	-41.5	0	0	113.6	Y47 V51 A53 P74	Y47-Q49 HydrophobicContact CE1-CB 4.1Å; Q49-V51 VanDerWaalsContact C-N 3.33Å; Q49-V51 PolarHBondContact O-N 3.07Å; Q49-A53 HydrophobicContact CG-CB 4.34Å; Q49-A53 WeakPolarHBondContact O-CA 3.45Å; Q49-A53 WeakPolarHBondContact O-CB 3.42Å; Q49-A53 PolarHBondContact O-N 3.04Å; Q49-A53 VanDerWaalsContact O-N 3.08Å; Q49-P74 HydrophobicContact CG-CG 3.5Å
50	E	88.3	Confident	89.9	Confident	166 Å²	166	58.6 Å²	58.6	78%	0.776	32%	0.318	S	S	*	.	H	α-helix	trans	-68.3	-37.1	-177.1	-62.1	-174.3	168.2	0	0	111.7	N48 S54	N48-E50 VanDerWaalsContact C-N 3.26Å; N48-E50 PolarHBondContact O-N 3.44Å; N48-E50 WeakPolarHBondContact OD1-CB 3.25Å; N48-E50 PolarHBondContact OD1-N 2.89Å; E50-S54 VanDerWaalsContact O-CB 3.31Å; E50-S54 WeakPolarHBondContact O-CB 3.43Å
51	V	89.9	Confident	89.8	Confident	72 Å²	72	61.8 Å²	61.8	44%	0.436	34%	0.339	S	S	.	.	H	α-helix	trans	-87.4	-54.9	-178.3	-179.1	0	0	0	0	110.8	N48 Q49 A53 S54	N48-V51 HydrophobicContact CB-CB 4.28Å; N48-V51 HydrophobicContact CB-CG2 4.41Å; N48-V51 PolarHBondContact O-N 3.33Å; N48-V51 VanDerWaalsContact O-N 3.15Å; N48-V51 PolarHBondContact OD1-N 3.35Å; Q49-V51 VanDerWaalsContact C-N 3.33Å; Q49-V51 PolarHBondContact O-N 3.07Å; V51-A53 VanDerWaalsContact C-N 3.33Å; V51-A53 PolarHBondContact O-N 3.24Å; V51-S54 VanDerWaalsContact O-CB 3.25Å; V51-S54 WeakPolarHBondContact O-CB 3.32Å; V51-S54 PolarHBondContact O-N 3.34Å; V51-S54 PolarHBondContact O-OG 3.22Å
52	D	92.5	Very high	89.9	Confident	12 Å²	12	58.6 Å²	58.6	6%	0.064	32%	0.324	C	S	.	.	H	α-helix	trans	-74.4	-22.5	-173.1	-65	-55.2	0	0	0	113.2	K40 Y47 N48	K40-D52 HydrophobicContact CB-CB 4.21Å; K40-D52 VanDerWaalsContact CD-CG 3.46Å; K40-D52 VanDerWaalsContact CD-OD1 3.23Å; K40-D52 WeakPolarHBondContact CD-OD1 3.39Å; K40-D52 WeakPolarHBondContact CD-OD2 3.44Å; Y47-D52 WeakPolarHBondContact CA-OD2 2.99Å; Y47-D52 HydrophobicContact CD2-CB 3.69Å; Y47-D52 HydrophobicContact CE2-CB 3.34Å; N48-D52 PolarHBondContact N-OD2 3.44Å; N48-D52 VanDerWaalsContact O-CB 3.24Å; N48-D52 WeakPolarHBondContact O-CB 3.31Å; N48-D52 PolarHBondContact O-N 3.21Å
53	A	93.4	Very high	90.1	Very high	1 Å²	1	61 Å²	61	1%	0.008	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-2.4	173.4	0	0	0	0	0	113.9	Q49 V51 I55 F56 K57 P74 W77	Q49-A53 HydrophobicContact CG-CB 4.34Å; Q49-A53 WeakPolarHBondContact O-CA 3.45Å; Q49-A53 WeakPolarHBondContact O-CB 3.42Å; Q49-A53 PolarHBondContact O-N 3.04Å; Q49-A53 VanDerWaalsContact O-N 3.08Å; V51-A53 VanDerWaalsContact C-N 3.33Å; V51-A53 PolarHBondContact O-N 3.24Å; A53-I55 PolarHBondContact O-N 3.28Å; A53-F56 PolarHBondContact O-N 3.48Å; A53-F56 VanDerWaalsContact O-N 3.1Å; A53-K57 WeakPolarHBondContact O-CB 3.37Å; A53-K57 PolarHBondContact O-N 3.45Å; A53-P74 HydrophobicContact CB-CB 3.82Å; A53-P74 HydrophobicContact CB-CG 4.26Å; A53-W77 HydrophobicContact CB-CE3 4.48Å
54	S	94.3	Very high	90.3	Very high	28 Å²	28	59.8 Å²	59.8	20%	0.196	31%	0.309	C	S	.	.	H	α-helix	trans	-53.1	-52.7	-169.4	56.6	0	0	0	0	113.8	E50 V51 F56 K57 A58	E50-S54 VanDerWaalsContact O-CB 3.31Å; E50-S54 WeakPolarHBondContact O-CB 3.43Å; V51-S54 VanDerWaalsContact O-CB 3.25Å; V51-S54 WeakPolarHBondContact O-CB 3.32Å; V51-S54 PolarHBondContact O-N 3.34Å; V51-S54 PolarHBondContact O-OG 3.22Å; S54-F56 VanDerWaalsContact C-N 3.34Å; S54-F56 PolarHBondContact O-N 3.41Å; S54-K57 WeakPolarHBondContact O-CB 3.47Å; S54-K57 PolarHBondContact O-N 3.48Å; S54-A58 WeakPolarHBondContact O-CB 3.44Å; S54-A58 PolarHBondContact O-N 2.96Å
55	I	95.9	Very high	90.4	Very high	2 Å²	2	63 Å²	63	1%	0.01	32%	0.323	C	S	.	.	H	α-helix	trans	-66.8	-35.1	179.8	-173.7	57.9	0	0	0	112.3	W12 Q16 Y22 L25 I37 A53 A58 W59	W12-I55 HydrophobicContact CH2-CD1 3.69Å; W12-I55 HydrophobicContact CZ3-CD1 4.19Å; Q16-I55 HydrophobicContact CB-CD1 3.93Å; Q16-I55 HydrophobicContact CG-CD1 4Å; Y22-I55 HydrophobicContact CD1-CB 4.02Å; Y22-I55 HydrophobicContact CD1-CD1 4.32Å; Y22-I55 HydrophobicContact CD2-CD1 3.87Å; Y22-I55 HydrophobicContact CE1-CD1 4.33Å; Y22-I55 HydrophobicContact CE2-CD1 3.91Å; Y22-I55 HydrophobicContact CG-CB 4.15Å; Y22-I55 HydrophobicContact CG-CD1 4.08Å; L25-I55 HydrophobicContact CD2-CD1 3.74Å; L25-I55 HydrophobicContact CD2-CG1 4.12Å; I37-I55 HydrophobicContact CG2-CG2 4.18Å; A53-I55 PolarHBondContact O-N 3.28Å; I55-A58 PolarHBondContact O-N 3.21Å; I55-W59 PolarHBondContact O-N 2.86Å
56	F	95.7	Very high	90.6	Very high	2 Å²	2	54 Å²	54	1%	0.009	28%	0.281	C	S	.	.	H	α-helix	trans	-69.7	-40.8	176.8	-53	-58.8	0	0	0	111.1	I37 P38 W39 A53 S54 W59 A60 W77 K78 L81	I37-F56 HydrophobicContact CG2-CE1 4.38Å; I37-F56 HydrophobicContact CG2-CZ 4.36Å; P38-F56 WeakPolarHBondContact O-CZ 3.36Å; W39-F56 HydrophobicContact CD2-CZ 4.49Å; W39-F56 HydrophobicContact CE3-CE1 4.19Å; W39-F56 AromaticContact CE3-CZ 3.84Å; W39-F56 HydrophobicContact CE3-CZ 3.84Å; W39-F56 HydrophobicContact CH2-CE1 4.22Å; W39-F56 AromaticContact CZ3-CE1 3.73Å; W39-F56 HydrophobicContact CZ3-CE1 3.73Å; W39-F56 AromaticContact CZ3-CZ 3.87Å; W39-F56 HydrophobicContact CZ3-CZ 3.87Å; A53-F56 PolarHBondContact O-N 3.48Å; A53-F56 VanDerWaalsContact O-N 3.1Å; S54-F56 VanDerWaalsContact C-N 3.34Å; S54-F56 PolarHBondContact O-N 3.41Å; F56-W59 PolarHBondContact O-N 3.19Å; F56-A60 PolarHBondContact O-N 3.13Å; F56-W77 HydrophobicContact CB-CB 3.78Å; F56-K78 HydrophobicContact CD1-CB 4.17Å; F56-K78 HydrophobicContact CD1-CG 4.22Å; F56-K78 HydrophobicContact CD2-CB 4.03Å; F56-K78 HydrophobicContact CD2-CG 4.2Å; F56-K78 HydrophobicContact CE1-CB 4.41Å; F56-K78 HydrophobicContact CE1-CG 3.95Å; F56-K78 HydrophobicContact CE2-CB 4.32Å; F56-K78 HydrophobicContact CE2-CD 4.07Å; F56-K78 HydrophobicContact CE2-CG 3.97Å; F56-K78 HydrophobicContact CG-CB 4Å; F56-K78 HydrophobicContact CG-CG 4.37Å; F56-K78 HydrophobicContact CZ-CD 4.21Å; F56-K78 HydrophobicContact CZ-CG 3.84Å; F56-L81 HydrophobicContact CD1-CB 3.99Å; F56-L81 HydrophobicContact CD1-CD2 3.55Å; F56-L81 HydrophobicContact CD1-CG 4.34Å; F56-L81 HydrophobicContact CE1-CD2 3.83Å
57	K	93.8	Very high	90.5	Very high	82 Å²	82	57 Å²	57	36%	0.357	29%	0.29	S	S	.	.	H	α-helix	trans	-60.4	-46.9	172.7	-175.9	-175.8	176.9	-172.3	0	110.3	A53 S54 W59 A60 V61 F66 W77	A53-K57 WeakPolarHBondContact O-CB 3.37Å; A53-K57 PolarHBondContact O-N 3.45Å; S54-K57 WeakPolarHBondContact O-CB 3.47Å; S54-K57 PolarHBondContact O-N 3.48Å; K57-W59 VanDerWaalsContact C-N 3.3Å; K57-W59 PolarHBondContact O-N 3.23Å; K57-A60 WeakPolarHBondContact O-CB 3.42Å; K57-A60 PolarHBondContact O-N 3.39Å; K57-A60 VanDerWaalsContact O-N 3.07Å; K57-V61 WeakPolarHBondContact O-CG2 3.35Å; K57-V61 PolarHBondContact O-N 3.09Å; K57-F66 HydrophobicContact CD-CE1 4.44Å; K57-F66 HydrophobicContact CG-CD1 4.32Å; K57-F66 HydrophobicContact CG-CE1 4.21Å; K57-W77 HydrophobicContact CB-CD2 4.44Å; K57-W77 HydrophobicContact CB-CE3 3.68Å; K57-W77 HydrophobicContact CB-CH2 4.36Å; K57-W77 HydrophobicContact CB-CZ3 3.64Å; K57-W77 HydrophobicContact CD-CH2 4.31Å; K57-W77 HydrophobicContact CD-CZ3 4.15Å; K57-W77 HydrophobicContact CG-CE3 4.17Å; K57-W77 HydrophobicContact CG-CH2 3.96Å; K57-W77 HydrophobicContact CG-CZ3 3.73Å
58	A	94.2	Very high	89.8	Confident	17 Å²	17	63.7 Å²	63.7	14%	0.14	32%	0.322	C	S	.	.	H	α-helix	trans	-59.1	-40.8	177.9	0	0	0	0	0	112.2	W12 Y22 S54 I55 V61 F62	W12-A58 HydrophobicContact CH2-CB 4.31Å; W12-A58 HydrophobicContact CZ2-CB 3.94Å; Y22-A58 HydrophobicContact CE1-CB 3.82Å; Y22-A58 WeakPolarHBondContact OH-CB 3.49Å; S54-A58 WeakPolarHBondContact O-CB 3.44Å; S54-A58 PolarHBondContact O-N 2.96Å; I55-A58 PolarHBondContact O-N 3.21Å; A58-V61 PolarHBondContact O-N 3.46Å; A58-F62 VanDerWaalsContact O-CB 3.26Å; A58-F62 WeakPolarHBondContact O-CB 3.45Å; A58-F62 PolarHBondContact O-N 2.73Å
59	W	93.8	Very high	89	Confident	19 Å²	19	63.8 Å²	63.8	7%	0.072	34%	0.342	C	S	.	.	H	α-helix	trans	-62.7	-42	173.5	178.6	-118.9	0	0	0	112.4	L9 W12 I55 F56 K57 F62 K63 L81 A84	L9-W59 HydrophobicContact CB-CH2 3.9Å; L9-W59 HydrophobicContact CB-CZ3 4.47Å; L9-W59 HydrophobicContact CD1-CD2 4.28Å; L9-W59 HydrophobicContact CD1-CE3 3.96Å; L9-W59 HydrophobicContact CD1-CH2 3.35Å; L9-W59 HydrophobicContact CD1-CZ2 3.71Å; L9-W59 HydrophobicContact CD1-CZ3 3.48Å; L9-W59 VanDerWaalsContact CD1-CZ3 3.48Å; L9-W59 HydrophobicContact CG-CH2 4.17Å; W12-W59 HydrophobicContact CB-CZ3 4.46Å; W12-W59 AromaticContact CD2-CE3 3.69Å; W12-W59 HydrophobicContact CD2-CE3 3.69Å; W12-W59 AromaticContact CD2-CZ3 3.92Å; W12-W59 HydrophobicContact CD2-CZ3 3.92Å; W12-W59 HydrophobicContact CE3-CD2 4.42Å; W12-W59 AromaticContact CE3-CE3 3.37Å; W12-W59 HydrophobicContact CE3-CE3 3.37Å; W12-W59 AromaticContact CE3-CZ3 3.73Å; W12-W59 HydrophobicContact CE3-CZ3 3.73Å; W12-W59 HydrophobicContact CG-CE3 4.44Å; W12-W59 HydrophobicContact CG-CZ3 4.26Å; W12-W59 HydrophobicContact CH2-CB 3.6Å; W12-W59 AromaticContact CH2-CE3 3.97Å; W12-W59 HydrophobicContact CH2-CE3 3.97Å; W12-W59 HydrophobicContact CH2-CG 4.45Å; W12-W59 HydrophobicContact CZ2-CB 4.26Å; W12-W59 HydrophobicContact CZ2-CE3 4.25Å; W12-W59 HydrophobicContact CZ3-CB 4.01Å; W12-W59 HydrophobicContact CZ3-CD2 4.2Å; W12-W59 AromaticContact CZ3-CE3 3.52Å; W12-W59 HydrophobicContact CZ3-CE3 3.52Å; W12-W59 HydrophobicContact CZ3-CG 4.44Å; W12-W59 HydrophobicContact CZ3-CZ3 4.32Å; I55-W59 PolarHBondContact O-N 2.86Å; F56-W59 PolarHBondContact O-N 3.19Å; K57-W59 VanDerWaalsContact C-N 3.3Å; K57-W59 PolarHBondContact O-N 3.23Å; W59-F62 AromaticContact CE3-CD1 3.67Å; W59-F62 HydrophobicContact CE3-CD1 3.67Å; W59-F62 HydrophobicContact CE3-CE1 4.28Å; W59-F62 HydrophobicContact CH2-CD1 4.3Å; W59-F62 HydrophobicContact CH2-CE1 4.31Å; W59-F62 AromaticContact CZ3-CD1 3.42Å; W59-F62 HydrophobicContact CZ3-CD1 3.42Å; W59-F62 VanDerWaalsContact CZ3-CD1 3.42Å; W59-F62 AromaticContact CZ3-CE1 3.58Å; W59-F62 HydrophobicContact CZ3-CE1 3.58Å; W59-F62 PolarHBondContact O-N 2.85Å; W59-K63 HydrophobicContact CD2-CG 3.93Å; W59-K63 HydrophobicContact CE3-CG 4.23Å; W59-K63 HydrophobicContact CH2-CD 3.65Å; W59-K63 HydrophobicContact CH2-CG 3.95Å; W59-K63 HydrophobicContact CZ2-CD 3.64Å; W59-K63 HydrophobicContact CZ2-CG 3.59Å; W59-K63 HydrophobicContact CZ3-CD 4.18Å; W59-K63 HydrophobicContact CZ3-CG 4.25Å; W59-K63 WeakPolarHBondContact O-CB 3.27Å; W59-K63 WeakPolarHBondContact O-CG 3.46Å; W59-K63 PolarHBondContact O-N 2.75Å; W59-L81 HydrophobicContact CB-CD1 4.25Å; W59-L81 HydrophobicContact CD2-CD1 3.89Å; W59-L81 HydrophobicContact CG-CB 4.25Å; W59-L81 HydrophobicContact CG-CD1 3.73Å; W59-L81 HydrophobicContact CG-CG 4.44Å; W59-A84 HydrophobicContact CZ2-CB 4.01Å
60	A	91.8	Very high	88.7	Confident	2 Å²	2	63.8 Å²	63.8	2%	0.017	35%	0.345	C	S	.	.	H	α-helix	trans	-64.1	-42	177.9	0	0	0	0	0	112.3	F56 K57 K63 G64 K65 F66 W77	F56-A60 PolarHBondContact O-N 3.13Å; K57-A60 WeakPolarHBondContact O-CB 3.42Å; K57-A60 PolarHBondContact O-N 3.39Å; K57-A60 VanDerWaalsContact O-N 3.07Å; A60-K63 PolarHBondContact O-N 3.37Å; A60-G64 PolarHBondContact O-N 3.03Å; A60-K65 PolarHBondContact O-N 3.19Å; A60-F66 HydrophobicContact CB-CB 3.87Å; A60-F66 PolarHBondContact O-N 3.08Å; A60-W77 HydrophobicContact CB-CB 4.4Å; A60-W77 VanDerWaalsContact CB-CD1 3.46Å; A60-W77 HydrophobicContact CB-CD2 4.37Å; A60-W77 HydrophobicContact CB-CG 3.83Å
61	V	90.5	Very high	88.5	Confident	79 Å²	79	64.4 Å²	64.4	48%	0.479	35%	0.345	S	S	.	.	H	α-helix	trans	-61.1	-48.5	172.8	173.5	0	0	0	0	110.3	K57 A58 K63 G64 F66	K57-V61 WeakPolarHBondContact O-CG2 3.35Å; K57-V61 PolarHBondContact O-N 3.09Å; A58-V61 PolarHBondContact O-N 3.46Å; V61-K63 VanDerWaalsContact C-N 3.3Å; V61-K63 PolarHBondContact O-N 3.49Å; V61-G64 WeakPolarHBondContact O-CA 3.11Å; V61-G64 PolarHBondContact O-N 3.15Å; V61-F66 HydrophobicContact CG2-CD1 3.69Å; V61-F66 HydrophobicContact CG2-CE1 4.43Å
62	F	89.8	Confident	88.2	Confident	33 Å²	33	63 Å²	63	15%	0.145	34%	0.34	C	S	.	.	H	α-helix	trans	-61.5	-36.8	-178.9	176.6	-101.5	0	0	0	113.1	R7 W12 A58 W59 G64	R7-F62 HydrophobicContact CB-CE1 4.41Å; R7-F62 HydrophobicContact CB-CE2 4.1Å; R7-F62 HydrophobicContact CB-CZ 3.43Å; R7-F62 VanDerWaalsContact CB-CZ 3.43Å; R7-F62 HydrophobicContact CG-CZ 4.44Å; W12-F62 HydrophobicContact CB-CD1 4.48Å; W12-F62 HydrophobicContact CB-CE1 3.8Å; W12-F62 HydrophobicContact CB-CE2 4.28Å; W12-F62 HydrophobicContact CB-CZ 3.62Å; W12-F62 AromaticContact CD1-CD1 3.77Å; W12-F62 AromaticContact CD1-CD2 3.2Å; W12-F62 AromaticContact CD1-CE1 3.73Å; W12-F62 AromaticContact CD1-CE2 3.15Å; W12-F62 AromaticContact CD1-CG 3.46Å; W12-F62 VanDerWaalsContact CD1-CG 3.46Å; W12-F62 AromaticContact CD1-CZ 3.36Å; W12-F62 HydrophobicContact CD2-CD1 4.18Å; W12-F62 HydrophobicContact CD2-CE1 4.37Å; W12-F62 HydrophobicContact CD2-CG 4.31Å; W12-F62 AromaticContact CE2-CG 3.91Å; W12-F62 AromaticContact CG-CD1 3.86Å; W12-F62 HydrophobicContact CG-CD1 3.86Å; W12-F62 HydrophobicContact CG-CD2 4.08Å; W12-F62 AromaticContact CG-CE1 3.65Å; W12-F62 HydrophobicContact CG-CE1 3.65Å; W12-F62 AromaticContact CG-CE2 3.88Å; W12-F62 HydrophobicContact CG-CE2 3.88Å; W12-F62 HydrophobicContact CG-CG 4.02Å; W12-F62 AromaticContact CG-CZ 3.59Å; W12-F62 HydrophobicContact CG-CZ 3.59Å; W12-F62 HydrophobicContact CZ2-CB 4.28Å; W12-F62 AromaticContact NE1-CD1 3.93Å; W12-F62 AromaticContact NE1-CD2 3.32Å; W12-F62 VanDerWaalsContact NE1-CD2 3.32Å; W12-F62 AromaticContact NE1-CE2 3.81Å; W12-F62 AromaticContact NE1-CG 3.33Å; W12-F62 VanDerWaalsContact NE1-CG 3.33Å; A58-F62 VanDerWaalsContact O-CB 3.26Å; A58-F62 WeakPolarHBondContact O-CB 3.45Å; A58-F62 PolarHBondContact O-N 2.73Å; W59-F62 AromaticContact CE3-CD1 3.67Å; W59-F62 HydrophobicContact CE3-CD1 3.67Å; W59-F62 HydrophobicContact CE3-CE1 4.28Å; W59-F62 HydrophobicContact CH2-CD1 4.3Å; W59-F62 HydrophobicContact CH2-CE1 4.31Å; W59-F62 AromaticContact CZ3-CD1 3.42Å; W59-F62 HydrophobicContact CZ3-CD1 3.42Å; W59-F62 VanDerWaalsContact CZ3-CD1 3.42Å; W59-F62 AromaticContact CZ3-CE1 3.58Å; W59-F62 HydrophobicContact CZ3-CE1 3.58Å; W59-F62 PolarHBondContact O-N 2.85Å; F62-G64 PolarHBondContact O-N 3.4Å
63	K	87.7	Confident	88	Confident	117 Å²	117	66.5 Å²	66.5	51%	0.509	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	1.6	173.6	-68	-60.3	-60.6	-179.4	0	113.8	W59 A60 V61 K65	W59-K63 HydrophobicContact CD2-CG 3.93Å; W59-K63 HydrophobicContact CE3-CG 4.23Å; W59-K63 HydrophobicContact CH2-CD 3.65Å; W59-K63 HydrophobicContact CH2-CG 3.95Å; W59-K63 HydrophobicContact CZ2-CD 3.64Å; W59-K63 HydrophobicContact CZ2-CG 3.59Å; W59-K63 HydrophobicContact CZ3-CD 4.18Å; W59-K63 HydrophobicContact CZ3-CG 4.25Å; W59-K63 WeakPolarHBondContact O-CB 3.27Å; W59-K63 WeakPolarHBondContact O-CG 3.46Å; W59-K63 PolarHBondContact O-N 2.75Å; A60-K63 PolarHBondContact O-N 3.37Å; V61-K63 VanDerWaalsContact C-N 3.3Å; V61-K63 PolarHBondContact O-N 3.49Å; K63-K65 HydrophobicContact CB-CG 4.18Å; K63-K65 PolarHBondContact O-N 2.92Å
64	G	86	Confident	87.8	Confident	54 Å²	54	67.3 Å²	67.3	56%	0.557	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	19.4	-178.3	0	0	0	0	0	113.9	A60 V61 F62	A60-G64 PolarHBondContact O-N 3.03Å; V61-G64 WeakPolarHBondContact O-CA 3.11Å; V61-G64 PolarHBondContact O-N 3.15Å; F62-G64 PolarHBondContact O-N 3.4Å
65	K	83.8	Confident	87.4	Confident	135 Å²	135	69.2 Å²	69.2	59%	0.587	38%	0.379	S	S	*	.	S	Bend	trans	-97.4	8	-178	-62.3	-64.1	-174.3	-178.4	0	113.3	A60 K63 R80	A60-K65 PolarHBondContact O-N 3.19Å; K63-K65 HydrophobicContact CB-CG 4.18Å; K63-K65 PolarHBondContact O-N 2.92Å; K65-R80 VanDerWaalsContact CB-NH1 3.34Å
66	F	86.3	Confident	87.1	Confident	16 Å²	16	71.2 Å²	71.2	7%	0.07	39%	0.392	C	S	.	.			trans	-155.5	136.2	174.4	176.6	-101.5	0	0	0	109.5	K57 A60 V61 D70 W77	K57-F66 HydrophobicContact CD-CE1 4.44Å; K57-F66 HydrophobicContact CG-CD1 4.32Å; K57-F66 HydrophobicContact CG-CE1 4.21Å; A60-F66 HydrophobicContact CB-CB 3.87Å; A60-F66 PolarHBondContact O-N 3.08Å; V61-F66 HydrophobicContact CG2-CD1 3.69Å; V61-F66 HydrophobicContact CG2-CE1 4.43Å; F66-D70 HydrophobicContact CD2-CB 3.74Å; F66-D70 HydrophobicContact CE2-CB 3.64Å; F66-D70 WeakPolarHBondContact CE2-O 3.32Å; F66-W77 HydrophobicContact CD1-CZ2 4.24Å; F66-W77 HydrophobicContact CD2-CH2 4.35Å; F66-W77 AromaticContact CD2-CZ2 3.42Å; F66-W77 HydrophobicContact CD2-CZ2 3.42Å; F66-W77 VanDerWaalsContact CD2-CZ2 3.42Å; F66-W77 HydrophobicContact CE1-CH2 4.44Å; F66-W77 HydrophobicContact CE1-CZ2 4.32Å; F66-W77 HydrophobicContact CE2-CH2 4.03Å; F66-W77 AromaticContact CE2-CZ2 3.47Å; F66-W77 HydrophobicContact CE2-CZ2 3.47Å; F66-W77 VanDerWaalsContact CE2-CZ2 3.47Å; F66-W77 AromaticContact CG-CZ2 3.81Å; F66-W77 HydrophobicContact CG-CZ2 3.81Å; F66-W77 HydrophobicContact CZ-CH2 4.09Å; F66-W77 AromaticContact CZ-CZ2 3.95Å; F66-W77 HydrophobicContact CZ-CZ2 3.95Å
67	K	83.3	Confident	87	Confident	151 Å²	151	71.5 Å²	71.5	66%	0.657	39%	0.393	S	S	*	.			trans	-122.5	154.4	172.1	-63.9	179.4	-177.5	177.7	0	110.2	G69 D70	K67-G69 PolarHBondContact O-N 2.97Å; K67-D70 PolarHBondContact N-OD2 3.41Å; K67-D70 WeakPolarHBondContact O-CB 3.46Å; K67-D70 PolarHBondContact O-N 2.65Å
68	E	74.8	Confident	87	Confident	185 Å²	185	69 Å²	69	86%	0.864	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	117.9	178.3	-163.1	144.9	-134.7	0	0	109.9
69	G	74.5	Confident	86.8	Confident	80 Å²	80	71.2 Å²	71.2	83%	0.825	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	113.4	-18.6	-169.8	0	0	0	0	0	114.3	K67	K67-G69 PolarHBondContact O-N 2.97Å
70	D	82.7	Confident	86.7	Confident	87 Å²	87	75.5 Å²	75.5	47%	0.465	41%	0.41	S	S	.	.	S	Bend	trans	-71.6	154.9	173.3	-65.6	-21	0	0	0	111.1	F66 K67 A72	F66-D70 HydrophobicContact CD2-CB 3.74Å; F66-D70 HydrophobicContact CE2-CB 3.64Å; F66-D70 WeakPolarHBondContact CE2-O 3.32Å; K67-D70 PolarHBondContact N-OD2 3.41Å; K67-D70 WeakPolarHBondContact O-CB 3.46Å; K67-D70 PolarHBondContact O-N 2.65Å; D70-A72 PolarHBondContact O-N 3.24Å
71	K	83.6	Confident	86.8	Confident	179 Å²	179	75.4 Å²	75.4	78%	0.778	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-60.3	125.2	173.4	-173.9	-177.9	177.6	-171.8	0	109.9	E73	K71-E73 PolarHBondContact O-N 2.98Å
72	A	84.4	Confident	87	Confident	41 Å²	41	76.7 Å²	76.7	34%	0.339	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-72.6	129.1	179.8	0	0	0	0	0	111.7	D70 W77	D70-A72 PolarHBondContact O-N 3.24Å; A72-W77 HydrophobicContact CB-CH2 3.57Å; A72-W77 HydrophobicContact CB-CZ2 4.15Å; A72-W77 HydrophobicContact CB-CZ3 4.42Å
73	E	87.9	Confident	87	Confident	87 Å²	87	77.8 Å²	77.8	41%	0.407	42%	0.416	S	S	.	.			trans	-130.8	77.6	178.1	-64	-165.8	155.4	0	0	111.9	K71 A75 T76 W77	K71-E73 PolarHBondContact O-N 2.98Å; E73-A75 VanDerWaalsContact C-N 3.28Å; E73-A75 PolarHBondContact O-N 2.71Å; E73-T76 WeakPolarHBondContact O-CB 3.21Å; E73-T76 PolarHBondContact O-N 2.91Å; E73-T76 VanDerWaalsContact O-N 3.1Å; E73-T76 PolarHBondContact OE2-OG1 2.94Å; E73-W77 PolarHBondContact O-N 2.87Å; E73-W77 VanDerWaalsContact O-N 3.09Å
74	P	88.5	Confident	87.3	Confident	18 Å²	18	73.5 Å²	73.5	12%	0.117	40%	0.403	C	S	.	.	H	α-helix	trans	-56.4	-37.9	-176.4	-28.1	36.6	0	0	0	114.4	Q49 A53 W77 K78	Q49-P74 HydrophobicContact CG-CG 3.5Å; A53-P74 HydrophobicContact CB-CB 3.82Å; A53-P74 HydrophobicContact CB-CG 4.26Å; P74-W77 HydrophobicContact CG-CZ3 4.35Å; P74-W77 PolarHBondContact O-N 3.16Å; P74-K78 WeakPolarHBondContact O-CB 3.34Å; P74-K78 PolarHBondContact O-N 3.48Å
75	A	87.3	Confident	87.6	Confident	68 Å²	68	71 Å²	71	56%	0.562	38%	0.377	S	S	*	.	H	α-helix	trans	-64.1	-41.3	178.4	0	0	0	0	0	112.2	E73 T79	E73-A75 VanDerWaalsContact C-N 3.28Å; E73-A75 PolarHBondContact O-N 2.71Å; A75-T79 WeakPolarHBondContact O-CB 3.17Å; A75-T79 PolarHBondContact O-N 3.27Å; A75-T79 PolarHBondContact O-OG1 3.45Å
76	T	89.1	Confident	88	Confident	44 Å²	44	69.4 Å²	69.4	27%	0.27	37%	0.374	S	S	.	.	H	α-helix	trans	-64.1	-46.1	176.1	-55.8	0	0	0	0	110.5	E73 T79 R80	E73-T76 WeakPolarHBondContact O-CB 3.21Å; E73-T76 PolarHBondContact O-N 2.91Å; E73-T76 VanDerWaalsContact O-N 3.1Å; E73-T76 PolarHBondContact OE2-OG1 2.94Å; T76-T79 PolarHBondContact O-N 3.1Å; T76-R80 WeakPolarHBondContact O-CG 3.49Å; T76-R80 PolarHBondContact O-N 3.38Å
77	W	93.8	Very high	88.1	Confident	8 Å²	8	77.4 Å²	77.4	3%	0.03	41%	0.409	C	S	.	.	H	α-helix	trans	-63.1	-46.4	179.3	-56	-23.9	0	0	0	112.5	A53 F56 K57 A60 F66 A72 E73 P74 T79 R80 L81	A53-W77 HydrophobicContact CB-CE3 4.48Å; F56-W77 HydrophobicContact CB-CB 3.78Å; K57-W77 HydrophobicContact CB-CD2 4.44Å; K57-W77 HydrophobicContact CB-CE3 3.68Å; K57-W77 HydrophobicContact CB-CH2 4.36Å; K57-W77 HydrophobicContact CB-CZ3 3.64Å; K57-W77 HydrophobicContact CD-CH2 4.31Å; K57-W77 HydrophobicContact CD-CZ3 4.15Å; K57-W77 HydrophobicContact CG-CE3 4.17Å; K57-W77 HydrophobicContact CG-CH2 3.96Å; K57-W77 HydrophobicContact CG-CZ3 3.73Å; A60-W77 HydrophobicContact CB-CB 4.4Å; A60-W77 VanDerWaalsContact CB-CD1 3.46Å; A60-W77 HydrophobicContact CB-CD2 4.37Å; A60-W77 HydrophobicContact CB-CG 3.83Å; F66-W77 HydrophobicContact CD1-CZ2 4.24Å; F66-W77 HydrophobicContact CD2-CH2 4.35Å; F66-W77 AromaticContact CD2-CZ2 3.42Å; F66-W77 HydrophobicContact CD2-CZ2 3.42Å; F66-W77 VanDerWaalsContact CD2-CZ2 3.42Å; F66-W77 HydrophobicContact CE1-CH2 4.44Å; F66-W77 HydrophobicContact CE1-CZ2 4.32Å; F66-W77 HydrophobicContact CE2-CH2 4.03Å; F66-W77 AromaticContact CE2-CZ2 3.47Å; F66-W77 HydrophobicContact CE2-CZ2 3.47Å; F66-W77 VanDerWaalsContact CE2-CZ2 3.47Å; F66-W77 AromaticContact CG-CZ2 3.81Å; F66-W77 HydrophobicContact CG-CZ2 3.81Å; F66-W77 HydrophobicContact CZ-CH2 4.09Å; F66-W77 AromaticContact CZ-CZ2 3.95Å; F66-W77 HydrophobicContact CZ-CZ2 3.95Å; A72-W77 HydrophobicContact CB-CH2 3.57Å; A72-W77 HydrophobicContact CB-CZ2 4.15Å; A72-W77 HydrophobicContact CB-CZ3 4.42Å; E73-W77 PolarHBondContact O-N 2.87Å; E73-W77 VanDerWaalsContact O-N 3.09Å; P74-W77 HydrophobicContact CG-CZ3 4.35Å; P74-W77 PolarHBondContact O-N 3.16Å; W77-T79 VanDerWaalsContact C-N 3.32Å; W77-T79 PolarHBondContact O-N 3.02Å; W77-R80 PolarHBondContact O-N 3.38Å; W77-L81 PolarHBondContact O-N 3.11Å
78	K	93.2	Very high	88.4	Confident	29 Å²	29	71.1 Å²	71.1	13%	0.126	38%	0.384	C	S	.	.	H	α-helix	trans	-59.8	-43	177	-174.8	174.1	-173.7	178	0	111.5	W39 K40 F56 P74 L81 R82	W39-K78 HydrophobicContact CZ2-CG 4.29Å; W39-K78 VanDerWaalsContact NE1-CE 3.26Å; W39-K78 PolarHBondContact O-NZ 3.38Å; K40-K78 PolarHBondContact O-NZ 2.98Å; F56-K78 HydrophobicContact CD1-CB 4.17Å; F56-K78 HydrophobicContact CD1-CG 4.22Å; F56-K78 HydrophobicContact CD2-CB 4.03Å; F56-K78 HydrophobicContact CD2-CG 4.2Å; F56-K78 HydrophobicContact CE1-CB 4.41Å; F56-K78 HydrophobicContact CE1-CG 3.95Å; F56-K78 HydrophobicContact CE2-CB 4.32Å; F56-K78 HydrophobicContact CE2-CD 4.07Å; F56-K78 HydrophobicContact CE2-CG 3.97Å; F56-K78 HydrophobicContact CG-CB 4Å; F56-K78 HydrophobicContact CG-CG 4.37Å; F56-K78 HydrophobicContact CZ-CD 4.21Å; F56-K78 HydrophobicContact CZ-CG 3.84Å; P74-K78 WeakPolarHBondContact O-CB 3.34Å; P74-K78 PolarHBondContact O-N 3.48Å; K78-L81 PolarHBondContact O-N 3.4Å; K78-R82 WeakPolarHBondContact O-CB 3.23Å; K78-R82 PolarHBondContact O-N 3.4Å
79	T	89.9	Confident	89.1	Confident	64 Å²	64	66 Å²	66	39%	0.393	37%	0.367	S	S	.	.	H	α-helix	trans	-62.3	-44.7	177.1	-63.7	0	0	0	0	111.8	A75 T76 W77 R82 C83	A75-T79 WeakPolarHBondContact O-CB 3.17Å; A75-T79 PolarHBondContact O-N 3.27Å; A75-T79 PolarHBondContact O-OG1 3.45Å; T76-T79 PolarHBondContact O-N 3.1Å; W77-T79 VanDerWaalsContact C-N 3.32Å; W77-T79 PolarHBondContact O-N 3.02Å; T79-R82 PolarHBondContact O-N 2.85Å; T79-C83 PolarHBondContact O-N 3.07Å; T79-C83 PolarHBondContact O-SG 2.92Å; T79-C83 VanDerWaalsContact O-SG 3.34Å
80	R	91.7	Very high	89.9	Confident	109 Å²	109	62.7 Å²	62.7	41%	0.411	33%	0.33	S	S	.	.	H	α-helix	trans	-62.5	-44.8	178.8	-74.5	176.1	178.7	165.8	1.5	112.6	K65 T76 W77 C83 A84	K65-R80 VanDerWaalsContact CB-NH1 3.34Å; T76-R80 WeakPolarHBondContact O-CG 3.49Å; T76-R80 PolarHBondContact O-N 3.38Å; W77-R80 PolarHBondContact O-N 3.38Å; R80-C83 PolarHBondContact O-N 2.9Å; R80-A84 WeakPolarHBondContact O-CB 3.47Å; R80-A84 PolarHBondContact O-N 3.32Å
81	L	94	Very high	90.5	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-65.8	-43.1	177.4	-176	59	0	0	0	111.4	L9 F56 W59 W77 K78 C83 A84 L85	L9-L81 HydrophobicContact CD1-CD1 3.79Å; F56-L81 HydrophobicContact CD1-CB 3.99Å; F56-L81 HydrophobicContact CD1-CD2 3.55Å; F56-L81 HydrophobicContact CD1-CG 4.34Å; F56-L81 HydrophobicContact CE1-CD2 3.83Å; W59-L81 HydrophobicContact CB-CD1 4.25Å; W59-L81 HydrophobicContact CD2-CD1 3.89Å; W59-L81 HydrophobicContact CG-CB 4.25Å; W59-L81 HydrophobicContact CG-CD1 3.73Å; W59-L81 HydrophobicContact CG-CG 4.44Å; W77-L81 PolarHBondContact O-N 3.11Å; K78-L81 PolarHBondContact O-N 3.4Å; L81-C83 VanDerWaalsContact C-N 3.35Å; L81-C83 PolarHBondContact O-N 3.37Å; L81-A84 WeakPolarHBondContact O-CB 3.22Å; L81-A84 PolarHBondContact O-N 3.32Å; L81-A84 VanDerWaalsContact O-N 3.13Å; L81-L85 HydrophobicContact CD1-CD1 4.47Å; L81-L85 HydrophobicContact CD1-CG 4.39Å; L81-L85 HydrophobicContact CG-CD1 4.08Å; L81-L85 HydrophobicContact CG-CG 4.48Å; L81-L85 WeakPolarHBondContact O-CG 3.36Å; L81-L85 PolarHBondContact O-N 2.82Å
82	R	94	Very high	91	Very high	106 Å²	106	54.9 Å²	54.9	40%	0.4	29%	0.293	S	S	.	.	H	α-helix	trans	-55.1	-48.8	175.1	179.9	-177.8	59.6	147.6	-4	111.9	W39 K78 T79 A84 L85 N86	W39-R82 HydrophobicContact CH2-CB 3.93Å; W39-R82 HydrophobicContact CH2-CG 4.34Å; W39-R82 HydrophobicContact CZ2-CB 4.07Å; W39-R82 HydrophobicContact CZ2-CG 4.19Å; K78-R82 WeakPolarHBondContact O-CB 3.23Å; K78-R82 PolarHBondContact O-N 3.4Å; T79-R82 PolarHBondContact O-N 2.85Å; R82-A84 VanDerWaalsContact C-N 3.3Å; R82-A84 PolarHBondContact O-N 3.34Å; R82-L85 PolarHBondContact O-N 3.38Å; R82-N86 WeakPolarHBondContact O-CB 2.99Å; R82-N86 PolarHBondContact O-N 3.48Å; R82-N86 PolarHBondContact O-OD1 2.95Å
83	C	90.8	Very high	91.5	Very high	56 Å²	56	55.5 Å²	55.5	38%	0.378	29%	0.29	S	S	.	.	H	α-helix	trans	-63.6	-37.2	178.5	-69.2	0	0	0	0	112	T79 R80 L81 K87	T79-C83 PolarHBondContact O-N 3.07Å; T79-C83 PolarHBondContact O-SG 2.92Å; T79-C83 VanDerWaalsContact O-SG 3.34Å; R80-C83 PolarHBondContact O-N 2.9Å; L81-C83 VanDerWaalsContact C-N 3.35Å; L81-C83 PolarHBondContact O-N 3.37Å; C83-K87 WeakPolarHBondContact O-CB 3.28Å; C83-K87 WeakPolarHBondContact O-CG 3.4Å; C83-K87 PolarHBondContact O-N 2.9Å
84	A	92.9	Very high	91.9	Very high	27 Å²	27	52.1 Å²	52.1	22%	0.223	28%	0.275	C	S	.	.	H	α-helix	trans	-66.3	-41.9	177.6	0	0	0	0	0	111.9	L9 W59 R80 L81 R82 S88	L9-A84 VanDerWaalsContact CD2-C 3.45Å; L9-A84 HydrophobicContact CD2-CB 3.77Å; L9-A84 WeakPolarHBondContact CD2-O 3.44Å; W59-A84 HydrophobicContact CZ2-CB 4.01Å; R80-A84 WeakPolarHBondContact O-CB 3.47Å; R80-A84 PolarHBondContact O-N 3.32Å; L81-A84 WeakPolarHBondContact O-CB 3.22Å; L81-A84 PolarHBondContact O-N 3.32Å; L81-A84 VanDerWaalsContact O-N 3.13Å; R82-A84 VanDerWaalsContact C-N 3.3Å; R82-A84 PolarHBondContact O-N 3.34Å; A84-S88 WeakPolarHBondContact O-CB 3.47Å; A84-S88 PolarHBondContact O-N 3.46Å
85	L	94.1	Very high	92	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-62.8	-49.1	174.4	-70.1	165.1	0	0	0	111.2	L9 L13 I37 L81 R82 K87 S88 F91 Y109	L9-L85 HydrophobicContact CD2-CD2 4.14Å; L9-L85 HydrophobicContact CD2-CG 4.4Å; L13-L85 HydrophobicContact CD2-CD2 3.86Å; I37-L85 HydrophobicContact CD1-CD1 3.6Å; L81-L85 HydrophobicContact CD1-CD1 4.47Å; L81-L85 HydrophobicContact CD1-CG 4.39Å; L81-L85 HydrophobicContact CG-CD1 4.08Å; L81-L85 HydrophobicContact CG-CG 4.48Å; L81-L85 WeakPolarHBondContact O-CG 3.36Å; L81-L85 PolarHBondContact O-N 2.82Å; R82-L85 PolarHBondContact O-N 3.38Å; L85-K87 VanDerWaalsContact C-N 3.32Å; L85-K87 PolarHBondContact O-N 3.08Å; L85-S88 PolarHBondContact O-N 3.17Å; L85-F91 HydrophobicContact CD2-CD1 4.47Å; L85-F91 HydrophobicContact CD2-CD2 3.82Å; L85-F91 HydrophobicContact CD2-CE2 3.99Å; L85-F91 HydrophobicContact CD2-CG 4.04Å; L85-F91 HydrophobicContact CD2-CZ 4.31Å; L85-Y109 HydrophobicContact CB-CE1 4.11Å; L85-Y109 HydrophobicContact CD1-CE1 4.16Å; L85-Y109 HydrophobicContact CD1-CE2 4.07Å
86	N	90.4	Very high	92.1	Very high	100 Å²	100	59.5 Å²	59.5	54%	0.535	30%	0.302	S	S	.	.	H	α-helix	trans	-67.5	-28.8	-176.3	-72.3	4.3	0	0	0	114.2	R82	R82-N86 WeakPolarHBondContact O-CB 2.99Å; R82-N86 PolarHBondContact O-N 3.48Å; R82-N86 PolarHBondContact O-OD1 2.95Å
87	K	88.9	Confident	92.1	Very high	185 Å²	185	63.6 Å²	63.6	80%	0.804	31%	0.312	S	S	*	.	H	α-helix	trans	-86.7	-14	177.9	-72.1	-175.6	177.1	-168.6	0	113	C83 L85	C83-K87 WeakPolarHBondContact O-CB 3.28Å; C83-K87 WeakPolarHBondContact O-CG 3.4Å; C83-K87 PolarHBondContact O-N 2.9Å; L85-K87 VanDerWaalsContact C-N 3.32Å; L85-K87 PolarHBondContact O-N 3.08Å
88	S	90.6	Very high	91.9	Very high	19 Å²	19	64.3 Å²	64.3	13%	0.133	32%	0.319	C	S	.	.			trans	-85.9	126.2	-173.9	179.8	0	0	0	0	110.4	A84 L85 D90 F91	A84-S88 WeakPolarHBondContact O-CB 3.47Å; A84-S88 PolarHBondContact O-N 3.46Å; L85-S88 PolarHBondContact O-N 3.17Å; S88-D90 PolarHBondContact O-N 3.25Å; S88-D90 WeakPolarHBondContact OG-CB 3.39Å; S88-D90 PolarHBondContact OG-N 2.74Å; S88-F91 PolarHBondContact O-N 2.83Å
89	P	88.3	Confident	91.7	Very high	76 Å²	76	66.5 Å²	66.5	49%	0.494	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-18.1	175.7	29.8	-35.6	0	0	0	112.2	F91 V112 Q117	P89-F91 PolarHBondContact O-N 2.89Å; P89-V112 WeakPolarHBondContact O-CB 3.17Å; P89-Q117 HydrophobicContact CB-CB 4.39Å; P89-Q117 HydrophobicContact CB-CG 4.43Å
90	D	91.9	Very high	91.6	Very high	11 Å²	11	66.4 Å²	66.4	6%	0.059	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-14.9	177.9	-72	-50.9	0	0	0	114.7	K10 S88 I111 V112 Q117	K10-D90 HydrophobicContact CB-CB 4.07Å; K10-D90 HydrophobicContact CD-CB 3.84Å; K10-D90 VanDerWaalsContact CD-CG 3.47Å; K10-D90 VanDerWaalsContact CD-OD1 3.27Å; K10-D90 WeakPolarHBondContact CD-OD1 3.26Å; K10-D90 HydrophobicContact CG-CB 4.36Å; K10-D90 IonicContact NZ-OD1 3.63Å; S88-D90 PolarHBondContact O-N 3.25Å; S88-D90 WeakPolarHBondContact OG-CB 3.39Å; S88-D90 PolarHBondContact OG-N 2.74Å; D90-I111 WeakPolarHBondContact O-CA 3.37Å; D90-V112 PolarHBondContact O-N 3.49Å; D90-Q117 PolarHBondContact OD1-NE2 3.07Å
91	F	95	Very high	91	Very high	17 Å²	17	65 Å²	65	8%	0.075	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	139.5	-171.3	-58	-71.6	0	0	0	112.9	L9 K10 L13 F35 L85 S88 P89 R110 I111	L9-F91 HydrophobicContact CB-CE2 4.42Å; L9-F91 HydrophobicContact CD2-CD2 4.15Å; L9-F91 HydrophobicContact CD2-CE2 3.7Å; L9-F91 HydrophobicContact CG-CE2 3.72Å; L9-F91 HydrophobicContact CG-CZ 4.38Å; K10-F91 HydrophobicContact CB-CE2 4.35Å; K10-F91 HydrophobicContact CB-CZ 4.1Å; L13-F91 HydrophobicContact CB-CZ 4.43Å; L13-F91 HydrophobicContact CD2-CE1 3.97Å; L13-F91 HydrophobicContact CD2-CZ 3.75Å; F35-F91 AromaticContact CE1-CD1 3.76Å; F35-F91 HydrophobicContact CE1-CD1 3.76Å; F35-F91 AromaticContact CE1-CE1 3.58Å; F35-F91 HydrophobicContact CE1-CE1 3.58Å; F35-F91 AromaticContact CZ-CD1 3.8Å; F35-F91 HydrophobicContact CZ-CD1 3.8Å; F35-F91 AromaticContact CZ-CE1 3.59Å; F35-F91 HydrophobicContact CZ-CE1 3.59Å; F35-F91 HydrophobicContact CZ-CZ 4.5Å; L85-F91 HydrophobicContact CD2-CD1 4.47Å; L85-F91 HydrophobicContact CD2-CD2 3.82Å; L85-F91 HydrophobicContact CD2-CE2 3.99Å; L85-F91 HydrophobicContact CD2-CG 4.04Å; L85-F91 HydrophobicContact CD2-CZ 4.31Å; S88-F91 PolarHBondContact O-N 2.83Å; P89-F91 PolarHBondContact O-N 2.89Å; F91-R110 WeakPolarHBondContact CA-O 3.42Å; F91-I111 HydrophobicContact CD1-CG1 4.37Å; F91-I111 HydrophobicContact CE1-CG1 4.22Å
92	E	94.2	Very high	90.4	Very high	85 Å²	85	68 Å²	68	40%	0.397	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	128.9	169.7	-173.1	-178.2	128.8	0	0	109.4	V94 Y109 R110 V112	E92-V94 PolarHBondContact O-N 2.91Å; E92-Y109 CarbonylContact O-C 3.59Å; E92-Y109 VanDerWaalsContact O-CA 3.28Å; E92-Y109 WeakPolarHBondContact O-CA 3.42Å; E92-R110 VanDerWaalsContact CD-NH1 3.26Å; E92-R110 VanDerWaalsContact CD-NH2 3.26Å; E92-R110 PolarHBondContact N-O 3.21Å; E92-R110 PolarHBondContact O-N 2.88Å; E92-R110 IonicContact OE1-CZ 3.63Å; E92-R110 IonicContact OE1-NH1 2.65Å; E92-R110 PolarHBondContact OE1-NH1 3.31Å; E92-R110 IonicContact OE1-NH2 3.76Å; E92-R110 PolarHBondContact OE1-NH2 3.38Å; E92-R110 IonicContact OE2-CZ 3.94Å; E92-R110 IonicContact OE2-NH1 3.49Å; E92-R110 PolarHBondContact OE2-NH1 2.65Å; E92-R110 IonicContact OE2-NH2 3.54Å; E92-R110 PolarHBondContact OE2-NH2 3.5Å; E92-V112 HydrophobicContact CB-CG2 3.92Å
93	E	95.5	Very high	89.9	Confident	55 Å²	55	66 Å²	66	26%	0.257	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	121.6	174.1	-173	175.4	165.5	0	0	109.7	T95 K107 Y109	E93-T95 HydrophobicContact CG-CG2 4.01Å; E93-T95 PolarHBondContact O-N 2.97Å; E93-K107 WeakPolarHBondContact OE1-CE 3.32Å; E93-K107 IonicContact OE1-NZ 3.54Å; E93-K107 PolarHBondContact OE1-NZ 2.92Å; E93-K107 IonicContact OE2-NZ 2.86Å; E93-K107 PolarHBondContact OE2-NZ 3.37Å; E93-Y109 HydrophobicContact CB-CD1 3.98Å; E93-Y109 HydrophobicContact CB-CE1 3.79Å; E93-Y109 HydrophobicContact CG-CD1 4.41Å; E93-Y109 HydrophobicContact CG-CE1 4.03Å
94	V	95.3	Very high	89.6	Confident	15 Å²	15	68.2 Å²	68.2	9%	0.091	35%	0.349	C	S	.	.			trans	-93.4	87.1	175.5	-172.2	0	0	0	0	107.8	E92 E96 R97 S98 V108 R110	E92-V94 PolarHBondContact O-N 2.91Å; V94-E96 VanDerWaalsContact C-N 3.27Å; V94-E96 PolarHBondContact O-N 3.4Å; V94-R97 HydrophobicContact CG1-CB 4Å; V94-R97 HydrophobicContact CG1-CG 3.84Å; V94-R97 PolarHBondContact O-N 3.08Å; V94-S98 PolarHBondContact O-N 3.25Å; V94-S98 PolarHBondContact O-OG 3.35Å; V94-V108 HydrophobicContact CB-CB 4.43Å; V94-V108 HydrophobicContact CB-CG1 4.19Å; V94-V108 PolarHBondContact N-O 2.65Å; V94-R110 HydrophobicContact CG2-CB 3.76Å
95	T	90.4	Very high	89.6	Confident	83 Å²	83	67 Å²	67	51%	0.509	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-66	-30.5	-170.7	65.1	0	0	0	0	112.8	E93 R97 S98	E93-T95 HydrophobicContact CG-CG2 4.01Å; E93-T95 PolarHBondContact O-N 2.97Å; T95-R97 VanDerWaalsContact C-N 3.25Å; T95-R97 PolarHBondContact O-N 2.82Å; T95-S98 WeakPolarHBondContact O-CB 3.35Å; T95-S98 PolarHBondContact O-N 2.89Å
96	E	89.4	Confident	89.7	Confident	159 Å²	159	68.1 Å²	68.1	74%	0.743	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-66.6	-28.9	-179.6	-56.7	72.7	-155.6	0	0	111.8	V94	V94-E96 VanDerWaalsContact C-N 3.27Å; V94-E96 PolarHBondContact O-N 3.4Å
97	R	89	Confident	90	Very high	130 Å²	130	64.5 Å²	64.5	49%	0.491	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-95.6	-11.1	178.1	-65.3	-169.5	173.4	-150.4	-1.3	113.4	V94 T95 Y106 V108	V94-R97 HydrophobicContact CG1-CB 4Å; V94-R97 HydrophobicContact CG1-CG 3.84Å; V94-R97 PolarHBondContact O-N 3.08Å; T95-R97 VanDerWaalsContact C-N 3.25Å; T95-R97 PolarHBondContact O-N 2.82Å; R97-Y106 WeakPolarHBondContact O-CE2 3.29Å; R97-V108 HydrophobicContact CB-CB 3.98Å; R97-V108 HydrophobicContact CB-CG1 4.13Å; R97-V108 HydrophobicContact CB-CG2 3.9Å; R97-V108 VanDerWaalsContact O-CG2 3.31Å; R97-V108 WeakPolarHBondContact O-CG2 3.04Å
98	S	91.3	Very high	90.4	Very high	23 Å²	23	55.7 Å²	55.7	16%	0.161	28%	0.284	C	S	.	.			trans	-74	137	178.6	-64.3	0	0	0	0	111.2	V94 T95 V108	V94-S98 PolarHBondContact O-N 3.25Å; V94-S98 PolarHBondContact O-OG 3.35Å; T95-S98 WeakPolarHBondContact O-CB 3.35Å; T95-S98 PolarHBondContact O-N 2.89Å; S98-V108 PolarHBondContact OG-N 2.88Å
99	Q	87.8	Confident	90.7	Very high	74 Å²	74	54.9 Å²	54.9	35%	0.346	28%	0.278	S	S	.	.	B	Isolated β-bridge	trans	-124.2	93.4	-179	-61.1	-168.1	19.6	0	0	110.4	I102 P105 Y106	Q99-I102 HydrophobicContact CB-CD1 3.89Å; Q99-I102 HydrophobicContact CB-CG1 4.03Å; Q99-I102 HydrophobicContact CB-CG2 4.37Å; Q99-P105 CarbonylContact O-C 3.56Å; Q99-P105 WeakPolarHBondContact O-CA 3.47Å; Q99-P105 WeakPolarHBondContact O-CB 3.41Å; Q99-Y106 CarbonylContact C-O 3.52Å; Q99-Y106 HydrophobicContact CB-CD1 4.28Å; Q99-Y106 HydrophobicContact CB-CE1 3.8Å; Q99-Y106 HydrophobicContact CB-CE2 4.17Å; Q99-Y106 HydrophobicContact CG-CE1 4.12Å; Q99-Y106 HydrophobicContact CG-CE2 4.1Å; Q99-Y106 WeakPolarHBondContact CG-OH 3.47Å; Q99-Y106 PolarHBondContact N-O 3.42Å; Q99-Y106 PolarHBondContact NE2-OH 3.4Å; Q99-Y106 PolarHBondContact O-N 3.42Å
100	L	88.6	Confident	91.1	Very high	63 Å²	63	54.4 Å²	54.4	33%	0.33	27%	0.267	S	S	.	.			trans	-91.7	-16	-178.4	-63.7	179.2	0	0	0	114.3	W39 P105 K107	W39-L100 HydrophobicContact CB-CD2 3.78Å; W39-L100 HydrophobicContact CG-CD2 3.96Å; L100-P105 WeakPolarHBondContact O-CB 3.42Å; L100-K107 HydrophobicContact CD2-CG 3.79Å
101	D	78.6	Confident	91.2	Very high	79 Å²	79	54.9 Å²	54.9	42%	0.422	27%	0.269	S	S	.	.	S	Bend	trans	-100.1	10.1	-172.6	-67	-47.3	0	0	0	113.4	R304	D101-R304 VanDerWaalsContact CG-NH2 3.35Å; D101-R304 IonicContact OD1-CZ 3.38Å; D101-R304 IonicContact OD1-NH2 3.5Å; D101-R304 PolarHBondContact OD1-NH2 3.4Å; D101-R304 IonicContact OD2-NH2 3.98Å; D101-R304 PolarHBondContact OD2-NH2 3.03Å
102	I	81.8	Confident	91	Very high	62 Å²	62	54.6 Å²	54.6	32%	0.318	27%	0.269	S	S	.	.	S	Bend	trans	-96.7	175.8	177.9	62	166.5	0	0	0	112.2	K44 Q99 E104 Y106	K44-I102 PolarHBondContact NZ-O 2.8Å; K44-I102 VanDerWaalsContact NZ-O 3.16Å; Q99-I102 HydrophobicContact CB-CD1 3.89Å; Q99-I102 HydrophobicContact CB-CG1 4.03Å; Q99-I102 HydrophobicContact CB-CG2 4.37Å; I102-E104 WeakPolarHBondContact CD1-O 3.34Å; I102-E104 WeakPolarHBondContact CG1-O 3.49Å; I102-Y106 HydrophobicContact CD1-CD1 3.82Å; I102-Y106 HydrophobicContact CD1-CE1 3.56Å
103	S	82.3	Confident	90.7	Very high	65 Å²	65	53.6 Å²	53.6	46%	0.455	27%	0.269	S	S	.	.	S	Bend	trans	-61.9	-44.8	179.8	54.6	0	0	0	0	112.2	P105	S103-P105 VanDerWaalsContact C-CD 3.45Å; S103-P105 WeakPolarHBondContact O-CD 3.42Å
104	E	86.1	Confident	90	Very high	102 Å²	102	57.8 Å²	57.8	48%	0.477	29%	0.289	S	S	.	.	S	Bend	trans	-109.2	76.2	175.5	-64.4	-53.6	136	0	0	109.2	K40 I102	K40-E104 IonicContact NZ-OE1 3.17Å; I102-E104 WeakPolarHBondContact CD1-O 3.34Å; I102-E104 WeakPolarHBondContact CG1-O 3.49Å
105	P	92.2	Very high	89.3	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.006	32%	0.324	C	S	.	.			trans	-67.2	147.4	-172.7	30.1	-37	0	0	0	111	P38 W39 K40 Q99 L100 S103	P38-P105 CarbonylContact C-O 3.55Å; P38-P105 WeakPolarHBondContact CA-O 3.32Å; W39-P105 PolarHBondContact N-O 2.87Å; K40-P105 HydrophobicContact CB-CG 4.08Å; K40-P105 HydrophobicContact CG-CG 4.18Å; Q99-P105 CarbonylContact O-C 3.56Å; Q99-P105 WeakPolarHBondContact O-CA 3.47Å; Q99-P105 WeakPolarHBondContact O-CB 3.41Å; L100-P105 WeakPolarHBondContact O-CB 3.42Å; S103-P105 VanDerWaalsContact C-CD 3.45Å; S103-P105 WeakPolarHBondContact O-CD 3.42Å
106	Y	96.1	Very high	89	Confident	26 Å²	26	66.6 Å²	66.6	10%	0.102	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	158	179.1	62.1	-97	0	0	0	112.4	R36 I37 R97 Q99 I102 V108	R36-Y106 HydrophobicContact CB-CD2 3.71Å; R36-Y106 HydrophobicContact CB-CE2 4.36Å; R36-Y106 HydrophobicContact CB-CG 4.18Å; R36-Y106 HydrophobicContact CG-CD2 4.46Å; I37-Y106 CarbonylContact O-C 3.59Å; I37-Y106 WeakPolarHBondContact O-CA 3.48Å; I37-Y106 WeakPolarHBondContact O-CB 3.11Å; R97-Y106 WeakPolarHBondContact O-CE2 3.29Å; Q99-Y106 CarbonylContact C-O 3.52Å; Q99-Y106 HydrophobicContact CB-CD1 4.28Å; Q99-Y106 HydrophobicContact CB-CE1 3.8Å; Q99-Y106 HydrophobicContact CB-CE2 4.17Å; Q99-Y106 HydrophobicContact CG-CE1 4.12Å; Q99-Y106 HydrophobicContact CG-CE2 4.1Å; Q99-Y106 WeakPolarHBondContact CG-OH 3.47Å; Q99-Y106 PolarHBondContact N-O 3.42Å; Q99-Y106 PolarHBondContact NE2-OH 3.4Å; Q99-Y106 PolarHBondContact O-N 3.42Å; I102-Y106 HydrophobicContact CD1-CD1 3.82Å; I102-Y106 HydrophobicContact CD1-CE1 3.56Å; Y106-V108 HydrophobicContact CD2-CG2 3.84Å; Y106-V108 HydrophobicContact CE2-CG2 3.67Å
107	K	96.9	Very high	88.4	Confident	24 Å²	24	61.1 Å²	61.1	10%	0.104	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	139.4	169.6	-72.7	-170.1	166.1	-133.1	0	110.2	R36 I37 W39 E93 L100 Y109	R36-K107 CarbonylContact C-O 3.48Å; R36-K107 WeakPolarHBondContact CA-O 3.18Å; I37-K107 PolarHBondContact N-O 3.34Å; I37-K107 PolarHBondContact O-N 3.25Å; W39-K107 HydrophobicContact CB-CG 4.2Å; W39-K107 HydrophobicContact CD2-CD 3.65Å; W39-K107 HydrophobicContact CD2-CG 3.9Å; W39-K107 HydrophobicContact CE3-CB 4.38Å; W39-K107 HydrophobicContact CE3-CD 3.96Å; W39-K107 HydrophobicContact CE3-CG 4.19Å; W39-K107 HydrophobicContact CG-CD 4.05Å; W39-K107 HydrophobicContact CG-CG 3.89Å; W39-K107 HydrophobicContact CH2-CD 4.31Å; W39-K107 HydrophobicContact CZ2-CD 4.04Å; W39-K107 HydrophobicContact CZ3-CD 4.27Å; E93-K107 WeakPolarHBondContact OE1-CE 3.32Å; E93-K107 IonicContact OE1-NZ 3.54Å; E93-K107 PolarHBondContact OE1-NZ 2.92Å; E93-K107 IonicContact OE2-NZ 2.86Å; E93-K107 PolarHBondContact OE2-NZ 3.37Å; L100-K107 HydrophobicContact CD2-CG 3.79Å; K107-Y109 HydrophobicContact CB-CD2 4.37Å; K107-Y109 HydrophobicContact CB-CE2 3.61Å; K107-Y109 HydrophobicContact CD-CE2 4.38Å; K107-Y109 WeakPolarHBondContact CD-OH 3.12Å
108	V	96.9	Very high	87	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	134.5	177.5	-178.8	0	0	0	0	109.6	E28 M34 F35 R36 V94 R97 S98 Y106	E28-V108 HydrophobicContact CG-CG1 4.35Å; E28-V108 HydrophobicContact CG-CG2 4.38Å; M34-V108 HydrophobicContact CB-CG1 4.44Å; F35-V108 WeakPolarHBondContact O-CA 3.1Å; R36-V108 HydrophobicContact CB-CG2 4.2Å; V94-V108 HydrophobicContact CB-CB 4.43Å; V94-V108 HydrophobicContact CB-CG1 4.19Å; V94-V108 PolarHBondContact N-O 2.65Å; R97-V108 HydrophobicContact CB-CB 3.98Å; R97-V108 HydrophobicContact CB-CG1 4.13Å; R97-V108 HydrophobicContact CB-CG2 3.9Å; R97-V108 VanDerWaalsContact O-CG2 3.31Å; R97-V108 WeakPolarHBondContact O-CG2 3.04Å; S98-V108 PolarHBondContact OG-N 2.88Å; Y106-V108 HydrophobicContact CD2-CG2 3.84Å; Y106-V108 HydrophobicContact CE2-CG2 3.67Å
109	Y	96.9	Very high	85.1	Confident	2 Å²	2	69.4 Å²	69.4	1%	0.008	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	139.6	175.5	-64.4	-93.7	0	0	0	109.8	M34 F35 I37 L85 E92 E93 K107	M34-Y109 VanDerWaalsContact CA-O 3.29Å; M34-Y109 WeakPolarHBondContact CA-O 3.47Å; F35-Y109 HydrophobicContact CE2-CD2 4.2Å; F35-Y109 HydrophobicContact CE2-CG 4.44Å; F35-Y109 HydrophobicContact CZ-CD2 4.45Å; F35-Y109 HydrophobicContact CZ-CG 4.24Å; F35-Y109 PolarHBondContact N-O 3.05Å; F35-Y109 PolarHBondContact O-N 3.31Å; I37-Y109 HydrophobicContact CD1-CD2 3.98Å; I37-Y109 HydrophobicContact CD1-CE2 3.81Å; I37-Y109 HydrophobicContact CG1-CD2 4.14Å; I37-Y109 HydrophobicContact CG1-CE2 4.19Å; L85-Y109 HydrophobicContact CB-CE1 4.11Å; L85-Y109 HydrophobicContact CD1-CE1 4.16Å; L85-Y109 HydrophobicContact CD1-CE2 4.07Å; E92-Y109 CarbonylContact O-C 3.59Å; E92-Y109 VanDerWaalsContact O-CA 3.28Å; E92-Y109 WeakPolarHBondContact O-CA 3.42Å; E93-Y109 HydrophobicContact CB-CD1 3.98Å; E93-Y109 HydrophobicContact CB-CE1 3.79Å; E93-Y109 HydrophobicContact CG-CD1 4.41Å; E93-Y109 HydrophobicContact CG-CE1 4.03Å; K107-Y109 HydrophobicContact CB-CD2 4.37Å; K107-Y109 HydrophobicContact CB-CE2 3.61Å; K107-Y109 HydrophobicContact CD-CE2 4.38Å; K107-Y109 WeakPolarHBondContact CD-OH 3.12Å
110	R	95.9	Very high	82.9	Confident	67 Å²	67	68.8 Å²	68.8	25%	0.253	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	137	170.4	-171.8	173.5	83	-113.5	2.7	109.3	T33 M34 F91 E92 V94 E116	T33-R110 CarbonylContact O-C 3.49Å; T33-R110 WeakPolarHBondContact O-CA 3.43Å; M34-R110 HydrophobicContact CG-CB 4.05Å; M34-R110 HydrophobicContact CG-CG 4.06Å; F91-R110 WeakPolarHBondContact CA-O 3.42Å; E92-R110 VanDerWaalsContact CD-NH1 3.26Å; E92-R110 VanDerWaalsContact CD-NH2 3.26Å; E92-R110 PolarHBondContact N-O 3.21Å; E92-R110 PolarHBondContact O-N 2.88Å; E92-R110 IonicContact OE1-CZ 3.63Å; E92-R110 IonicContact OE1-NH1 2.65Å; E92-R110 PolarHBondContact OE1-NH1 3.31Å; E92-R110 IonicContact OE1-NH2 3.76Å; E92-R110 PolarHBondContact OE1-NH2 3.38Å; E92-R110 IonicContact OE2-CZ 3.94Å; E92-R110 IonicContact OE2-NH1 3.49Å; E92-R110 PolarHBondContact OE2-NH1 2.65Å; E92-R110 IonicContact OE2-NH2 3.54Å; E92-R110 PolarHBondContact OE2-NH2 3.5Å; V94-R110 HydrophobicContact CG2-CB 3.76Å; R110-E116 IonicContact NH2-OE2 3.37Å
111	I	94.2	Very high	80.8	Confident	20 Å²	20	76.1 Å²	76.1	10%	0.103	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	117.3	169.1	-61.1	178.2	0	0	0	107.4	K10 M14 W27 T33 F35 D90 F91 P113	K10-I111 HydrophobicContact CD-CG2 4.35Å; M14-I111 HydrophobicContact CG-CD1 4.18Å; M14-I111 HydrophobicContact SD-CD1 4.11Å; W27-I111 HydrophobicContact CH2-CD1 3.61Å; W27-I111 HydrophobicContact CZ3-CD1 3.71Å; T33-I111 PolarHBondContact O-N 2.8Å; F35-I111 HydrophobicContact CD1-CD1 4.38Å; F35-I111 HydrophobicContact CD1-CG1 4.16Å; F35-I111 HydrophobicContact CE1-CD1 4.42Å; F35-I111 HydrophobicContact CE1-CG1 3.91Å; D90-I111 WeakPolarHBondContact O-CA 3.37Å; F91-I111 HydrophobicContact CD1-CG1 4.37Å; F91-I111 HydrophobicContact CE1-CG1 4.22Å; I111-P113 WeakPolarHBondContact O-CD 3.48Å
112	V	90.5	Very high	78.6	Confident	12 Å²	12	79.4 Å²	79.4	7%	0.073	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-78.8	124	-180	-175.8	0	0	0	0	108.7	P89 D90 E92 E116 Q117	P89-V112 WeakPolarHBondContact O-CB 3.17Å; D90-V112 PolarHBondContact O-N 3.49Å; E92-V112 HydrophobicContact CB-CG2 3.92Å; V112-E116 HydrophobicContact CG1-CB 3.57Å; V112-Q117 HydrophobicContact CB-CG 4.2Å; V112-Q117 HydrophobicContact CG1-CG 3.8Å; V112-Q117 PolarHBondContact O-NE2 3.38Å
113	P	88.1	Confident	76.6	Confident	63 Å²	63	81.8 Å²	81.8	41%	0.409	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-60.5	147.6	172.9	-21.2	32.6	0	0	0	111.6	I111 E115 E116 Q117	I111-P113 WeakPolarHBondContact O-CD 3.48Å; P113-E115 PolarHBondContact O-N 2.76Å; P113-E115 VanDerWaalsContact O-N 3.07Å; P113-E116 PolarHBondContact O-N 2.95Å; P113-Q117 WeakPolarHBondContact O-CG 3.31Å; P113-Q117 PolarHBondContact O-N 3Å
114	E	82.2	Confident	74.2	Confident	144 Å²	144	85.5 Å²	85.5	67%	0.673	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-28.2	-174.7	-168.7	170	-177.6	0	0	113.5	E116 Q117	E114-E116 VanDerWaalsContact C-N 3.34Å; E114-E116 PolarHBondContact O-N 2.95Å; E114-Q117 PolarHBondContact O-N 3.06Å
115	E	80.6	Confident	71.8	Confident	175 Å²	175	88.2 Å²	88.2	82%	0.818	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-34.3	175.9	-56.9	-172.2	-163.7	0	0	113	P113	P113-E115 PolarHBondContact O-N 2.76Å; P113-E115 VanDerWaalsContact O-N 3.07Å
116	E	83.4	Confident	68.9	Low	107 Å²	107	93.6 Å²	93.6	50%	0.5	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-18.9	179.2	-69.4	176.8	-154.7	0	0	112.3	R110 V112 P113 E114 K118	R110-E116 IonicContact NH2-OE2 3.37Å; V112-E116 HydrophobicContact CG1-CB 3.57Å; P113-E116 PolarHBondContact O-N 2.95Å; E114-E116 VanDerWaalsContact C-N 3.34Å; E114-E116 PolarHBondContact O-N 2.95Å; E116-K118 VanDerWaalsContact C-N 3.29Å; E116-K118 PolarHBondContact O-N 3.05Å
117	Q	77.6	Confident	65.9	Low	44 Å²	44	100 Å²	100	21%	0.206	52%	0.517	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-18	-175.6	-64.4	-179.7	15	0	0	113.9	P89 D90 V112 P113 E114 H119	P89-Q117 HydrophobicContact CB-CB 4.39Å; P89-Q117 HydrophobicContact CB-CG 4.43Å; D90-Q117 PolarHBondContact OD1-NE2 3.07Å; V112-Q117 HydrophobicContact CB-CG 4.2Å; V112-Q117 HydrophobicContact CG1-CG 3.8Å; V112-Q117 PolarHBondContact O-NE2 3.38Å; P113-Q117 WeakPolarHBondContact O-CG 3.31Å; P113-Q117 PolarHBondContact O-N 3Å; E114-Q117 PolarHBondContact O-N 3.06Å; Q117-H119 VanDerWaalsContact C-N 3.31Å; Q117-H119 PolarHBondContact O-N 2.92Å
118	K	59.6	Low	62.8	Low	165 Å²	165	105.6 Å²	105.6	72%	0.717	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-3.8	-174.5	-68.6	-172.2	178.7	-179.2	0	114.9	E116	E116-K118 VanDerWaalsContact C-N 3.29Å; E116-K118 PolarHBondContact O-N 3.05Å
119	H	50	Low	59.5	Low	162 Å²	162	109.1 Å²	109.1	75%	0.75	59%	0.59	S	S	*	*	S	Bend	trans	-112.8	76.7	179.5	-57	95.2	0	0	0	110.4	Q117	Q117-H119 VanDerWaalsContact C-N 3.31Å; Q117-H119 PolarHBondContact O-N 2.92Å
120	G	43.1	Very low	57.2	Low	62 Å²	62	114.6 Å²	114.6	64%	0.639	63%	0.626	S	S	*	*			trans	-58.5	137.1	173.5	0	0	0	0	0	111.9	I122	G120-I122 PolarHBondContact O-N 3.04Å; G120-I122 VanDerWaalsContact O-N 3.13Å
121	K	43.4	Very low	53.9	Low	216 Å²	216	118 Å²	118	94%	0.939	65%	0.654	S	S	*	*			trans	-48.2	110.4	179.6	-62.7	172.8	179.9	177	0	112.1
122	I	33.3	Very low	50.7	Low	149 Å²	149	121.8 Å²	121.8	76%	0.764	68%	0.682	S	S	*	*			trans	-109.1	133.2	162.3	-61.2	178	0	0	0	107.4	G120 V124	G120-I122 PolarHBondContact O-N 3.04Å; G120-I122 VanDerWaalsContact O-N 3.13Å; I122-V124 PolarHBondContact O-N 3.21Å
123	P	38.7	Very low	47.8	Very low	112 Å²	112	126.3 Å²	126.3	73%	0.727	71%	0.714	S	S	*	*			trans	-69.8	129.8	174.1	23.2	-19.6	0	0	0	109.8	I125	P123-I125 PolarHBondContact O-N 3.31Å
124	V	31.9	Very low	44.9	Very low	142 Å²	142	127.1 Å²	127.1	86%	0.861	73%	0.734	S	S	*	*			trans	-65	116.4	-175.4	176.8	0	0	0	0	111	I122	I122-V124 PolarHBondContact O-N 3.21Å
125	I	35.3	Very low	42.3	Very low	159 Å²	159	127.8 Å²	127.8	82%	0.815	74%	0.742	S	S	*	*			trans	-123.6	142.7	156	-55.1	177.2	0	0	0	107.5	P123	P123-I125 PolarHBondContact O-N 3.31Å
126	T	32.4	Very low	40.4	Very low	115 Å²	115	127.1 Å²	127.1	71%	0.706	74%	0.739	S	S	*	*			trans	-69.5	140.7	-165	-4.3	0	0	0	0	116
127	M	33.4	Very low	37.8	Very low	161 Å²	161	128.3 Å²	128.3	79%	0.793	75%	0.753	S	S	*	*			trans	78.4	133.6	144	-64.2	-57.2	179.5	0	0	124.4
128	T	31.4	Very low	35.8	Very low	140 Å²	140	133.6 Å²	133.6	86%	0.859	78%	0.783	S	S	*	*			trans	94.9	115.7	146.3	64.1	0	0	0	0	121.6
129	G	28.1	Very low	34.8	Very low	75 Å²	75	134.2 Å²	134.2	77%	0.773	79%	0.791	S	S	*	*			trans	97	148	134.1	0	0	0	0	0	118.4
130	P	47.4	Very low	33.9	Very low	117 Å²	117	131.2 Å²	131.2	76%	0.76	79%	0.794	S	S	*	*			trans	-115.9	-179.8	-140.6	36.9	-22.7	0	0	0	116.4
131	T	27.5	Very low	33.2	Very low	137 Å²	137	134.6 Å²	134.6	84%	0.84	81%	0.806	S	S	*	*			trans	82.7	145.1	165.9	69.4	0	0	0	0	116.3
132	S	27.4	Very low	32.5	Very low	100 Å²	100	128.8 Å²	128.8	70%	0.699	79%	0.793	S	S	*	*			cis	-164.3	159.5	-6.6	60.6	0	0	0	0	110.1
133	S	28.1	Very low	32.6	Very low	108 Å²	108	127.4 Å²	127.4	76%	0.755	79%	0.793	S	S	*	*			trans	58.1	124.5	138.4	65.8	0	0	0	0	123.7
134	G	28.1	Very low	32.3	Very low	79 Å²	79	127 Å²	127	81%	0.814	79%	0.789	S	S	*	*			trans	76.9	144.9	149.1	0	0	0	0	0	115.2
135	D	28.1	Very low	32.2	Very low	158 Å²	158	129.5 Å²	129.5	85%	0.845	79%	0.791	S	S	*	*			cis	-165.4	160.3	19.6	-157.1	-3.9	0	0	0	108.8
136	H	39.2	Very low	32.3	Very low	161 Å²	161	129.8 Å²	129.8	75%	0.745	79%	0.793	S	S	*	*			trans	-64.2	130.1	179	-120.2	-97.6	0	0	0	111.5
137	T	29.8	Very low	32.2	Very low	132 Å²	132	132.6 Å²	132.6	81%	0.81	80%	0.798	S	S	*	*			trans	-146.7	125.5	150.2	40.7	0	0	0	0	111.6
138	D	36.4	Very low	32.2	Very low	156 Å²	156	133.7 Å²	133.7	83%	0.834	80%	0.801	S	S	*	*			trans	-60.3	126.6	167.1	-80.6	-48.7	0	0	0	110.4
139	M	38.3	Very low	32.2	Very low	178 Å²	178	135.4 Å²	135.4	88%	0.877	80%	0.804	S	S	*	*			trans	-122.9	93.7	173.8	-161.7	68.1	153.6	0	0	109.5	C141	M139-C141 PolarHBondContact O-N 3.17Å
140	A	30.3	Very low	32.6	Very low	98 Å²	98	139.5 Å²	139.5	81%	0.81	81%	0.807	S	S	*	*			trans	-67.8	122.4	169.6	0	0	0	0	0	109.4	S142	A140-S142 PolarHBondContact O-N 3.03Å
141	C	29.2	Very low	31.6	Very low	134 Å²	134	142.1 Å²	142.1	91%	0.905	81%	0.806	S	S	*	*			trans	-83.6	113.7	-179	-147.6	0	0	0	0	110.1	M139	M139-C141 PolarHBondContact O-N 3.17Å
142	S	28.5	Very low	31.7	Very low	93 Å²	93	142.7 Å²	142.7	65%	0.65	80%	0.799	S	S	*	*			trans	-73.1	145.8	174.7	-174.8	0	0	0	0	111.4	A140 T144	A140-S142 PolarHBondContact O-N 3.03Å; S142-T144 PolarHBondContact O-N 2.82Å
143	P	35.9	Very low	31.9	Very low	120 Å²	120	146.2 Å²	146.2	78%	0.779	80%	0.804	S	S	*	*	S	Bend	trans	-94.4	62.7	-164.8	38	-35.4	0	0	0	114
144	T	30.7	Very low	31.8	Very low	103 Å²	103	148.6 Å²	148.6	63%	0.632	81%	0.809	S	S	*	*			trans	-136.6	21.3	-174.7	-17.5	0	0	0	0	117.2	S142	S142-T144 PolarHBondContact O-N 2.82Å
145	E	31	Very low	31.6	Very low	195 Å²	195	148.6 Å²	148.6	91%	0.911	81%	0.809	S	S	*	*	S	Bend	trans	-114.8	15.7	173.5	-73.5	-174.9	155.2	0	0	114
146	I	36.8	Very low	31.4	Very low	165 Å²	165	147.2 Å²	147.2	85%	0.846	81%	0.81	S	S	*	*	S	Bend	trans	-108.5	-3.5	-178.8	-48.6	177.1	0	0	0	111.8
147	E	31.7	Very low	30.6	Very low	174 Å²	174	145 Å²	145	81%	0.813	81%	0.812	S	S	*	*	S	Bend	trans	-100	4.6	-168.1	-144.6	163.3	-151.1	0	0	115.3
148	E	32.8	Very low	30.7	Very low	184 Å²	184	145.7 Å²	145.7	86%	0.86	81%	0.81	S	S	*	*	S	Bend	trans	-111	18.1	-169.7	-132.5	-177.7	-158.7	0	0	117.4
149	L	30.8	Very low	30	Very low	176 Å²	176	147.3 Å²	147.3	92%	0.921	81%	0.812	S	S	*	*			trans	-138.2	64.2	172.3	-69.5	170.9	0	0	0	112.2
150	I	36.3	Very low	29.4	Very low	162 Å²	162	143.1 Å²	143.1	83%	0.831	81%	0.806	S	S	*	*			trans	-132.1	99.4	159.4	-55.8	175.4	0	0	0	107.9
151	K	27.6	Very low	29	Very low	172 Å²	172	144.3 Å²	144.3	75%	0.748	81%	0.808	S	S	*	*			trans	-166.5	105.8	149.6	-108.5	-177.4	170.2	-113.5	0	108.1
152	E	28.4	Very low	29.1	Very low	148 Å²	148	142.5 Å²	142.5	69%	0.692	80%	0.795	S	S	*	*				101	137.2	121.6	-76.9	171.4	-158.2	0	0	110.2
153	E	31.1	Very low	29	Very low	174 Å²	174	146 Å²	146	81%	0.813	80%	0.801	S	S	*	*			cis	-164.8	171.2	-15.6	-151.2	-178.8	-178.3	0	0	106.5
154	D	27.4	Very low	28.3	Very low	159 Å²	159	149.6 Å²	149.6	85%	0.85	80%	0.8	S	S	*	*			trans	-40.3	155.6	-179.2	-74.5	-50.9	0	0	0	119.4
155	G	23.8	Very low	27.9	Very low	79 Å²	79	156 Å²	156	81%	0.814	81%	0.813	S	S	*	*			trans	163.6	89.9	156.9	0	0	0	0	0	114.7
156	C	24.1	Very low	27.7	Very low	129 Å²	129	152 Å²	152	87%	0.872	81%	0.805	S	S	*	*			trans	-82.5	130.3	164	-177.7	0	0	0	0	110
157	S	21.5	Very low	27.1	Very low	113 Å²	113	152.3 Å²	152.3	79%	0.79	80%	0.802	S	S	*	*			trans	-159.7	136	144.1	-166.1	0	0	0	0	112.1
158	I	32	Very low	26.7	Very low	147 Å²	147	150 Å²	150	75%	0.754	81%	0.805	S	S	*	*			trans	-70.7	132.5	170.4	-65.1	167.1	0	0	0	108.6
159	Q	22.4	Very low	26.3	Very low	190 Å²	190	145.9 Å²	145.9	89%	0.888	80%	0.797	S	S	*	*			trans	-161.7	127.4	143	-110.6	170.6	20.5	0	0	111.7
160	A	25.5	Very low	25.9	Very low	91 Å²	91	145.1 Å²	145.1	75%	0.752	79%	0.791	S	S	*	*			trans	-72.4	144	165.7	0	0	0	0	0	110.1
161	S	21.6	Very low	25.4	Very low	122 Å²	122	144.1 Å²	144.1	85%	0.853	79%	0.787	S	S	*	*			trans	-178.6	162	150.8	-87.5	0	0	0	0	111.7
162	P	31.7	Very low	25.3	Very low	96 Å²	96	140.1 Å²	140.1	62%	0.623	79%	0.786	S	S	*	*			trans	-115.7	179.2	-136.9	43.8	-36	0	0	0	115.4
163	E	26.1	Very low	25.2	Very low	167 Å²	167	142.5 Å²	142.5	78%	0.78	79%	0.794	S	S	*	*			trans	72.8	130.9	155.7	-67.8	153.7	172.4	0	0	118.8
164	Y	21.3	Very low	25.2	Very low	195 Å²	195	139.7 Å²	139.7	77%	0.765	79%	0.794	S	S	*	*				170.3	112.7	100	-139.3	-102.9	0	0	0	109.7
165	W	23.1	Very low	25.2	Very low	237 Å²	237	139.2 Å²	139.2	90%	0.898	79%	0.79	S	S	*	*			trans	-78.3	137.3	163.4	-70.5	109.1	0	0	0	108.4	Q167	W165-Q167 PolarHBondContact O-N 2.75Å; W165-Q167 VanDerWaalsContact O-N 3.12Å
166	P	25.9	Very low	25.5	Very low	113 Å²	113	143.1 Å²	143.1	73%	0.734	79%	0.787	S	S	*	*			trans	-72.8	112.5	175.9	28.4	-29.5	0	0	0	109.5
167	Q	24.9	Very low	25.7	Very low	171 Å²	171	146.2 Å²	146.2	80%	0.799	79%	0.789	S	S	*	*			trans	-71	127.9	160.5	-87.2	177.1	-46.7	0	0	109.6	W165	W165-Q167 PolarHBondContact O-N 2.75Å; W165-Q167 VanDerWaalsContact O-N 3.12Å
168	S	22.5	Very low	25.8	Very low	125 Å²	125	147.2 Å²	147.2	87%	0.874	79%	0.785	S	S	*	*			trans	-116.6	101.7	157.1	25.8	0	0	0	0	109.1
169	S	23.6	Very low	25.8	Very low	97 Å²	97	145.8 Å²	145.8	68%	0.678	79%	0.786	S	S	*	*			trans	-87.1	148.8	159.2	55.7	0	0	0	0	108.2
170	M	23.6	Very low	26.1	Very low	161 Å²	161	144.1 Å²	144.1	79%	0.793	78%	0.78	S	S	*	*			cis	-159.1	152.6	34.1	-64.7	-174.7	-170.1	0	0	110
171	N	24.8	Very low	26.6	Very low	140 Å²	140	145.1 Å²	145.1	75%	0.749	78%	0.778	S	S	*	*				178.8	132.2	105.2	-91.8	-20.1	0	0	0	111.4
172	A	26.2	Very low	27.5	Very low	88 Å²	88	145 Å²	145	73%	0.727	78%	0.778	S	S	*	*			trans	-74.8	128.5	174.9	0	0	0	0	0	110.7
173	F	25.5	Very low	27.6	Very low	198 Å²	198	143.2 Å²	143.2	87%	0.868	78%	0.777	S	S	*	*			trans	-136.8	110.1	148	-75.8	-75.8	0	0	0	107.7
174	S	32.9	Very low	28.1	Very low	115 Å²	115	142.9 Å²	142.9	80%	0.804	78%	0.78	S	S	*	*			trans	-75.7	119.1	161.6	-63.8	0	0	0	0	108.1
175	L	27	Very low	29.2	Very low	149 Å²	149	140.1 Å²	140.1	78%	0.78	78%	0.783	S	S	*	*			trans	-165.6	125.9	147.9	-130.8	73.7	0	0	0	110.2
176	H	29.2	Very low	30.7	Very low	162 Å²	162	131.1 Å²	131.1	75%	0.75	75%	0.753	S	S	*	*			trans	69	93.7	167.3	-59	-70.6	0	0	0	118.5	D178	H176-D178 PolarHBondContact O-N 3.36Å
177	Q	27.6	Very low	32.4	Very low	193 Å²	193	129.1 Å²	129.1	90%	0.902	74%	0.741	S	S	*	*			trans	-67.5	109.6	147.5	-78.8	176.2	-14.9	0	0	108.4
178	D	25.3	Very low	34.3	Very low	135 Å²	135	121.4 Å²	121.4	72%	0.722	71%	0.708	S	S	*	*			trans	-84	123.9	148	-86.2	-30.8	0	0	0	107.4	H176 M180	H176-D178 PolarHBondContact O-N 3.36Å; D178-M180 PolarHBondContact O-N 2.91Å
179	P	31.2	Very low	36.7	Very low	117 Å²	117	116 Å²	116	76%	0.76	67%	0.669	S	S	*	*			trans	-68.8	105.1	173.5	27.3	-28.8	0	0	0	107.8
180	M	28.8	Very low	39.4	Very low	154 Å²	154	112 Å²	112	76%	0.759	64%	0.641	S	S	*	*			trans	-54.5	131	161.9	-78.9	-74.4	99.6	0	0	108	D178 S182	D178-M180 PolarHBondContact O-N 2.91Å; M180-S182 PolarHBondContact O-N 2.92Å
181	P	36.6	Very low	42.7	Very low	112 Å²	112	107 Å²	107	73%	0.727	62%	0.615	S	S	*	*			trans	-60.6	122.5	-177.4	24.9	-30.8	0	0	0	106.9	G183	P181-G183 PolarHBondContact O-N 2.75Å
182	S	39.8	Very low	46.1	Very low	121 Å²	121	100.3 Å²	100.3	85%	0.846	58%	0.58	S	S	*	*			trans	-56.9	91.4	167.5	-48	0	0	0	0	106.7	M180 N184	M180-S182 PolarHBondContact O-N 2.92Å; S182-N184 PolarHBondContact O-N 3.04Å; S182-N184 VanDerWaalsContact O-N 3.09Å
183	G	33.2	Very low	49.5	Very low	58 Å²	58	98.7 Å²	98.7	60%	0.598	56%	0.558	S	S	*	*			trans	-57.4	119.5	173.2	0	0	0	0	0	106.3	P181 V185	P181-G183 PolarHBondContact O-N 2.75Å; G183-V185 PolarHBondContact O-N 2.93Å
184	N	37.3	Very low	53	Low	159 Å²	159	89.2 Å²	89.2	85%	0.85	52%	0.516	S	S	*	.			trans	-46.2	104.4	170.3	-103	-7.4	0	0	0	107.4	S182 N186	S182-N184 PolarHBondContact O-N 3.04Å; S182-N184 VanDerWaalsContact O-N 3.09Å; N184-N186 VanDerWaalsContact C-N 3.27Å; N184-N186 PolarHBondContact O-N 3Å
185	V	43.4	Very low	56.1	Low	137 Å²	137	84.2 Å²	84.2	83%	0.83	48%	0.481	S	S	*	.			trans	-67.1	100	174.1	-165.2	0	0	0	0	104	G183 S187	G183-V185 PolarHBondContact O-N 2.93Å; V185-S187 VanDerWaalsContact C-N 3.28Å; V185-S187 PolarHBondContact O-N 3.16Å
186	N	56.3	Low	59.5	Low	49 Å²	49	77.1 Å²	77.1	26%	0.262	44%	0.444	S	S	.	.			trans	-66.7	91.6	-170.5	-143.9	-4.4	0	0	0	107.5	N184 G188 F189 Q394	N184-N186 VanDerWaalsContact C-N 3.27Å; N184-N186 PolarHBondContact O-N 3Å; N186-G188 PolarHBondContact O-N 3.33Å; N186-F189 HydrophobicContact CB-CD2 4.14Å; N186-F189 HydrophobicContact CB-CE2 4.01Å; N186-F189 WeakPolarHBondContact O-CD2 3.49Å; N186-F189 PolarHBondContact O-N 2.89Å; N186-Q394 PolarHBondContact OD1-NE2 2.82Å
187	S	60.1	Low	62.7	Low	70 Å²	70	72 Å²	72	49%	0.49	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-63.2	-5.2	-168.5	-176.9	0	0	0	0	113.9	V185 F189 S190	V185-S187 VanDerWaalsContact C-N 3.28Å; V185-S187 PolarHBondContact O-N 3.16Å; S187-F189 VanDerWaalsContact C-N 3.34Å; S187-S190 PolarHBondContact O-OG 3.3Å
188	G	65.1	Low	66	Low	10 Å²	10	62.9 Å²	62.9	10%	0.103	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-64.2	-36.6	176.8	0	0	0	0	0	112.8	N186 S190 Q191 N362	N186-G188 PolarHBondContact O-N 3.33Å; G188-S190 PolarHBondContact O-N 3.25Å; G188-Q191 PolarHBondContact O-N 3.26Å; G188-N362 WeakPolarHBondContact CA-ND2 3.07Å; G188-N362 VanDerWaalsContact O-CG 3.24Å; G188-N362 PolarHBondContact O-ND2 3.21Å; G188-N362 PolarHBondContact O-OD1 3.33Å
189	F	73.6	Confident	69.2	Low	12 Å²	12	58 Å²	58	5%	0.053	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-76.7	-7.5	-172.5	-59.6	-81	0	0	0	114.8	N186 S187 A268 Q270 I398 L402	N186-F189 HydrophobicContact CB-CD2 4.14Å; N186-F189 HydrophobicContact CB-CE2 4.01Å; N186-F189 WeakPolarHBondContact O-CD2 3.49Å; N186-F189 PolarHBondContact O-N 2.89Å; S187-F189 VanDerWaalsContact C-N 3.34Å; F189-A268 CarbonylContact O-C 3.58Å; F189-A268 WeakPolarHBondContact O-CB 3.22Å; F189-Q270 HydrophobicContact CB-CG 4.17Å; F189-Q270 HydrophobicContact CD1-CG 4.16Å; F189-Q270 HydrophobicContact CD2-CG 3.44Å; F189-Q270 VanDerWaalsContact CD2-CG 3.44Å; F189-Q270 HydrophobicContact CE1-CG 4.37Å; F189-Q270 HydrophobicContact CE2-CG 3.69Å; F189-Q270 HydrophobicContact CG-CB 4.4Å; F189-Q270 HydrophobicContact CG-CG 3.67Å; F189-Q270 HydrophobicContact CZ-CG 4.12Å; F189-I398 HydrophobicContact CE1-CG2 3.49Å; F189-I398 VanDerWaalsContact CE1-CG2 3.49Å; F189-I398 HydrophobicContact CE2-CD1 4.21Å; F189-I398 HydrophobicContact CE2-CG1 4.01Å; F189-I398 HydrophobicContact CE2-CG2 4.38Å; F189-I398 HydrophobicContact CZ-CB 4Å; F189-I398 HydrophobicContact CZ-CD1 4.1Å; F189-I398 HydrophobicContact CZ-CG1 3.7Å; F189-I398 HydrophobicContact CZ-CG2 3.3Å; F189-L402 HydrophobicContact CE1-CD1 3.66Å; F189-L402 HydrophobicContact CZ-CD1 3.83Å
190	S	80.6	Confident	72.1	Confident	12 Å²	12	54 Å²	54	8%	0.084	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-90.9	-2.3	175.6	54.2	0	0	0	0	113.2	S187 G188 L192	S187-S190 PolarHBondContact O-OG 3.3Å; G188-S190 PolarHBondContact O-N 3.25Å; S190-L192 PolarHBondContact O-N 3.26Å
191	Q	92.5	Very high	75.2	Confident	55 Å²	55	51.8 Å²	51.8	26%	0.257	32%	0.324	S	S	.	.			trans	-80.6	118.6	-175.5	-61.1	-171.2	-0.3	0	0	112.5	G188 V208 T209 V361	G188-Q191 PolarHBondContact O-N 3.26Å; Q191-V208 CarbonylContact C-O 3.57Å; Q191-V208 VanDerWaalsContact CA-O 3.29Å; Q191-V208 WeakPolarHBondContact CA-O 3.44Å; Q191-T209 HydrophobicContact CG-CG2 4.22Å; Q191-V361 HydrophobicContact CB-CB 3.94Å; Q191-V361 HydrophobicContact CB-CG1 4.47Å; Q191-V361 HydrophobicContact CB-CG2 4.26Å; Q191-V361 PolarHBondContact O-N 2.9Å
192	L	96.1	Very high	78.1	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	132.2	178.4	-63.7	175.7	0	0	0	110.7	S190 V208 V266 A268 I273 I358 T359	S190-L192 PolarHBondContact O-N 3.26Å; L192-V208 HydrophobicContact CB-CB 4.23Å; L192-V208 PolarHBondContact N-O 3.12Å; L192-V208 PolarHBondContact O-N 2.76Å; L192-V266 HydrophobicContact CD1-CG1 3.71Å; L192-A268 HydrophobicContact CD1-CB 3.92Å; L192-A268 HydrophobicContact CD2-CB 3.75Å; L192-A268 HydrophobicContact CG-CB 3.82Å; L192-I273 HydrophobicContact CD2-CD1 3.67Å; L192-I273 HydrophobicContact CD2-CG1 3.95Å; L192-I358 HydrophobicContact CB-CG2 4.43Å; L192-I358 HydrophobicContact CD1-CG2 4.25Å; L192-I358 HydrophobicContact CD2-CG2 4Å; L192-I358 HydrophobicContact CG-CG2 4.48Å; L192-T359 WeakPolarHBondContact CA-O 3.2Å
193	M	97.4	Very high	80.7	Confident	53 Å²	53	46.6 Å²	46.6	26%	0.261	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	127.2	165.4	-179	63.7	68.3	0	0	108.6	N205 L207 I358 T359 V361	M193-N205 HydrophobicContact SD-CB 4.2Å; M193-L207 HydrophobicContact CE-CB 4.3Å; M193-L207 HydrophobicContact CE-CD1 4.42Å; M193-I358 WeakPolarHBondContact O-CA 3.26Å; M193-T359 PolarHBondContact N-O 3.31Å; M193-T359 PolarHBondContact O-N 2.83Å; M193-V361 HydrophobicContact CB-CG2 3.97Å
194	I	98.1	Very high	83.6	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	119.3	-177.3	-62.3	176.5	0	0	0	108.7	F196 N205 T206 V208 C214 I216 I236 L356 Q357	I194-F196 HydrophobicContact CG2-CD2 4.28Å; I194-F196 HydrophobicContact CG2-CE2 3.56Å; I194-F196 HydrophobicContact CG2-CZ 3.79Å; I194-N205 CarbonylContact O-C 3.53Å; I194-N205 WeakPolarHBondContact O-CA 3.3Å; I194-N205 WeakPolarHBondContact O-CB 3.44Å; I194-T206 HydrophobicContact CB-CG2 4.12Å; I194-T206 PolarHBondContact N-O 3.47Å; I194-T206 PolarHBondContact O-N 3.41Å; I194-V208 HydrophobicContact CD1-CG2 3.44Å; I194-V208 VanDerWaalsContact CD1-CG2 3.44Å; I194-V208 HydrophobicContact CG1-CG2 4.19Å; I194-C214 VanDerWaalsContact CD1-SG 3.53Å; I194-I216 HydrophobicContact CD1-CD1 3.83Å; I194-I216 HydrophobicContact CD1-CG1 4.43Å; I194-I216 HydrophobicContact CG2-CD1 4.22Å; I194-I236 HydrophobicContact CD1-CD1 3.45Å; I194-I236 VanDerWaalsContact CD1-CD1 3.45Å; I194-L356 HydrophobicContact CG2-CD1 3.33Å; I194-L356 HydrophobicContact CG2-CG 4.22Å; I194-Q357 WeakPolarHBondContact CA-O 3.46Å
195	S	98.3	Very high	86.4	Confident	10 Å²	10	45.3 Å²	45.3	7%	0.07	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	127.3	-177.4	-62.5	0	0	0	0	111.1	N205 L356 Q357	S195-N205 WeakPolarHBondContact OG-CB 3.44Å; S195-L356 WeakPolarHBondContact O-CA 3.42Å; S195-Q357 PolarHBondContact N-O 3.38Å; S195-Q357 PolarHBondContact O-N 2.73Å
196	F	98.2	Very high	89	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	130.6	-178.2	-63.6	-96.7	0	0	0	110.6	I194 M203 Y204 I216 I236 F238 P239 L356	I194-F196 HydrophobicContact CG2-CD2 4.28Å; I194-F196 HydrophobicContact CG2-CE2 3.56Å; I194-F196 HydrophobicContact CG2-CZ 3.79Å; F196-M203 PolarHBondContact O-N 3.05Å; F196-Y204 AromaticContact CD2-CD1 3.77Å; F196-Y204 HydrophobicContact CD2-CD1 3.77Å; F196-Y204 AromaticContact CE2-CD1 3.92Å; F196-Y204 HydrophobicContact CE2-CD1 3.92Å; F196-Y204 HydrophobicContact CE2-CE1 4.4Å; F196-Y204 PolarHBondContact N-O 2.86Å; F196-I216 HydrophobicContact CE1-CG2 3.74Å; F196-I216 HydrophobicContact CZ-CG2 3.71Å; F196-I236 HydrophobicContact CE2-CG2 3.98Å; F196-I236 HydrophobicContact CZ-CG2 3.77Å; F196-F238 AromaticContact CD1-CD1 3.77Å; F196-F238 HydrophobicContact CD1-CD1 3.77Å; F196-F238 HydrophobicContact CD1-CE1 4.16Å; F196-F238 HydrophobicContact CD1-CG 4.4Å; F196-F238 AromaticContact CE1-CD1 3.71Å; F196-F238 HydrophobicContact CE1-CD1 3.71Å; F196-F238 AromaticContact CE1-CE1 3.97Å; F196-F238 HydrophobicContact CE1-CE1 3.97Å; F196-F238 HydrophobicContact CE1-CG 4.04Å; F196-P239 HydrophobicContact CB-CG 3.84Å; F196-P239 HydrophobicContact CG-CG 4.07Å; F196-L356 HydrophobicContact CD1-CD1 3.56Å; F196-L356 HydrophobicContact CD2-CD1 4.18Å; F196-L356 HydrophobicContact CE1-CD1 3.43Å; F196-L356 VanDerWaalsContact CE1-CD1 3.43Å; F196-L356 HydrophobicContact CE2-CD1 4.08Å; F196-L356 HydrophobicContact CG-CD1 3.94Å; F196-L356 HydrophobicContact CZ-CD1 3.7Å
197	Y	97.4	Very high	90.9	Very high	54 Å²	54	41.3 Å²	41.3	21%	0.212	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	136.1	176	-54.2	-106.6	0	0	0	111.3	K201 L202 I355 Q357	Y197-K201 CarbonylContact C-O 3.59Å; Y197-K201 WeakPolarHBondContact CA-O 3.46Å; Y197-L202 HydrophobicContact CD1-CB 3.91Å; Y197-L202 HydrophobicContact CD1-CD1 4.28Å; Y197-L202 HydrophobicContact CE1-CB 3.7Å; Y197-L202 HydrophobicContact CE1-CD1 3.82Å; Y197-L202 HydrophobicContact CE1-CG 4.32Å; Y197-L202 HydrophobicContact CE2-CD1 4.12Å; Y197-I355 HydrophobicContact CD2-CG2 4.25Å; Y197-I355 PolarHBondContact N-O 2.63Å; Y197-I355 PolarHBondContact O-N 2.85Å; Y197-Q357 HydrophobicContact CE2-CB 4.05Å; Y197-Q357 PolarHBondContact OH-OE1 3.36Å
198	Y	97	Very high	92.5	Very high	2 Å²	2	38 Å²	38	1%	0.008	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	116.1	171.3	-64.9	-22.6	0	0	0	110.9	G200 K201 M203 P239 I244 Q249 T253 L353 I354	Y198-G200 PolarHBondContact O-N 3.27Å; Y198-K201 PolarHBondContact N-O 2.92Å; Y198-K201 PolarHBondContact O-N 2.55Å; Y198-K201 VanDerWaalsContact O-N 3.12Å; Y198-M203 HydrophobicContact CD2-CE 4.12Å; Y198-M203 HydrophobicContact CD2-CG 3.63Å; Y198-M203 HydrophobicContact CD2-SD 4.21Å; Y198-M203 HydrophobicContact CE2-CG 4.33Å; Y198-M203 HydrophobicContact CG-CG 3.75Å; Y198-M203 HydrophobicContact CG-SD 4.47Å; Y198-P239 HydrophobicContact CE2-CB 3.99Å; Y198-P239 WeakPolarHBondContact CE2-O 3.46Å; Y198-P239 PolarHBondContact OH-O 3.05Å; Y198-I244 HydrophobicContact CD2-CD1 3.61Å; Y198-I244 HydrophobicContact CD2-CG1 3.72Å; Y198-I244 HydrophobicContact CE2-CD1 4.28Å; Y198-I244 HydrophobicContact CG-CD1 4.13Å; Y198-I244 HydrophobicContact CG-CG1 4.42Å; Y198-Q249 PolarHBondContact O-NE2 3.27Å; Y198-T253 HydrophobicContact CD1-CG2 4.13Å; Y198-T253 HydrophobicContact CD2-CG2 4.21Å; Y198-T253 HydrophobicContact CE1-CG2 4.15Å; Y198-T253 HydrophobicContact CE2-CG2 4.19Å; Y198-T253 HydrophobicContact CG-CG2 4.19Å; Y198-L353 WeakPolarHBondContact CA-O 3.35Å; Y198-L353 WeakPolarHBondContact CD1-O 3.44Å; Y198-I354 HydrophobicContact CD1-CB 4.29Å; Y198-I354 HydrophobicContact CD1-CG1 3.82Å; Y198-I354 HydrophobicContact CD1-CG2 4.39Å; Y198-I354 HydrophobicContact CE1-CB 4.2Å; Y198-I354 HydrophobicContact CE1-CD1 4.11Å; Y198-I354 HydrophobicContact CE1-CG1 3.65Å; Y198-I354 HydrophobicContact CE1-CG2 3.94Å
199	G	92.6	Very high	93.7	Very high	32 Å²	32	40.8 Å²	40.8	33%	0.33	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	39.9	-175.7	0	0	0	0	0	112.4	K201 Q249 K350 K352 L353	G199-K201 PolarHBondContact O-N 3.02Å; G199-Q249 VanDerWaalsContact N-NE2 3.13Å; G199-K350 CarbonylContact C-O 3.07Å; G199-K352 WeakPolarHBondContact CA-O 3.48Å; G199-K352 PolarHBondContact N-O 3.48Å; G199-L353 PolarHBondContact N-O 2.88Å
200	G	91.7	Very high	94.4	Very high	34 Å²	34	43.2 Å²	43.2	35%	0.351	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.9	-7.2	-178.8	0	0	0	0	0	116	Y198 K350	Y198-G200 PolarHBondContact O-N 3.27Å; G200-K350 WeakPolarHBondContact CA-O 3.32Å; G200-K350 PolarHBondContact N-O 3.24Å; G200-K350 VanDerWaalsContact N-O 3.13Å
201	K	94.4	Very high	94.7	Very high	106 Å²	106	46.3 Å²	46.3	46%	0.461	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	126	174.7	-172.4	179.1	-178.3	-177.2	0	110.2	Y197 Y198 G199 M203 E245	Y197-K201 CarbonylContact C-O 3.59Å; Y197-K201 WeakPolarHBondContact CA-O 3.46Å; Y198-K201 PolarHBondContact N-O 2.92Å; Y198-K201 PolarHBondContact O-N 2.55Å; Y198-K201 VanDerWaalsContact O-N 3.12Å; G199-K201 PolarHBondContact O-N 3.02Å; K201-M203 HydrophobicContact CB-SD 4.23Å; K201-M203 HydrophobicContact CD-SD 4.16Å; K201-M203 HydrophobicContact CG-SD 4.11Å; K201-M203 WeakPolarHBondContact O-CG 3.01Å; K201-M203 PolarHBondContact O-N 2.72Å; K201-E245 IonicContact NZ-OE1 3.53Å; K201-E245 PolarHBondContact NZ-OE1 3.38Å
202	L	96.1	Very high	94.5	Very high	85 Å²	85	47 Å²	47	45%	0.445	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	122.4	171.3	178	66.4	0	0	0	109	Y197	Y197-L202 HydrophobicContact CD1-CB 3.91Å; Y197-L202 HydrophobicContact CD1-CD1 4.28Å; Y197-L202 HydrophobicContact CE1-CB 3.7Å; Y197-L202 HydrophobicContact CE1-CD1 3.82Å; Y197-L202 HydrophobicContact CE1-CG 4.32Å; Y197-L202 HydrophobicContact CE2-CD1 4.12Å
203	M	96	Very high	94.3	Very high	39 Å²	39	47 Å²	47	19%	0.192	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	-41.8	-176.9	-58.1	-55	-63.2	0	0	111.7	F196 Y198 K201 P239 L243	F196-M203 PolarHBondContact O-N 3.05Å; Y198-M203 HydrophobicContact CD2-CE 4.12Å; Y198-M203 HydrophobicContact CD2-CG 3.63Å; Y198-M203 HydrophobicContact CD2-SD 4.21Å; Y198-M203 HydrophobicContact CE2-CG 4.33Å; Y198-M203 HydrophobicContact CG-CG 3.75Å; Y198-M203 HydrophobicContact CG-SD 4.47Å; K201-M203 HydrophobicContact CB-SD 4.23Å; K201-M203 HydrophobicContact CD-SD 4.16Å; K201-M203 HydrophobicContact CG-SD 4.11Å; K201-M203 WeakPolarHBondContact O-CG 3.01Å; K201-M203 PolarHBondContact O-N 2.72Å; M203-P239 HydrophobicContact CB-CB 4.09Å; M203-P239 HydrophobicContact CB-CG 3.87Å; M203-L243 HydrophobicContact CE-CB 3.52Å; M203-L243 HydrophobicContact CE-CD1 4.43Å
204	Y	94	Very high	94.2	Very high	109 Å²	109	44.5 Å²	44.5	43%	0.427	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.4	149.2	-173.9	176.8	-119.9	0	0	0	109.9	F196 T206	F196-Y204 AromaticContact CD2-CD1 3.77Å; F196-Y204 HydrophobicContact CD2-CD1 3.77Å; F196-Y204 AromaticContact CE2-CD1 3.92Å; F196-Y204 HydrophobicContact CE2-CD1 3.92Å; F196-Y204 HydrophobicContact CE2-CE1 4.4Å; F196-Y204 PolarHBondContact N-O 2.86Å; Y204-T206 HydrophobicContact CE1-CG2 3.99Å; Y204-T206 WeakPolarHBondContact OH-CB 3.43Å; Y204-T206 PolarHBondContact OH-OG1 3.16Å
205	N	96.5	Very high	94.1	Very high	81 Å²	81	46.1 Å²	46.1	43%	0.433	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	158.1	165.1	65.8	20.5	0	0	0	111.5	M193 I194 S195	M193-N205 HydrophobicContact SD-CB 4.2Å; I194-N205 CarbonylContact O-C 3.53Å; I194-N205 WeakPolarHBondContact O-CA 3.3Å; I194-N205 WeakPolarHBondContact O-CB 3.44Å; S195-N205 WeakPolarHBondContact OG-CB 3.44Å
206	T	96.7	Very high	94.1	Very high	24 Å²	24	45.7 Å²	45.7	15%	0.147	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	145.8	-179.6	-165.3	0	0	0	0	112.3	I194 Y204 I236	I194-T206 HydrophobicContact CB-CG2 4.12Å; I194-T206 PolarHBondContact N-O 3.47Å; I194-T206 PolarHBondContact O-N 3.41Å; Y204-T206 HydrophobicContact CE1-CG2 3.99Å; Y204-T206 WeakPolarHBondContact OH-CB 3.43Å; Y204-T206 PolarHBondContact OH-OG1 3.16Å; T206-I236 HydrophobicContact CG2-CD1 4.12Å; T206-I236 HydrophobicContact CG2-CG2 3.94Å
207	L	96.4	Very high	94	Very high	78 Å²	78	46 Å²	46	41%	0.408	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	126.8	174	-178.7	68.6	0	0	0	109.8	M193 T209 V361	M193-L207 HydrophobicContact CE-CB 4.3Å; M193-L207 HydrophobicContact CE-CD1 4.42Å; L207-T209 HydrophobicContact CD2-CG2 3.9Å; L207-T209 HydrophobicContact CG-CG2 3.93Å; L207-V361 HydrophobicContact CD1-CG2 3.8Å
208	V	94	Very high	93.8	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	121.1	172.8	178.9	0	0	0	0	108.3	Q191 L192 I194 H210 C214 I236	Q191-V208 CarbonylContact C-O 3.57Å; Q191-V208 VanDerWaalsContact CA-O 3.29Å; Q191-V208 WeakPolarHBondContact CA-O 3.44Å; L192-V208 HydrophobicContact CB-CB 4.23Å; L192-V208 PolarHBondContact N-O 3.12Å; L192-V208 PolarHBondContact O-N 2.76Å; I194-V208 HydrophobicContact CD1-CG2 3.44Å; I194-V208 VanDerWaalsContact CD1-CG2 3.44Å; I194-V208 HydrophobicContact CG1-CG2 4.19Å; V208-H210 HydrophobicContact CG1-CB 4.36Å; V208-C214 HydrophobicContact CG1-CB 3.95Å; V208-C214 HydrophobicContact CG2-CB 4.23Å; V208-I236 HydrophobicContact CG2-CD1 3.21Å; V208-I236 HydrophobicContact CG2-CG1 4.49Å
209	T	90.4	Very high	93.2	Very high	69 Å²	69	50.6 Å²	50.6	42%	0.423	27%	0.27	S	S	.	.			trans	-114.9	-1.5	175.2	58.3	0	0	0	0	112.3	Q191 L207	Q191-T209 HydrophobicContact CG-CG2 4.22Å; L207-T209 HydrophobicContact CD2-CG2 3.9Å; L207-T209 HydrophobicContact CG-CG2 3.93Å
210	H	88.6	Confident	92.2	Very high	64 Å²	64	53.4 Å²	53.4	30%	0.296	28%	0.275	S	S	.	.			trans	-65.2	127.5	-173.6	-161	-76	0	0	0	111.7	V208 E212 G213 S232 Q234	V208-H210 HydrophobicContact CG1-CB 4.36Å; H210-E212 VanDerWaalsContact C-N 3.28Å; H210-E212 PolarHBondContact ND1-N 2.67Å; H210-E212 PolarHBondContact O-N 3.3Å; H210-G213 WeakPolarHBondContact O-CA 3.38Å; H210-G213 PolarHBondContact O-N 3.25Å; H210-S232 PolarHBondContact CE1-O 3.24Å; H210-S232 PolarHBondContact ND1-O 3.34Å; H210-Q234 HydrophobicContact CB-CB 3.83Å
211	P	85.8	Confident	90.4	Very high	76 Å²	76	60.6 Å²	60.6	49%	0.494	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-28.8	-171.8	24.3	-35	0	0	0	114.1	G213 R267	P211-G213 VanDerWaalsContact C-N 3.27Å; P211-R267 PolarHBondContact O-NH2 2.92Å; P211-R267 VanDerWaalsContact O-NH2 3.12Å
212	E	88	Confident	88.4	Confident	70 Å²	70	62.3 Å²	62.3	33%	0.327	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-4.2	175.2	-64.6	-62.8	116.5	0	0	113.2	H210 S232 M233 R267	H210-E212 VanDerWaalsContact C-N 3.28Å; H210-E212 PolarHBondContact ND1-N 2.67Å; H210-E212 PolarHBondContact O-N 3.3Å; E212-S232 WeakPolarHBondContact CB-O 3.41Å; E212-S232 WeakPolarHBondContact CG-O 3.24Å; E212-M233 HydrophobicContact CB-CG 4.17Å; E212-M233 WeakPolarHBondContact O-CE 3.44Å; E212-R267 IonicContact OE1-CZ 2.91Å; E212-R267 IonicContact OE1-NH1 3.55Å; E212-R267 PolarHBondContact OE1-NH1 3.4Å; E212-R267 IonicContact OE1-NH2 3.84Å; E212-R267 PolarHBondContact OE1-NH2 2.99Å; E212-R267 IonicContact OE2-CZ 3.36Å; E212-R267 IonicContact OE2-NH1 3.6Å; E212-R267 PolarHBondContact OE2-NH1 3.46Å; E212-R267 IonicContact OE2-NH2 2.75Å
213	G	92.7	Very high	85.5	Confident	2 Å²	2	61.4 Å²	61.4	2%	0.021	32%	0.324	C	S	.	.			trans	84	-155.2	-175.2	0	0	0	0	0	113.3	H210 P211 Q234 V266	H210-G213 WeakPolarHBondContact O-CA 3.38Å; H210-G213 PolarHBondContact O-N 3.25Å; P211-G213 VanDerWaalsContact C-N 3.27Å; G213-Q234 PolarHBondContact O-N 2.95Å; G213-Q234 VanDerWaalsContact O-N 3.11Å; G213-V266 CarbonylContact C-O 3.55Å; G213-V266 VanDerWaalsContact CA-O 3.26Å; G213-V266 WeakPolarHBondContact CA-O 3.47Å
214	C	95.4	Very high	82.9	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	151.3	-173.7	65.7	0	0	0	0	113.9	I194 V208 M233 Q234 I236 V266	I194-C214 VanDerWaalsContact CD1-SG 3.53Å; V208-C214 HydrophobicContact CG1-CB 3.95Å; V208-C214 HydrophobicContact CG2-CB 4.23Å; C214-M233 VanDerWaalsContact O-CE 3.3Å; C214-M233 WeakPolarHBondContact O-CE 3.35Å; C214-Q234 CarbonylContact C-O 3.52Å; C214-Q234 WeakPolarHBondContact CA-O 3.38Å; C214-Q234 HydrophobicContact CB-CB 4.21Å; C214-Q234 VanDerWaalsContact CB-O 3.25Å; C214-Q234 WeakPolarHBondContact CB-O 3.13Å; C214-I236 HydrophobicContact CB-CD1 3.5Å; C214-I236 VanDerWaalsContact CB-CD1 3.5Å; C214-I236 HydrophobicContact CB-CG1 4.05Å; C214-V266 PolarHBondContact N-O 2.8Å; C214-V266 PolarHBondContact O-N 3.48Å
215	R	96.4	Very high	80.6	Confident	34 Å²	34	69.6 Å²	69.6	13%	0.128	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	127.2	166.8	175.3	172.9	179.5	160.3	-3.7	108.6	Y228 Q234 I236 R262 V264 L265	R215-Y228 PolarHBondContact NH1-O 2.99Å; R215-Q234 PolarHBondContact N-O 2.84Å; R215-I236 PolarHBondContact O-N 3.46Å; R215-R262 PolarHBondContact NH2-O 2.9Å; R215-V264 WeakPolarHBondContact CA-O 3.02Å; R215-L265 HydrophobicContact CB-CD2 3.73Å; R215-L265 HydrophobicContact CG-CD2 3.75Å
216	I	97.4	Very high	78.2	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	109.8	179.3	-47.9	171.6	0	0	0	108.4	I194 F196 I236 F238 G263 V264 V266 L356	I194-I216 HydrophobicContact CD1-CD1 3.83Å; I194-I216 HydrophobicContact CD1-CG1 4.43Å; I194-I216 HydrophobicContact CG2-CD1 4.22Å; F196-I216 HydrophobicContact CE1-CG2 3.74Å; F196-I216 HydrophobicContact CZ-CG2 3.71Å; I216-I236 WeakPolarHBondContact CA-O 3.37Å; I216-I236 HydrophobicContact CG1-CB 4.28Å; I216-F238 HydrophobicContact CG2-CD2 4.16Å; I216-F238 HydrophobicContact CG2-CE2 3.72Å; I216-F238 HydrophobicContact CG2-CZ 4.02Å; I216-G263 CarbonylContact O-C 3.59Å; I216-G263 WeakPolarHBondContact O-CA 3.23Å; I216-V264 HydrophobicContact CB-CG2 3.89Å; I216-V264 HydrophobicContact CD1-CG2 4.21Å; I216-V264 HydrophobicContact CG1-CG2 4.35Å; I216-V264 PolarHBondContact N-O 2.96Å; I216-V264 PolarHBondContact O-N 3.02Å; I216-V266 HydrophobicContact CD1-CG2 3.94Å; I216-L356 HydrophobicContact CD1-CD2 3.57Å; I216-L356 HydrophobicContact CG2-CD2 4.33Å
217	S	96.1	Very high	75.8	Confident	6 Å²	6	72.4 Å²	72.4	4%	0.042	40%	0.399	C	S	.	.			trans	-150.7	152.5	-178.5	53.1	0	0	0	0	111.1	I236 H237 E261	S217-I236 PolarHBondContact N-O 2.84Å; S217-H237 VanDerWaalsContact O-CA 3.31Å; S217-H237 WeakPolarHBondContact O-CA 3.3Å; S217-H237 PolarHBondContact O-ND1 2.79Å; S217-H237 VanDerWaalsContact O-ND1 3.08Å; S217-E261 WeakPolarHBondContact CB-O 3.38Å
218	P	93.9	Very high	73.5	Confident	19 Å²	19	77.1 Å²	77.1	12%	0.123	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-52.1	150.5	172.3	-22.6	31.9	0	0	0	110.8	Q220 F238 L257 L260	P218-Q220 PolarHBondContact O-N 2.99Å; P218-Q220 VanDerWaalsContact O-N 3.16Å; P218-F238 HydrophobicContact CG-CD2 4.19Å; P218-L257 HydrophobicContact CG-CB 4.47Å; P218-L257 HydrophobicContact CG-CD2 4.25Å; P218-L257 WeakPolarHBondContact CG-O 3.23Å; P218-L260 VanDerWaalsContact CD-C 3.46Å; P218-L260 WeakPolarHBondContact CD-O 3.46Å; P218-L260 HydrophobicContact CG-CB 3.74Å
219	Q	85.1	Confident	71.3	Confident	134 Å²	134	81 Å²	81	63%	0.626	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-63.7	120.2	177.5	-168	162.8	5.5	0	0	109.4	H237	Q219-H237 HydrophobicContact CB-CB 4.33Å
220	Q	70.1	Confident	69.5	Low	92 Å²	92	81.3 Å²	81.3	43%	0.43	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-83.8	121	175.1	-68.7	-172.8	-24.2	0	0	108.6	P218 L222	P218-Q220 PolarHBondContact O-N 2.99Å; P218-Q220 VanDerWaalsContact O-N 3.16Å; Q220-L222 VanDerWaalsContact C-N 3.35Å; Q220-L222 PolarHBondContact O-N 2.9Å
221	H	54.3	Low	68.1	Low	184 Å²	184	86.1 Å²	86.1	85%	0.852	47%	0.473	S	S	*	.			trans	-70.7	96.5	164.2	-62.9	-74.3	0	0	0	107.3	G223	H221-G223 PolarHBondContact O-N 2.76Å
222	L	51.6	Low	67.9	Low	143 Å²	143	85 Å²	85	75%	0.749	47%	0.467	S	S	*	.			trans	-54	110.2	-176.7	-85.6	152.9	0	0	0	112.2	Q220	Q220-L222 VanDerWaalsContact C-N 3.35Å; Q220-L222 PolarHBondContact O-N 2.9Å
223	G	37.2	Very low	68	Low	66 Å²	66	83.2 Å²	83.2	68%	0.68	46%	0.459	S	S	*	.			trans	-86.8	137.6	133.9	0	0	0	0	0	108.2	H221	H221-G223 PolarHBondContact O-N 2.76Å
224	R	40.5	Very low	67.9	Low	253 Å²	253	86 Å²	86	96%	0.955	47%	0.472	S	S	*	.	S	Bend	trans	-30.3	129.7	-171.4	-66.3	-174	-164.8	-106.1	3.7	116.2
225	G	45.5	Very low	67.8	Low	67 Å²	67	89.9 Å²	89.9	69%	0.691	49%	0.492	S	S	*	.			trans	69.3	80.1	148.6	0	0	0	0	0	115.8	P227	G225-P227 WeakPolarHBondContact O-CD 3.49Å
226	A	45.4	Very low	67.8	Low	44 Å²	44	88.7 Å²	88.7	36%	0.364	49%	0.488	S	S	.	.			trans	-78.2	122	160.7	0	0	0	0	0	109.1	Y228 S229	A226-Y228 PolarHBondContact O-N 3.18Å; A226-S229 PolarHBondContact O-N 2.91Å
227	P	46.3	Very low	67.7	Low	119 Å²	119	92 Å²	92	77%	0.773	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	14	179.5	29	-34.2	0	0	0	113.9	G225	G225-P227 WeakPolarHBondContact O-CD 3.49Å
228	Y	48.4	Very low	67.8	Low	178 Å²	178	92.2 Å²	92.2	70%	0.698	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.9	14.6	-176.6	-59.3	-74.1	0	0	0	113.4	R215 A226 S230	R215-Y228 PolarHBondContact NH1-O 2.99Å; A226-Y228 PolarHBondContact O-N 3.18Å; Y228-S230 VanDerWaalsContact C-N 3.29Å; Y228-S230 PolarHBondContact O-N 3.16Å
229	S	48.1	Very low	67.9	Low	80 Å²	80	91.7 Å²	91.7	56%	0.559	50%	0.5	S	S	*	.			trans	-73.3	90.2	163.2	-84.6	0	0	0	0	108	A226 D231	A226-S229 PolarHBondContact O-N 2.91Å; S229-D231 PolarHBondContact O-N 3.23Å; S229-D231 VanDerWaalsContact O-N 3.07Å
230	S	52.8	Low	68.4	Low	77 Å²	77	88.6 Å²	88.6	54%	0.538	49%	0.492	S	S	.	.			trans	-64.3	105	155.7	-80.5	0	0	0	0	106.7	Y228 S232 M233	Y228-S230 VanDerWaalsContact C-N 3.29Å; Y228-S230 PolarHBondContact O-N 3.16Å; S230-S232 PolarHBondContact O-N 3.3Å; S230-M233 PolarHBondContact O-N 2.89Å
231	D	59.8	Low	69.5	Low	165 Å²	165	84.3 Å²	84.3	88%	0.882	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-5.2	171.7	-104.3	-7.6	0	0	0	113	S229	S229-D231 PolarHBondContact O-N 3.23Å; S229-D231 VanDerWaalsContact O-N 3.07Å
232	S	80.8	Confident	71.5	Confident	53 Å²	53	81.3 Å²	81.3	37%	0.371	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-12.1	-178.7	64.9	0	0	0	0	114.8	H210 E212 S230	H210-S232 PolarHBondContact CE1-O 3.24Å; H210-S232 PolarHBondContact ND1-O 3.34Å; E212-S232 WeakPolarHBondContact CB-O 3.41Å; E212-S232 WeakPolarHBondContact CG-O 3.24Å; S230-S232 PolarHBondContact O-N 3.3Å
233	M	89.5	Confident	73.5	Confident	31 Å²	31	79 Å²	79	15%	0.153	45%	0.447	C	S	.	.	S	Bend	trans	-117.9	148.3	-176.1	-62.7	-179.3	75.4	0	0	112.8	E212 C214 S230 N235 L265	E212-M233 HydrophobicContact CB-CG 4.17Å; E212-M233 WeakPolarHBondContact O-CE 3.44Å; C214-M233 VanDerWaalsContact O-CE 3.3Å; C214-M233 WeakPolarHBondContact O-CE 3.35Å; S230-M233 PolarHBondContact O-N 2.89Å; M233-N235 PolarHBondContact O-N 2.89Å; M233-L265 HydrophobicContact CE-CB 4.09Å; M233-L265 HydrophobicContact CE-CD2 4.4Å; M233-L265 HydrophobicContact SD-CD1 4.5Å; M233-L265 HydrophobicContact SD-CD2 4.15Å
234	Q	92.1	Very high	76.3	Confident	62 Å²	62	76.2 Å²	76.2	29%	0.29	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	129.6	173.3	-175.8	174.7	4.5	0	0	110.6	H210 G213 C214 R215 I236	H210-Q234 HydrophobicContact CB-CB 3.83Å; G213-Q234 PolarHBondContact O-N 2.95Å; G213-Q234 VanDerWaalsContact O-N 3.11Å; C214-Q234 CarbonylContact C-O 3.52Å; C214-Q234 WeakPolarHBondContact CA-O 3.38Å; C214-Q234 HydrophobicContact CB-CB 4.21Å; C214-Q234 VanDerWaalsContact CB-O 3.25Å; C214-Q234 WeakPolarHBondContact CB-O 3.13Å; R215-Q234 PolarHBondContact N-O 2.84Å; Q234-I236 HydrophobicContact CG-CG1 4.41Å
235	N	93.3	Very high	78.8	Confident	81 Å²	81	70.1 Å²	70.1	43%	0.433	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	130.5	175.8	-68.7	-64.9	0	0	0	110.8	M233	M233-N235 PolarHBondContact O-N 2.89Å
236	I	95.4	Very high	81.1	Confident	8 Å²	8	74.8 Å²	74.8	4%	0.041	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	135.8	179.9	-55	176	0	0	0	108.2	I194 F196 T206 V208 C214 R215 I216 S217 Q234	I194-I236 HydrophobicContact CD1-CD1 3.45Å; I194-I236 VanDerWaalsContact CD1-CD1 3.45Å; F196-I236 HydrophobicContact CE2-CG2 3.98Å; F196-I236 HydrophobicContact CZ-CG2 3.77Å; T206-I236 HydrophobicContact CG2-CD1 4.12Å; T206-I236 HydrophobicContact CG2-CG2 3.94Å; V208-I236 HydrophobicContact CG2-CD1 3.21Å; V208-I236 HydrophobicContact CG2-CG1 4.49Å; C214-I236 HydrophobicContact CB-CD1 3.5Å; C214-I236 VanDerWaalsContact CB-CD1 3.5Å; C214-I236 HydrophobicContact CB-CG1 4.05Å; R215-I236 PolarHBondContact O-N 3.46Å; I216-I236 WeakPolarHBondContact CA-O 3.37Å; I216-I236 HydrophobicContact CG1-CB 4.28Å; S217-I236 PolarHBondContact N-O 2.84Å; Q234-I236 HydrophobicContact CG-CG1 4.41Å
237	H	96.4	Very high	83.4	Confident	71 Å²	71	78.3 Å²	78.3	33%	0.329	41%	0.405	S	S	.	.			trans	-107.4	137.9	-174.4	-60	-52.8	0	0	0	112.3	S217 Q219	S217-H237 VanDerWaalsContact O-CA 3.31Å; S217-H237 WeakPolarHBondContact O-CA 3.3Å; S217-H237 PolarHBondContact O-ND1 2.79Å; S217-H237 VanDerWaalsContact O-ND1 3.08Å; Q219-H237 HydrophobicContact CB-CB 4.33Å
238	F	97.3	Very high	85.6	Confident	9 Å²	9	82 Å²	82	4%	0.039	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-60.5	138.5	165.8	-76	-91.5	0	0	0	109.3	F196 I216 P218 L257 L260 F339 I354	F196-F238 AromaticContact CD1-CD1 3.77Å; F196-F238 HydrophobicContact CD1-CD1 3.77Å; F196-F238 HydrophobicContact CD1-CE1 4.16Å; F196-F238 HydrophobicContact CD1-CG 4.4Å; F196-F238 AromaticContact CE1-CD1 3.71Å; F196-F238 HydrophobicContact CE1-CD1 3.71Å; F196-F238 AromaticContact CE1-CE1 3.97Å; F196-F238 HydrophobicContact CE1-CE1 3.97Å; F196-F238 HydrophobicContact CE1-CG 4.04Å; I216-F238 HydrophobicContact CG2-CD2 4.16Å; I216-F238 HydrophobicContact CG2-CE2 3.72Å; I216-F238 HydrophobicContact CG2-CZ 4.02Å; P218-F238 HydrophobicContact CG-CD2 4.19Å; F238-L257 HydrophobicContact CB-CD2 3.62Å; F238-L257 HydrophobicContact CD1-CD2 4.14Å; F238-L257 HydrophobicContact CG-CD2 3.87Å; F238-L260 HydrophobicContact CD1-CD1 4.41Å; F238-L260 HydrophobicContact CE1-CD1 3.94Å; F238-L260 HydrophobicContact CE2-CB 4.49Å; F238-L260 HydrophobicContact CE2-CD1 4.12Å; F238-L260 HydrophobicContact CZ-CD1 3.78Å; F238-F339 HydrophobicContact CE1-CE2 4.33Å; F238-F339 HydrophobicContact CE1-CZ 4.42Å; F238-F339 HydrophobicContact CZ-CD1 4.46Å; F238-F339 HydrophobicContact CZ-CE1 4Å; F238-F339 HydrophobicContact CZ-CE2 4.26Å; F238-F339 AromaticContact CZ-CZ 3.9Å; F238-F339 HydrophobicContact CZ-CZ 3.9Å; F238-I354 HydrophobicContact CD1-CG2 4.17Å; F238-I354 HydrophobicContact CE1-CG2 3.83Å
239	P	96.2	Very high	87.8	Confident	8 Å²	8	75.4 Å²	75.4	5%	0.052	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-57.1	141.1	174.5	-26.8	35.9	0	0	0	111.7	F196 Y198 M203 L243	F196-P239 HydrophobicContact CB-CG 3.84Å; F196-P239 HydrophobicContact CG-CG 4.07Å; Y198-P239 HydrophobicContact CE2-CB 3.99Å; Y198-P239 WeakPolarHBondContact CE2-O 3.46Å; Y198-P239 PolarHBondContact OH-O 3.05Å; M203-P239 HydrophobicContact CB-CB 4.09Å; M203-P239 HydrophobicContact CB-CG 3.87Å; P239-L243 HydrophobicContact CB-CD1 4.15Å
240	P	94.9	Very high	90.2	Very high	70 Å²	70	74 Å²	74	46%	0.455	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-61	142.4	178	18.8	-25.6	0	0	0	111.1	E242 L243	P240-E242 VanDerWaalsContact CB-OE2 3.27Å; P240-E242 WeakPolarHBondContact CB-OE2 3.48Å; P240-E242 PolarHBondContact O-N 2.83Å; P240-L243 HydrophobicContact CG-CD1 4.01Å; P240-L243 HydrophobicContact CG-CG 4.05Å; P240-L243 PolarHBondContact O-N 2.96Å
241	A	94.9	Very high	92.2	Very high	2 Å²	2	76 Å²	76	2%	0.017	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-65.1	-22	-179.6	0	0	0	0	0	111.8	L243 I244 R250 R254 L257	A241-L243 PolarHBondContact O-N 3Å; A241-L243 VanDerWaalsContact O-N 3.08Å; A241-I244 HydrophobicContact CB-CD1 4.28Å; A241-I244 VanDerWaalsContact O-CB 3.25Å; A241-I244 WeakPolarHBondContact O-CB 3.26Å; A241-I244 WeakPolarHBondContact O-CG1 3.25Å; A241-I244 PolarHBondContact O-N 3.48Å; A241-R250 HydrophobicContact CB-CG 4.36Å; A241-R250 WeakPolarHBondContact O-CG 3.09Å; A241-R254 HydrophobicContact CB-CB 3.79Å; A241-R254 HydrophobicContact CB-CG 4.49Å; A241-L257 HydrophobicContact CB-CD1 4.02Å
242	E	95	Very high	93.9	Very high	121 Å²	121	72.4 Å²	72.4	57%	0.565	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-56.8	-22	176.7	-69.4	64.2	-141.9	0	0	112.7	P240 I244	P240-E242 VanDerWaalsContact CB-OE2 3.27Å; P240-E242 WeakPolarHBondContact CB-OE2 3.48Å; P240-E242 PolarHBondContact O-N 2.83Å; E242-I244 PolarHBondContact O-N 3.35Å
243	L	93.8	Very high	94.6	Very high	94 Å²	94	69.9 Å²	69.9	49%	0.492	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-75	-9.5	174.7	-58.5	177.3	0	0	0	113.7	M203 P239 P240 A241	M203-L243 HydrophobicContact CE-CB 3.52Å; M203-L243 HydrophobicContact CE-CD1 4.43Å; P239-L243 HydrophobicContact CB-CD1 4.15Å; P240-L243 HydrophobicContact CG-CD1 4.01Å; P240-L243 HydrophobicContact CG-CG 4.05Å; P240-L243 PolarHBondContact O-N 2.96Å; A241-L243 PolarHBondContact O-N 3Å; A241-L243 VanDerWaalsContact O-N 3.08Å
244	I	95.8	Very high	94.9	Very high	7 Å²	7	74.1 Å²	74.1	4%	0.036	33%	0.332	C	S	.	.			trans	-84	123.6	-180	-60	167.3	0	0	0	109.2	Y198 A241 E242 Q249 R250 T253	Y198-I244 HydrophobicContact CD2-CD1 3.61Å; Y198-I244 HydrophobicContact CD2-CG1 3.72Å; Y198-I244 HydrophobicContact CE2-CD1 4.28Å; Y198-I244 HydrophobicContact CG-CD1 4.13Å; Y198-I244 HydrophobicContact CG-CG1 4.42Å; A241-I244 HydrophobicContact CB-CD1 4.28Å; A241-I244 VanDerWaalsContact O-CB 3.25Å; A241-I244 WeakPolarHBondContact O-CB 3.26Å; A241-I244 WeakPolarHBondContact O-CG1 3.25Å; A241-I244 PolarHBondContact O-N 3.48Å; E242-I244 PolarHBondContact O-N 3.35Å; I244-Q249 HydrophobicContact CG2-CB 3.94Å; I244-Q249 HydrophobicContact CG2-CG 3.91Å; I244-R250 HydrophobicContact CB-CB 4.05Å; I244-R250 HydrophobicContact CB-CG 4.44Å; I244-R250 HydrophobicContact CG2-CB 4.08Å; I244-R250 PolarHBondContact O-NE 3.12Å; I244-R250 PolarHBondContact O-NH2 3.09Å; I244-T253 VanDerWaalsContact CD1-CB 3.46Å; I244-T253 HydrophobicContact CD1-CG2 3.55Å; I244-T253 WeakPolarHBondContact CD1-OG1 3.33Å
245	E	94.1	Very high	95.1	Very high	126 Å²	126	76.1 Å²	76.1	59%	0.589	34%	0.339	S	S	*	.	S	Bend	trans	-69.5	-44.7	-178.6	-67.8	165.4	-142.6	0	0	112.5	K201 E247 R250	K201-E245 IonicContact NZ-OE1 3.53Å; K201-E245 PolarHBondContact NZ-OE1 3.38Å; E245-E247 PolarHBondContact O-N 3.08Å; E245-R250 PolarHBondContact O-NH2 2.87Å
246	Y	93.7	Very high	95.2	Very high	164 Å²	164	73.1 Å²	73.1	64%	0.643	32%	0.323	S	S	*	.	S	Bend	trans	-78.1	116.2	-175.6	-60.8	-72	0	0	0	112.5	R248 Q249 R250	Y246-R248 VanDerWaalsContact C-N 3.33Å; Y246-R248 PolarHBondContact O-N 3.11Å; Y246-Q249 PolarHBondContact O-N 2.81Å; Y246-Q249 VanDerWaalsContact O-N 3.11Å; Y246-R250 WeakPolarHBondContact O-CB 3.31Å; Y246-R250 PolarHBondContact O-N 2.75Å
247	E	93.4	Very high	95.3	Very high	118 Å²	118	73.7 Å²	73.7	55%	0.551	33%	0.326	S	S	*	.	H	α-helix	trans	-54.3	-44.1	-174.7	-162.2	65.5	-123.1	0	0	113.6	E245 R250 Y251	E245-E247 PolarHBondContact O-N 3.08Å; E247-R250 WeakPolarHBondContact O-CB 3.06Å; E247-R250 PolarHBondContact O-N 2.81Å; E247-R250 IonicContact OE1-CZ 3.3Å; E247-R250 IonicContact OE1-NH1 2.65Å; E247-R250 PolarHBondContact OE1-NH1 2.83Å; E247-R250 IonicContact OE2-CZ 3.48Å; E247-R250 IonicContact OE2-NH1 3.66Å; E247-R250 PolarHBondContact OE2-NH1 3.02Å; E247-Y251 WeakPolarHBondContact O-CB 3.36Å; E247-Y251 PolarHBondContact O-N 3.23Å
248	R	92.6	Very high	95.2	Very high	196 Å²	196	72.1 Å²	72.1	74%	0.74	33%	0.329	S	S	*	.	H	α-helix	trans	-62.8	-47.2	179.7	-173.7	176.6	-178.6	175.1	1.2	111.1	Y246 Y251 F252	Y246-R248 VanDerWaalsContact C-N 3.33Å; Y246-R248 PolarHBondContact O-N 3.11Å; R248-Y251 PolarHBondContact O-N 3.28Å; R248-F252 HydrophobicContact CG-CD2 4.04Å; R248-F252 HydrophobicContact CG-CE2 3.66Å; R248-F252 WeakPolarHBondContact O-CD2 3.27Å; R248-F252 PolarHBondContact O-N 2.8Å
249	Q	94.5	Very high	95	Very high	41 Å²	41	75 Å²	75	19%	0.192	34%	0.343	C	S	.	.	H	α-helix	trans	-64.6	-43.1	177.8	-175.6	-169.8	-1.1	0	0	110.9	Y198 G199 I244 Y246 Y251 F252 T253 L353	Y198-Q249 PolarHBondContact O-NE2 3.27Å; G199-Q249 VanDerWaalsContact N-NE2 3.13Å; I244-Q249 HydrophobicContact CG2-CB 3.94Å; I244-Q249 HydrophobicContact CG2-CG 3.91Å; Y246-Q249 PolarHBondContact O-N 2.81Å; Y246-Q249 VanDerWaalsContact O-N 3.11Å; Q249-Y251 VanDerWaalsContact C-N 3.35Å; Q249-Y251 PolarHBondContact O-N 3.01Å; Q249-F252 PolarHBondContact O-N 2.83Å; Q249-T253 WeakPolarHBondContact O-CB 3.34Å; Q249-T253 PolarHBondContact O-N 2.9Å; Q249-T253 PolarHBondContact O-OG1 2.9Å; Q249-L353 HydrophobicContact CG-CD2 4.12Å
250	R	97.1	Very high	95	Very high	49 Å²	49	74.7 Å²	74.7	19%	0.185	34%	0.34	C	S	.	.	H	α-helix	trans	-55.2	-49.8	176.4	-176.2	-175	-49.6	135.4	3	111.3	A241 I244 E245 Y246 E247 F252 T253 R254	A241-R250 HydrophobicContact CB-CG 4.36Å; A241-R250 WeakPolarHBondContact O-CG 3.09Å; I244-R250 HydrophobicContact CB-CB 4.05Å; I244-R250 HydrophobicContact CB-CG 4.44Å; I244-R250 HydrophobicContact CG2-CB 4.08Å; I244-R250 PolarHBondContact O-NE 3.12Å; I244-R250 PolarHBondContact O-NH2 3.09Å; E245-R250 PolarHBondContact O-NH2 2.87Å; Y246-R250 WeakPolarHBondContact O-CB 3.31Å; Y246-R250 PolarHBondContact O-N 2.75Å; E247-R250 WeakPolarHBondContact O-CB 3.06Å; E247-R250 PolarHBondContact O-N 2.81Å; E247-R250 IonicContact OE1-CZ 3.3Å; E247-R250 IonicContact OE1-NH1 2.65Å; E247-R250 PolarHBondContact OE1-NH1 2.83Å; E247-R250 IonicContact OE2-CZ 3.48Å; E247-R250 IonicContact OE2-NH1 3.66Å; E247-R250 PolarHBondContact OE2-NH1 3.02Å; R250-F252 PolarHBondContact O-N 2.82Å; R250-T253 PolarHBondContact O-N 2.91Å; R250-R254 VanDerWaalsContact O-CB 3.29Å; R250-R254 WeakPolarHBondContact O-CB 3.38Å; R250-R254 PolarHBondContact O-N 3.47Å
251	Y	95.6	Very high	94.8	Very high	120 Å²	120	76.4 Å²	76.4	47%	0.471	34%	0.343	S	S	.	.	H	α-helix	trans	-56.5	-50	179.9	174.4	-98.1	0	0	0	112.2	E247 R248 Q249 K255	E247-Y251 WeakPolarHBondContact O-CB 3.36Å; E247-Y251 PolarHBondContact O-N 3.23Å; R248-Y251 PolarHBondContact O-N 3.28Å; Q249-Y251 VanDerWaalsContact C-N 3.35Å; Q249-Y251 PolarHBondContact O-N 3.01Å; Y251-K255 PolarHBondContact O-N 3.1Å; Y251-K255 VanDerWaalsContact O-N 3.1Å
252	F	94.9	Very high	94.6	Very high	90 Å²	90	81.4 Å²	81.4	40%	0.395	36%	0.361	S	S	.	.	H	α-helix	trans	-69.6	-40	-179.8	-69.5	-63.5	0	0	0	112.7	R248 Q249 R250 K255 L256 L353	R248-F252 HydrophobicContact CG-CD2 4.04Å; R248-F252 HydrophobicContact CG-CE2 3.66Å; R248-F252 WeakPolarHBondContact O-CD2 3.27Å; R248-F252 PolarHBondContact O-N 2.8Å; Q249-F252 PolarHBondContact O-N 2.83Å; R250-F252 PolarHBondContact O-N 2.82Å; F252-K255 PolarHBondContact O-N 3.45Å; F252-L256 WeakPolarHBondContact O-CB 3.4Å; F252-L256 PolarHBondContact O-N 3.26Å; F252-L353 HydrophobicContact CB-CD1 3.8Å; F252-L353 HydrophobicContact CB-CD2 4.15Å
253	T	96.2	Very high	94.6	Very high	0 Å²	0	75.7 Å²	75.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-63.6	-43.6	177.9	-53.6	0	0	0	0	111	Y198 I244 Q249 R250 K255 L256 L257 I354	Y198-T253 HydrophobicContact CD1-CG2 4.13Å; Y198-T253 HydrophobicContact CD2-CG2 4.21Å; Y198-T253 HydrophobicContact CE1-CG2 4.15Å; Y198-T253 HydrophobicContact CE2-CG2 4.19Å; Y198-T253 HydrophobicContact CG-CG2 4.19Å; I244-T253 VanDerWaalsContact CD1-CB 3.46Å; I244-T253 HydrophobicContact CD1-CG2 3.55Å; I244-T253 WeakPolarHBondContact CD1-OG1 3.33Å; Q249-T253 WeakPolarHBondContact O-CB 3.34Å; Q249-T253 PolarHBondContact O-N 2.9Å; Q249-T253 PolarHBondContact O-OG1 2.9Å; R250-T253 PolarHBondContact O-N 2.91Å; T253-K255 PolarHBondContact O-N 3.21Å; T253-L256 PolarHBondContact O-N 3.35Å; T253-L257 HydrophobicContact CG2-CD1 4.46Å; T253-L257 WeakPolarHBondContact O-CG 3.29Å; T253-L257 PolarHBondContact O-N 3.11Å; T253-I354 HydrophobicContact CG2-CD1 3.95Å; T253-I354 HydrophobicContact CG2-CG1 3.83Å
254	R	96.3	Very high	94.8	Very high	119 Å²	119	71.2 Å²	71.2	45%	0.449	31%	0.311	S	S	.	.	H	α-helix	trans	-60.4	-44.4	174.9	-176.8	173.1	59.8	-159.9	-2.3	112.3	A241 R250 L256 L257 G258	A241-R254 HydrophobicContact CB-CB 3.79Å; A241-R254 HydrophobicContact CB-CG 4.49Å; R250-R254 VanDerWaalsContact O-CB 3.29Å; R250-R254 WeakPolarHBondContact O-CB 3.38Å; R250-R254 PolarHBondContact O-N 3.47Å; R254-L256 VanDerWaalsContact C-N 3.3Å; R254-L256 PolarHBondContact O-N 3.31Å; R254-L257 PolarHBondContact O-N 3.48Å; R254-G258 PolarHBondContact O-N 3.23Å
255	K	95.3	Very high	94.9	Very high	105 Å²	105	73 Å²	73	46%	0.457	32%	0.32	S	S	.	.	H	α-helix	trans	-60.5	-42.8	176	-172.7	176.8	-179.6	178.3	0	111.1	Y251 F252 T253 G258 H259	Y251-K255 PolarHBondContact O-N 3.1Å; Y251-K255 VanDerWaalsContact O-N 3.1Å; F252-K255 PolarHBondContact O-N 3.45Å; T253-K255 PolarHBondContact O-N 3.21Å; K255-G258 PolarHBondContact O-N 3.27Å; K255-H259 PolarHBondContact O-CD2 2.86Å; K255-H259 VanDerWaalsContact O-CD2 3.24Å
256	L	96.7	Very high	95.1	Very high	18 Å²	18	67 Å²	67	9%	0.094	29%	0.292	C	S	.	.	H	α-helix	trans	-64.8	-43	177.8	178.2	57.1	0	0	0	112.4	F252 T253 R254 G258 H259 S281 F339 L353 I354	F252-L256 WeakPolarHBondContact O-CB 3.4Å; F252-L256 PolarHBondContact O-N 3.26Å; T253-L256 PolarHBondContact O-N 3.35Å; R254-L256 VanDerWaalsContact C-N 3.3Å; R254-L256 PolarHBondContact O-N 3.31Å; L256-G258 PolarHBondContact O-N 3.44Å; L256-H259 WeakPolarHBondContact O-CA 3.39Å; L256-H259 WeakPolarHBondContact O-CB 3.38Å; L256-H259 PolarHBondContact O-N 2.83Å; L256-S281 WeakPolarHBondContact CD1-OG 3.33Å; L256-F339 HydrophobicContact CD2-CB 4.44Å; L256-F339 VanDerWaalsContact CD2-O 3.31Å; L256-F339 WeakPolarHBondContact CD2-O 3.47Å; L256-L353 HydrophobicContact CD2-CB 4.31Å; L256-I354 HydrophobicContact CB-CD1 4.32Å; L256-I354 HydrophobicContact CD2-CB 4.25Å; L256-I354 HydrophobicContact CD2-CD1 3.62Å; L256-I354 HydrophobicContact CD2-CG1 3.84Å; L256-I354 HydrophobicContact CG-CD1 3.85Å
257	L	96.4	Very high	95.1	Very high	19 Å²	19	63.8 Å²	63.8	10%	0.099	28%	0.279	C	S	.	.	H	α-helix	trans	-55.8	-35.9	176.2	-73.1	171	0	0	0	112.2	P218 F238 A241 T253 R254 H259 L260 I354	P218-L257 HydrophobicContact CG-CB 4.47Å; P218-L257 HydrophobicContact CG-CD2 4.25Å; P218-L257 WeakPolarHBondContact CG-O 3.23Å; F238-L257 HydrophobicContact CB-CD2 3.62Å; F238-L257 HydrophobicContact CD1-CD2 4.14Å; F238-L257 HydrophobicContact CG-CD2 3.87Å; A241-L257 HydrophobicContact CB-CD1 4.02Å; T253-L257 HydrophobicContact CG2-CD1 4.46Å; T253-L257 WeakPolarHBondContact O-CG 3.29Å; T253-L257 PolarHBondContact O-N 3.11Å; R254-L257 PolarHBondContact O-N 3.48Å; L257-H259 PolarHBondContact O-N 3.1Å; L257-H259 VanDerWaalsContact O-N 3.16Å; L257-L260 HydrophobicContact CD2-CD1 4.27Å; L257-L260 WeakPolarHBondContact O-CB 3.47Å; L257-L260 PolarHBondContact O-N 3.42Å; L257-I354 HydrophobicContact CD2-CD1 3.87Å; L257-I354 HydrophobicContact CG-CD1 4.08Å
258	G	94	Very high	95.1	Very high	38 Å²	38	58.4 Å²	58.4	39%	0.392	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-21.1	173.7	0	0	0	0	0	114.5	R254 K255 L256	R254-G258 PolarHBondContact O-N 3.23Å; K255-G258 PolarHBondContact O-N 3.27Å; L256-G258 PolarHBondContact O-N 3.44Å
259	H	94.4	Very high	95	Very high	71 Å²	71	51.8 Å²	51.8	33%	0.329	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-0	173.9	-61.3	-69.5	0	0	0	113.3	K255 L256 L257 Q280 S281	K255-H259 PolarHBondContact O-CD2 2.86Å; K255-H259 VanDerWaalsContact O-CD2 3.24Å; L256-H259 WeakPolarHBondContact O-CA 3.39Å; L256-H259 WeakPolarHBondContact O-CB 3.38Å; L256-H259 PolarHBondContact O-N 2.83Å; L257-H259 PolarHBondContact O-N 3.1Å; L257-H259 VanDerWaalsContact O-N 3.16Å; H259-Q280 HydrophobicContact CB-CB 4.36Å; H259-Q280 PolarHBondContact O-N 2.95Å; H259-S281 PolarHBondContact O-N 2.92Å
260	L	96.1	Very high	94.8	Very high	0 Å²	0	55 Å²	55	0%	0	25%	0.249	C	C	.	.			trans	-101.4	3.8	-178.7	-57.7	-168.6	0	0	0	114.3	P218 F238 L257 R262 G263 C279 F339 I354	P218-L260 VanDerWaalsContact CD-C 3.46Å; P218-L260 WeakPolarHBondContact CD-O 3.46Å; P218-L260 HydrophobicContact CG-CB 3.74Å; F238-L260 HydrophobicContact CD1-CD1 4.41Å; F238-L260 HydrophobicContact CE1-CD1 3.94Å; F238-L260 HydrophobicContact CE2-CB 4.49Å; F238-L260 HydrophobicContact CE2-CD1 4.12Å; F238-L260 HydrophobicContact CZ-CD1 3.78Å; L257-L260 HydrophobicContact CD2-CD1 4.27Å; L257-L260 WeakPolarHBondContact O-CB 3.47Å; L257-L260 PolarHBondContact O-N 3.42Å; L260-R262 VanDerWaalsContact C-N 3.35Å; L260-R262 PolarHBondContact O-N 2.98Å; L260-G263 VanDerWaalsContact O-CA 3.23Å; L260-G263 WeakPolarHBondContact O-CA 3.19Å; L260-G263 PolarHBondContact O-N 2.87Å; L260-C279 HydrophobicContact CD2-CB 4.02Å; L260-F339 HydrophobicContact CD1-CB 4.21Å; L260-F339 HydrophobicContact CD1-CD1 3.84Å; L260-F339 HydrophobicContact CD1-CG 4.13Å; L260-F339 HydrophobicContact CD2-CB 4.41Å; L260-F339 HydrophobicContact CD2-CD1 3.62Å; L260-F339 HydrophobicContact CD2-CE1 4.38Å; L260-F339 HydrophobicContact CD2-CG 4.42Å; L260-F339 HydrophobicContact CG-CD1 4.41Å; L260-I354 HydrophobicContact CD1-CD1 4.01Å
261	E	90.4	Very high	94.4	Very high	107 Å²	107	58.3 Å²	58.3	50%	0.5	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-43.2	-171.7	-66	178.1	170.5	0	0	115.3	S217 G263	S217-E261 WeakPolarHBondContact CB-O 3.38Å; E261-G263 VanDerWaalsContact C-N 3.27Å; E261-G263 PolarHBondContact O-N 2.65Å
262	R	90.6	Very high	94.3	Very high	106 Å²	106	52.6 Å²	52.6	40%	0.4	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-21.2	176.1	-71	-178.5	69.4	-147.4	6.1	112.9	R215 L260 L278 D305	R215-R262 PolarHBondContact NH2-O 2.9Å; L260-R262 VanDerWaalsContact C-N 3.35Å; L260-R262 PolarHBondContact O-N 2.98Å; R262-L278 HydrophobicContact CB-CB 3.78Å; R262-L278 VanDerWaalsContact CB-O 3.32Å; R262-L278 WeakPolarHBondContact CB-O 3.46Å; R262-L278 WeakPolarHBondContact CD-O 3.44Å; R262-L278 PolarHBondContact NH1-O 2.79Å; R262-D305 IonicContact CZ-OD1 2.98Å; R262-D305 IonicContact NH1-OD1 3.87Å; R262-D305 IonicContact NH1-OD2 3.62Å; R262-D305 IonicContact NH2-OD1 2.71Å; R262-D305 PolarHBondContact NH2-OD1 2.79Å; R262-D305 VanDerWaalsContact NH2-OD1 3.17Å
263	G	95.8	Very high	94.4	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.01	23%	0.226	C	C	.	.			trans	70.4	-156	173.3	0	0	0	0	0	115.4	I216 L260 E261 L278 C279	I216-G263 CarbonylContact O-C 3.59Å; I216-G263 WeakPolarHBondContact O-CA 3.23Å; L260-G263 VanDerWaalsContact O-CA 3.23Å; L260-G263 WeakPolarHBondContact O-CA 3.19Å; L260-G263 PolarHBondContact O-N 2.87Å; E261-G263 VanDerWaalsContact C-N 3.27Å; E261-G263 PolarHBondContact O-N 2.65Å; G263-L278 CarbonylContact O-C 3.52Å; G263-L278 WeakPolarHBondContact O-CA 3.34Å; G263-L278 WeakPolarHBondContact O-CB 3.27Å; G263-L278 PolarHBondContact O-N 3.46Å; G263-C279 PolarHBondContact O-N 2.86Å
264	V	97.8	Very high	94.4	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	149.3	171.3	-60	0	0	0	0	109.4	R215 I216 V266 I275 K276 F339	R215-V264 WeakPolarHBondContact CA-O 3.02Å; I216-V264 HydrophobicContact CB-CG2 3.89Å; I216-V264 HydrophobicContact CD1-CG2 4.21Å; I216-V264 HydrophobicContact CG1-CG2 4.35Å; I216-V264 PolarHBondContact N-O 2.96Å; I216-V264 PolarHBondContact O-N 3.02Å; V264-V266 HydrophobicContact CG2-CG2 4.12Å; V264-I275 HydrophobicContact CB-CD1 4.1Å; V264-I275 HydrophobicContact CB-CG1 4.21Å; V264-I275 HydrophobicContact CG1-CD1 4.38Å; V264-I275 HydrophobicContact CG2-CD1 4.26Å; V264-K276 WeakPolarHBondContact CA-O 3.37Å; V264-F339 HydrophobicContact CG1-CE1 4.02Å; V264-F339 HydrophobicContact CG1-CZ 4.31Å
265	L	97.2	Very high	94.4	Very high	45 Å²	45	45.1 Å²	45.1	24%	0.236	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	129.3	170	-53.2	-178.7	0	0	0	108.2	R215 M233 I275 K276 L278	R215-L265 HydrophobicContact CB-CD2 3.73Å; R215-L265 HydrophobicContact CG-CD2 3.75Å; M233-L265 HydrophobicContact CE-CB 4.09Å; M233-L265 HydrophobicContact CE-CD2 4.4Å; M233-L265 HydrophobicContact SD-CD1 4.5Å; M233-L265 HydrophobicContact SD-CD2 4.15Å; L265-I275 CarbonylContact O-C 3.52Å; L265-I275 VanDerWaalsContact O-CA 3.24Å; L265-I275 WeakPolarHBondContact O-CA 3.45Å; L265-I275 WeakPolarHBondContact O-CG1 3.31Å; L265-K276 HydrophobicContact CB-CB 4.25Å; L265-K276 PolarHBondContact N-O 3.25Å; L265-K276 PolarHBondContact O-N 2.85Å; L265-L278 HydrophobicContact CD1-CD1 3.93Å; L265-L278 HydrophobicContact CD2-CD1 4.11Å; L265-L278 HydrophobicContact CG-CD1 3.75Å; L265-L278 HydrophobicContact CG-CG 4.41Å
266	V	97.6	Very high	94.5	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	132	-179.1	-176.2	0	0	0	0	108.9	L192 G213 C214 I216 V264 I273 F274 I275 I358	L192-V266 HydrophobicContact CD1-CG1 3.71Å; G213-V266 CarbonylContact C-O 3.55Å; G213-V266 VanDerWaalsContact CA-O 3.26Å; G213-V266 WeakPolarHBondContact CA-O 3.47Å; C214-V266 PolarHBondContact N-O 2.8Å; C214-V266 PolarHBondContact O-N 3.48Å; I216-V266 HydrophobicContact CD1-CG2 3.94Å; V264-V266 HydrophobicContact CG2-CG2 4.12Å; V266-I273 HydrophobicContact CG1-CG2 3.74Å; V266-F274 WeakPolarHBondContact CA-O 3.48Å; V266-I275 HydrophobicContact CG2-CD1 4.05Å; V266-I275 HydrophobicContact CG2-CG1 4.08Å; V266-I358 HydrophobicContact CG1-CD1 4.16Å; V266-I358 HydrophobicContact CG2-CD1 4.02Å
267	R	94.6	Very high	94.5	Very high	96 Å²	96	42.8 Å²	42.8	36%	0.362	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	140.2	174.7	-174	176.6	-173.6	137.3	8.3	110.1	P211 E212 F274	P211-R267 PolarHBondContact O-NH2 2.92Å; P211-R267 VanDerWaalsContact O-NH2 3.12Å; E212-R267 IonicContact OE1-CZ 2.91Å; E212-R267 IonicContact OE1-NH1 3.55Å; E212-R267 PolarHBondContact OE1-NH1 3.4Å; E212-R267 IonicContact OE1-NH2 3.84Å; E212-R267 PolarHBondContact OE1-NH2 2.99Å; E212-R267 IonicContact OE2-CZ 3.36Å; E212-R267 IonicContact OE2-NH1 3.6Å; E212-R267 PolarHBondContact OE2-NH1 3.46Å; E212-R267 IonicContact OE2-NH2 2.75Å; R267-F274 PolarHBondContact N-O 2.86Å; R267-F274 PolarHBondContact O-N 3.41Å
268	A	93.6	Very high	94.5	Very high	5 Å²	5	42.7 Å²	42.7	4%	0.041	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	146.6	172.3	0	0	0	0	0	111.1	F189 L192 G272 I273	F189-A268 CarbonylContact O-C 3.58Å; F189-A268 WeakPolarHBondContact O-CB 3.22Å; L192-A268 HydrophobicContact CD1-CB 3.92Å; L192-A268 HydrophobicContact CD2-CB 3.75Å; L192-A268 HydrophobicContact CG-CB 3.82Å; A268-G272 WeakPolarHBondContact CA-O 3.39Å; A268-I273 HydrophobicContact CB-CG1 4.43Å
269	N	90.4	Very high	94.6	Very high	58 Å²	58	41 Å²	41	31%	0.31	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	-169.6	171.7	68.5	18.2	0	0	0	109.4	E271 G272 F274 M360	N269-E271 PolarHBondContact O-N 3.29Å; N269-E271 WeakPolarHBondContact OD1-CA 3.26Å; N269-E271 WeakPolarHBondContact OD1-CB 3.32Å; N269-E271 PolarHBondContact OD1-N 3.17Å; N269-G272 PolarHBondContact N-O 3.4Å; N269-G272 PolarHBondContact O-N 3.47Å; N269-G272 PolarHBondContact OD1-N 2.92Å; N269-G272 PolarHBondContact OD1-O 3.24Å; N269-F274 WeakPolarHBondContact OD1-CE2 3.13Å; N269-M360 VanDerWaalsContact O-CE 3.27Å; N269-M360 WeakPolarHBondContact O-CE 3.33Å
270	Q	89.1	Confident	94.5	Very high	107 Å²	107	42.4 Å²	42.4	50%	0.5	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-31.2	179.9	-68	176	10.3	0	0	113.8	F189 T313	F189-Q270 HydrophobicContact CB-CG 4.17Å; F189-Q270 HydrophobicContact CD1-CG 4.16Å; F189-Q270 HydrophobicContact CD2-CG 3.44Å; F189-Q270 VanDerWaalsContact CD2-CG 3.44Å; F189-Q270 HydrophobicContact CE1-CG 4.37Å; F189-Q270 HydrophobicContact CE2-CG 3.69Å; F189-Q270 HydrophobicContact CG-CB 4.4Å; F189-Q270 HydrophobicContact CG-CG 3.67Å; F189-Q270 HydrophobicContact CZ-CG 4.12Å; Q270-T313 VanDerWaalsContact O-CB 3.23Å; Q270-T313 WeakPolarHBondContact O-CB 3.38Å; Q270-T313 WeakPolarHBondContact O-CG2 3.37Å; Q270-T313 PolarHBondContact O-OG1 3.23Å
271	E	89.9	Confident	94.4	Very high	120 Å²	120	42.9 Å²	42.9	56%	0.561	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-26.9	-179.8	-59.1	-176.6	-179.4	0	0	112.8	N269 F274 T313	N269-E271 PolarHBondContact O-N 3.29Å; N269-E271 WeakPolarHBondContact OD1-CA 3.26Å; N269-E271 WeakPolarHBondContact OD1-CB 3.32Å; N269-E271 PolarHBondContact OD1-N 3.17Å; E271-F274 HydrophobicContact CB-CE2 4.26Å; E271-F274 HydrophobicContact CB-CZ 4.23Å; E271-T313 PolarHBondContact O-N 3.07Å; E271-T313 PolarHBondContact O-OG1 3.39Å
272	G	93.4	Very high	94.7	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	144.4	-149.8	177.3	0	0	0	0	0	113.9	A268 N269 F311 T313	A268-G272 WeakPolarHBondContact CA-O 3.39Å; N269-G272 PolarHBondContact N-O 3.4Å; N269-G272 PolarHBondContact O-N 3.47Å; N269-G272 PolarHBondContact OD1-N 2.92Å; N269-G272 PolarHBondContact OD1-O 3.24Å; G272-F311 WeakPolarHBondContact CA-O 3.28Å; G272-T313 WeakPolarHBondContact CA-OG1 2.96Å; G272-T313 PolarHBondContact N-OG1 2.79Å
273	I	96.1	Very high	95	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	127.4	-175.7	-52.3	175.5	0	0	0	109.7	L192 V266 A268 K309 I310 F311 I358 M360	L192-I273 HydrophobicContact CD2-CD1 3.67Å; L192-I273 HydrophobicContact CD2-CG1 3.95Å; V266-I273 HydrophobicContact CG1-CG2 3.74Å; A268-I273 HydrophobicContact CB-CG1 4.43Å; I273-K309 CarbonylContact O-C 3.4Å; I273-K309 WeakPolarHBondContact O-CA 3.3Å; I273-I310 HydrophobicContact CB-CD1 4.5Å; I273-I310 HydrophobicContact CB-CG1 4.02Å; I273-I310 HydrophobicContact CG2-CD1 3.86Å; I273-I310 HydrophobicContact CG2-CG1 3.86Å; I273-I310 WeakPolarHBondContact O-CG1 3.48Å; I273-I310 PolarHBondContact O-N 2.62Å; I273-F311 HydrophobicContact CB-CB 3.75Å; I273-F311 HydrophobicContact CD1-CB 3.83Å; I273-F311 HydrophobicContact CD1-CG 4.18Å; I273-F311 HydrophobicContact CG1-CB 3.72Å; I273-F311 HydrophobicContact CG1-CD1 4.34Å; I273-F311 HydrophobicContact CG1-CG 4.26Å; I273-F311 PolarHBondContact N-O 3.21Å; I273-F311 VanDerWaalsContact N-O 3.11Å; I273-F311 PolarHBondContact O-N 3.23Å; I273-I358 HydrophobicContact CD1-CG2 3.98Å; I273-M360 HydrophobicContact CD1-CB 4.17Å; I273-M360 HydrophobicContact CG1-SD 4.13Å
274	F	95.8	Very high	95	Very high	50 Å²	50	37.3 Å²	37.3	22%	0.219	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	140.9	176.6	-62.1	-97.2	0	0	0	110.2	V266 R267 N269 E271 V307 V308 K309	V266-F274 WeakPolarHBondContact CA-O 3.48Å; R267-F274 PolarHBondContact N-O 2.86Å; R267-F274 PolarHBondContact O-N 3.41Å; N269-F274 WeakPolarHBondContact OD1-CE2 3.13Å; E271-F274 HydrophobicContact CB-CE2 4.26Å; E271-F274 HydrophobicContact CB-CZ 4.23Å; F274-V307 HydrophobicContact CB-CG1 4.41Å; F274-V307 HydrophobicContact CD1-CG1 4.45Å; F274-V308 WeakPolarHBondContact CA-O 3.35Å; F274-K309 HydrophobicContact CD1-CB 4Å; F274-K309 HydrophobicContact CE1-CB 3.8Å; F274-K309 HydrophobicContact CE1-CD 4.26Å; F274-K309 HydrophobicContact CE1-CG 4.19Å; F274-K309 HydrophobicContact CZ-CB 4.39Å; F274-K309 HydrophobicContact CZ-CD 4.03Å; F274-K309 HydrophobicContact CZ-CG 4.28Å
275	I	97.6	Very high	94.8	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.01	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	146.3	178.9	-168.7	164.7	0	0	0	111.3	V264 L265 V266 L302 V307 V308 I310 L337	V264-I275 HydrophobicContact CB-CD1 4.1Å; V264-I275 HydrophobicContact CB-CG1 4.21Å; V264-I275 HydrophobicContact CG1-CD1 4.38Å; V264-I275 HydrophobicContact CG2-CD1 4.26Å; L265-I275 CarbonylContact O-C 3.52Å; L265-I275 VanDerWaalsContact O-CA 3.24Å; L265-I275 WeakPolarHBondContact O-CA 3.45Å; L265-I275 WeakPolarHBondContact O-CG1 3.31Å; V266-I275 HydrophobicContact CG2-CD1 4.05Å; V266-I275 HydrophobicContact CG2-CG1 4.08Å; I275-L302 HydrophobicContact CD1-CD1 4.07Å; I275-L302 HydrophobicContact CG2-CD1 3.98Å; I275-V307 WeakPolarHBondContact O-CA 3.09Å; I275-V308 HydrophobicContact CG2-CG2 3.63Å; I275-V308 PolarHBondContact N-O 2.87Å; I275-V308 PolarHBondContact O-N 3.36Å; I275-I310 HydrophobicContact CB-CD1 3.95Å; I275-I310 HydrophobicContact CB-CG1 4.44Å; I275-I310 HydrophobicContact CD1-CD1 4.3Å; I275-I310 HydrophobicContact CG2-CB 4.41Å; I275-I310 HydrophobicContact CG2-CD1 3.94Å; I275-I310 HydrophobicContact CG2-CG1 4.15Å; I275-I310 HydrophobicContact CG2-CG2 3.42Å; I275-I310 VanDerWaalsContact CG2-CG2 3.42Å; I275-L337 HydrophobicContact CD1-CD1 3.4Å; I275-L337 HydrophobicContact CD1-CD2 4.38Å
276	K	97	Very high	94.4	Very high	68 Å²	68	35.5 Å²	35.5	30%	0.296	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	118.2	166.7	-170.6	176.1	-173.9	168.8	0	109.9	V264 L265 L278 D305 S306 V307	V264-K276 WeakPolarHBondContact CA-O 3.37Å; L265-K276 HydrophobicContact CB-CB 4.25Å; L265-K276 PolarHBondContact N-O 3.25Å; L265-K276 PolarHBondContact O-N 2.85Å; K276-L278 HydrophobicContact CD-CD2 4.02Å; K276-L278 HydrophobicContact CG-CD2 3.97Å; K276-D305 WeakPolarHBondContact CE-O 3.39Å; K276-S306 WeakPolarHBondContact CA-O 3.4Å; K276-V307 HydrophobicContact CB-CG2 4.18Å; K276-V307 HydrophobicContact CD-CG2 3.96Å; K276-V307 HydrophobicContact CG-CG2 4.22Å
277	R	97.4	Very high	93.8	Very high	6 Å²	6	36.2 Å²	36.2	2%	0.023	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	122.6	176.3	176.2	-170.2	164.2	-136	-10	110.4	Q280 S281 V283 L302 D305	R277-Q280 PolarHBondContact NH2-O 2.92Å; R277-S281 PolarHBondContact NE-O 3.45Å; R277-S281 VanDerWaalsContact NH2-C 3.27Å; R277-S281 PolarHBondContact NH2-O 3.44Å; R277-V283 HydrophobicContact CG-CG2 4.04Å; R277-L302 HydrophobicContact CB-CB 4.39Å; R277-L302 VanDerWaalsContact CD-O 3.3Å; R277-L302 WeakPolarHBondContact CD-O 3.07Å; R277-L302 PolarHBondContact NH1-O 3.45Å; R277-D305 PolarHBondContact O-N 2.89Å
278	L	95.8	Very high	92.6	Very high	17 Å²	17	34.3 Å²	34.3	9%	0.089	17%	0.165	C	C	.	.			trans	-114.9	-20.8	177.3	-55.6	179.1	0	0	0	113.1	R262 G263 L265 K276 D305	R262-L278 HydrophobicContact CB-CB 3.78Å; R262-L278 VanDerWaalsContact CB-O 3.32Å; R262-L278 WeakPolarHBondContact CB-O 3.46Å; R262-L278 WeakPolarHBondContact CD-O 3.44Å; R262-L278 PolarHBondContact NH1-O 2.79Å; G263-L278 CarbonylContact O-C 3.52Å; G263-L278 WeakPolarHBondContact O-CA 3.34Å; G263-L278 WeakPolarHBondContact O-CB 3.27Å; G263-L278 PolarHBondContact O-N 3.46Å; L265-L278 HydrophobicContact CD1-CD1 3.93Å; L265-L278 HydrophobicContact CD2-CD1 4.11Å; L265-L278 HydrophobicContact CG-CD1 3.75Å; L265-L278 HydrophobicContact CG-CG 4.41Å; K276-L278 HydrophobicContact CD-CD2 4.02Å; K276-L278 HydrophobicContact CG-CD2 3.97Å; L278-D305 WeakPolarHBondContact CD2-OD1 3.29Å
279	C	95.4	Very high	90.7	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.007	17%	0.174	C	C	.	.	S	Bend	trans	-66.1	159.9	-178.1	61.2	0	0	0	0	113.9	L260 G263 S281 R304	L260-C279 HydrophobicContact CD2-CB 4.02Å; G263-C279 PolarHBondContact O-N 2.86Å; C279-S281 PolarHBondContact SG-O 3.26Å; C279-R304 PolarHBondContact O-NE 2.96Å
280	Q	93.4	Very high	88.5	Confident	101 Å²	101	35.7 Å²	35.7	47%	0.472	18%	0.177	S	C	.	.	S	Bend	trans	-73.6	-40.8	177.8	-65.6	177.8	13.9	0	0	110.9	H259 R277 R304	H259-Q280 HydrophobicContact CB-CB 4.36Å; H259-Q280 PolarHBondContact O-N 2.95Å; R277-Q280 PolarHBondContact NH2-O 2.92Å; Q280-R304 VanDerWaalsContact CA-NH2 3.28Å; Q280-R304 PolarHBondContact O-NH2 3.32Å
281	S	94.6	Very high	86.4	Confident	10 Å²	10	34 Å²	34	7%	0.07	19%	0.188	C	C	.	.	S	Bend	trans	-56.8	144	177	-175.6	0	0	0	0	112.5	L256 H259 R277 C279 G340	L256-S281 WeakPolarHBondContact CD1-OG 3.33Å; H259-S281 PolarHBondContact O-N 2.92Å; R277-S281 PolarHBondContact NE-O 3.45Å; R277-S281 VanDerWaalsContact NH2-C 3.27Å; R277-S281 PolarHBondContact NH2-O 3.44Å; C279-S281 PolarHBondContact SG-O 3.26Å; S281-G340 WeakPolarHBondContact OG-CA 3.47Å; S281-G340 PolarHBondContact OG-N 2.62Å
282	R	95	Very high	84.1	Confident	79 Å²	79	32.8 Å²	32.8	30%	0.298	19%	0.193	S	C	.	.			trans	-61.1	147	165.1	62	-171.5	-174.7	154	-4.7	110.4	F284 G340	R282-F284 HydrophobicContact CB-CE2 4.2Å; R282-F284 HydrophobicContact CG-CD2 4.48Å; R282-F284 HydrophobicContact CG-CE2 3.8Å; R282-G340 PolarHBondContact NE-O 3.02Å; R282-G340 PolarHBondContact NH2-O 3.06Å; R282-G340 PolarHBondContact O-N 3.11Å
283	V	97.3	Very high	81.6	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	125	175.9	-172.5	0	0	0	0	107.5	R277 L302 L337 C338 F339	R277-V283 HydrophobicContact CG-CG2 4.04Å; V283-L302 HydrophobicContact CB-CB 4.44Å; V283-L302 HydrophobicContact CB-CD1 4.27Å; V283-L302 HydrophobicContact CG1-CD1 3.93Å; V283-L302 PolarHBondContact O-N 3.05Å; V283-L337 HydrophobicContact CG1-CB 4.11Å; V283-L337 HydrophobicContact CG1-CD2 4.43Å; V283-C338 CarbonylContact C-O 3.6Å; V283-C338 VanDerWaalsContact CA-O 3.3Å; V283-C338 WeakPolarHBondContact CA-O 3.48Å; V283-F339 HydrophobicContact CG1-CD1 4.3Å; V283-F339 HydrophobicContact CG1-CE1 4.1Å; V283-F339 HydrophobicContact CG1-CE2 4.45Å; V283-F339 HydrophobicContact CG1-CZ 4.18Å; V283-F339 HydrophobicContact CG2-CD1 3.56Å; V283-F339 HydrophobicContact CG2-CE1 3.64Å; V283-F339 HydrophobicContact CG2-CG 4.39Å
284	F	95.5	Very high	79	Confident	19 Å²	19	45 Å²	45	8%	0.083	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	143.4	172.7	-65.5	-100	0	0	0	108.9	R282 W300 K301 L337 C338 E341 E342 L343	R282-F284 HydrophobicContact CB-CE2 4.2Å; R282-F284 HydrophobicContact CG-CD2 4.48Å; R282-F284 HydrophobicContact CG-CE2 3.8Å; F284-W300 CarbonylContact C-O 3.59Å; F284-W300 VanDerWaalsContact CA-O 3.32Å; F284-W300 WeakPolarHBondContact CA-O 3.33Å; F284-K301 HydrophobicContact CD1-CB 4.04Å; F284-K301 HydrophobicContact CE1-CB 3.88Å; F284-K301 HydrophobicContact CE1-CG 4.39Å; F284-K301 HydrophobicContact CZ-CB 4.49Å; F284-L337 CarbonylContact O-C 3.43Å; F284-L337 VanDerWaalsContact O-CA 3.26Å; F284-L337 WeakPolarHBondContact O-CA 3.32Å; F284-C338 HydrophobicContact CB-CB 4.42Å; F284-C338 PolarHBondContact N-O 3.31Å; F284-C338 PolarHBondContact O-N 3.17Å; F284-E341 WeakPolarHBondContact CD2-O 3.32Å; F284-E341 VanDerWaalsContact CE2-O 3.28Å; F284-E341 WeakPolarHBondContact CE2-O 3.44Å; F284-E342 HydrophobicContact CE1-CG 3.98Å; F284-E342 HydrophobicContact CE2-CB 4.25Å; F284-E342 HydrophobicContact CZ-CB 4.08Å; F284-E342 HydrophobicContact CZ-CG 3.92Å; F284-L343 HydrophobicContact CB-CB 3.92Å
285	C	93.7	Very high	76.3	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	139.8	-176.7	-178.9	0	0	0	0	109.4	P299 W300 L302 I310 V335 T336 L337	C285-P299 CarbonylContact O-C 3.54Å; C285-P299 WeakPolarHBondContact O-CA 3.46Å; C285-W300 HydrophobicContact CB-CD2 4.26Å; C285-W300 HydrophobicContact CB-CH2 4.41Å; C285-W300 HydrophobicContact CB-CZ2 3.93Å; C285-W300 PolarHBondContact N-O 3.37Å; C285-W300 PolarHBondContact O-N 3.47Å; C285-W300 WeakPolarHBondContact SG-CZ2 3.29Å; C285-L302 HydrophobicContact CB-CD1 4.24Å; C285-L302 HydrophobicContact CB-CD2 3.69Å; C285-L302 HydrophobicContact CB-CG 3.95Å; C285-I310 VanDerWaalsContact SG-CG2 3.59Å; C285-V335 WeakPolarHBondContact SG-CG1 3.27Å; C285-T336 CarbonylContact C-O 3.5Å; C285-T336 WeakPolarHBondContact CA-O 3.46Å; C285-L337 HydrophobicContact CB-CD2 3.62Å; C285-L337 VanDerWaalsContact SG-CD2 3.59Å
286	S	90.3	Very high	74.1	Confident	6 Å²	6	55.6 Å²	55.6	4%	0.042	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	138.5	171.7	-178.4	0	0	0	0	109.3	S297 V335 T336 V346	S286-S297 PolarHBondContact OG-O 3.35Å; S286-V335 CarbonylContact O-C 3.43Å; S286-V335 WeakPolarHBondContact O-CG1 3.36Å; S286-T336 PolarHBondContact N-O 3.42Å; S286-T336 PolarHBondContact O-N 3.39Å; S286-V346 WeakPolarHBondContact OG-CG2 3.46Å
287	G	83.4	Confident	72.4	Confident	16 Å²	16	53.6 Å²	53.6	17%	0.165	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.6	-168.4	-177.7	0	0	0	0	0	110.2	G289 S297	G287-G289 PolarHBondContact O-N 2.83Å; G287-S297 WeakPolarHBondContact O-CB 3.33Å; G287-S297 PolarHBondContact O-OG 2.82Å
288	L	70.5	Confident	71.2	Confident	55 Å²	55	60.2 Å²	60.2	29%	0.288	34%	0.343	S	S	.	.	S	Bend	trans	-70.2	77.1	174.6	-164.7	67.4	0	0	0	110.2	F316	L288-F316 HydrophobicContact CD2-CB 4.02Å; L288-F316 HydrophobicContact CD2-CD2 4.27Å
289	G	54.1	Low	70.7	Confident	22 Å²	22	60 Å²	60	23%	0.227	34%	0.343	C	S	.	.			trans	-129.7	-7.2	-148.6	0	0	0	0	0	118	G287	G287-G289 PolarHBondContact O-N 2.83Å
290	D	44.4	Very low	70.4	Confident	70 Å²	70	63.3 Å²	63.3	37%	0.374	36%	0.355	S	S	.	.			trans	-155.5	149	160.4	78.7	47.9	0	0	0	110.5	S292	D290-S292 PolarHBondContact O-N 2.91Å; D290-S292 WeakPolarHBondContact OD1-CA 3.38Å; D290-S292 WeakPolarHBondContact OD1-CB 3.37Å; D290-S292 PolarHBondContact OD1-N 3.49Å; D290-S292 PolarHBondContact OD1-OG 2.77Å; D290-S292 PolarHBondContact OD2-OG 2.86Å
291	G	44.8	Very low	70.3	Confident	71 Å²	71	63.2 Å²	63.2	73%	0.732	35%	0.353	S	S	*	.	S	Bend	trans	-85.5	29.2	178.5	0	0	0	0	0	113.2
292	S	41	Very low	70.3	Confident	95 Å²	95	63 Å²	63	66%	0.664	35%	0.351	S	S	*	.	S	Bend	trans	-108.4	-0.8	-168.9	77.7	0	0	0	0	116	D290	D290-S292 PolarHBondContact O-N 2.91Å; D290-S292 WeakPolarHBondContact OD1-CA 3.38Å; D290-S292 WeakPolarHBondContact OD1-CB 3.37Å; D290-S292 PolarHBondContact OD1-N 3.49Å; D290-S292 PolarHBondContact OD1-OG 2.77Å; D290-S292 PolarHBondContact OD2-OG 2.86Å
293	S	40.8	Very low	70.2	Confident	62 Å²	62	64.5 Å²	64.5	43%	0.434	36%	0.362	S	S	.	.			trans	-148	142.7	170.8	88.1	0	0	0	0	113.6	Y295 G296	S293-Y295 PolarHBondContact O-N 2.76Å; S293-Y295 VanDerWaalsContact O-N 3.16Å; S293-Y295 PolarHBondContact OG-N 3.45Å; S293-Y295 PolarHBondContact OG-O 2.7Å; S293-Y295 VanDerWaalsContact OG-O 3.13Å; S293-G296 PolarHBondContact OG-O 2.87Å; S293-G296 VanDerWaalsContact OG-O 3.07Å
294	Q	40.5	Very low	70	Confident	195 Å²	195	68.3 Å²	68.3	91%	0.911	38%	0.376	S	S	*	.	S	Bend	trans	-74.3	12.9	166.3	-59.8	-179.8	33.9	0	0	111.6
295	Y	39.2	Very low	69.9	Low	216 Å²	216	71.1 Å²	71.1	85%	0.847	39%	0.392	S	S	*	.	S	Bend	trans	-140.8	67.5	-173.2	-75.3	-78.4	0	0	0	111	S293	S293-Y295 PolarHBondContact O-N 2.76Å; S293-Y295 VanDerWaalsContact O-N 3.16Å; S293-Y295 PolarHBondContact OG-N 3.45Å; S293-Y295 PolarHBondContact OG-O 2.7Å; S293-Y295 VanDerWaalsContact OG-O 3.13Å
296	G	51.5	Low	69.7	Low	58 Å²	58	73.5 Å²	73.5	60%	0.598	41%	0.409	S	S	*	.			trans	66.5	142.9	168.3	0	0	0	0	0	115.6	S293 M298	S293-G296 PolarHBondContact OG-O 2.87Å; S293-G296 VanDerWaalsContact OG-O 3.07Å; G296-M298 PolarHBondContact O-N 3.29Å; G296-M298 VanDerWaalsContact O-N 3.14Å
297	S	62	Low	69.9	Low	27 Å²	27	77.5 Å²	77.5	19%	0.189	43%	0.433	C	S	.	.			trans	-75	107.2	172.2	-172.4	0	0	0	0	109.1	S286 G287 W300	S286-S297 PolarHBondContact OG-O 3.35Å; G287-S297 WeakPolarHBondContact O-CB 3.33Å; G287-S297 PolarHBondContact O-OG 2.82Å; S297-W300 WeakPolarHBondContact OG-CZ3 3.45Å
298	M	72.9	Confident	70.4	Confident	145 Å²	145	78.9 Å²	78.9	71%	0.714	44%	0.437	S	S	*	.			trans	-58.7	134	174.5	-175.9	-177.4	170.4	0	0	108.9	G296 W300	G296-M298 PolarHBondContact O-N 3.29Å; G296-M298 VanDerWaalsContact O-N 3.14Å; M298-W300 PolarHBondContact O-N 3.28Å
299	P	84.9	Confident	71.5	Confident	13 Å²	13	80.6 Å²	80.6	8%	0.084	44%	0.443	C	S	.	.			trans	-61.3	137	179.3	-20	30.7	0	0	0	111.9	C285 L343 N344	C285-P299 CarbonylContact O-C 3.54Å; C285-P299 WeakPolarHBondContact O-CA 3.46Å; P299-L343 HydrophobicContact CB-CB 3.91Å; P299-L343 HydrophobicContact CB-CD2 3.95Å; P299-L343 HydrophobicContact CB-CG 4.01Å; P299-L343 WeakPolarHBondContact CB-O 3.21Å; P299-L343 HydrophobicContact CG-CB 4.16Å; P299-L343 HydrophobicContact CG-CD2 3.96Å; P299-L343 HydrophobicContact CG-CG 3.81Å; P299-L343 VanDerWaalsContact CG-O 3.23Å; P299-L343 WeakPolarHBondContact CG-O 3.39Å; P299-N344 WeakPolarHBondContact CD-O 3.43Å
300	W	88.3	Confident	73.5	Confident	70 Å²	70	79.7 Å²	79.7	27%	0.265	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	150.1	-179.5	67.5	98	0	0	0	111.5	F284 C285 S297 M298 I310	F284-W300 CarbonylContact C-O 3.59Å; F284-W300 VanDerWaalsContact CA-O 3.32Å; F284-W300 WeakPolarHBondContact CA-O 3.33Å; C285-W300 HydrophobicContact CB-CD2 4.26Å; C285-W300 HydrophobicContact CB-CH2 4.41Å; C285-W300 HydrophobicContact CB-CZ2 3.93Å; C285-W300 PolarHBondContact N-O 3.37Å; C285-W300 PolarHBondContact O-N 3.47Å; C285-W300 WeakPolarHBondContact SG-CZ2 3.29Å; S297-W300 WeakPolarHBondContact OG-CZ3 3.45Å; M298-W300 PolarHBondContact O-N 3.28Å; W300-I310 HydrophobicContact CZ2-CG2 4.2Å
301	K	92.6	Very high	75.8	Confident	99 Å²	99	76.4 Å²	76.4	43%	0.43	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	135.2	177.8	-176.1	-175.9	168.3	-161.2	0	110.3	F284	F284-K301 HydrophobicContact CD1-CB 4.04Å; F284-K301 HydrophobicContact CE1-CB 3.88Å; F284-K301 HydrophobicContact CE1-CG 4.39Å; F284-K301 HydrophobicContact CZ-CB 4.49Å
302	L	94.1	Very high	78.1	Confident	4 Å²	4	74.3 Å²	74.3	2%	0.021	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-84.1	125.4	172.7	-58.9	-174.7	0	0	0	111	I275 R277 V283 C285 V308 I310 L337	I275-L302 HydrophobicContact CD1-CD1 4.07Å; I275-L302 HydrophobicContact CG2-CD1 3.98Å; R277-L302 HydrophobicContact CB-CB 4.39Å; R277-L302 VanDerWaalsContact CD-O 3.3Å; R277-L302 WeakPolarHBondContact CD-O 3.07Å; R277-L302 PolarHBondContact NH1-O 3.45Å; V283-L302 HydrophobicContact CB-CB 4.44Å; V283-L302 HydrophobicContact CB-CD1 4.27Å; V283-L302 HydrophobicContact CG1-CD1 3.93Å; V283-L302 PolarHBondContact O-N 3.05Å; C285-L302 HydrophobicContact CB-CD1 4.24Å; C285-L302 HydrophobicContact CB-CD2 3.69Å; C285-L302 HydrophobicContact CB-CG 3.95Å; L302-V308 HydrophobicContact CD2-CG2 3.89Å; L302-I310 HydrophobicContact CD2-CG2 4.26Å; L302-L337 HydrophobicContact CD1-CD2 4.07Å
303	E	92.1	Very high	80.5	Confident	112 Å²	112	69.9 Å²	69.9	52%	0.523	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-71.5	142.2	173.3	-69.9	-51.6	138.6	0	0	111.9
304	R	94.2	Very high	82.8	Confident	79 Å²	79	68.5 Å²	68.5	30%	0.298	35%	0.352	S	S	.	.	B	Isolated β-bridge	trans	-73.8	142.8	-178.2	-162.1	-172.7	-75.8	153.1	10.6	109.5	D101 C279 Q280 S306	D101-R304 VanDerWaalsContact CG-NH2 3.35Å; D101-R304 IonicContact OD1-CZ 3.38Å; D101-R304 IonicContact OD1-NH2 3.5Å; D101-R304 PolarHBondContact OD1-NH2 3.4Å; D101-R304 IonicContact OD2-NH2 3.98Å; D101-R304 PolarHBondContact OD2-NH2 3.03Å; C279-R304 PolarHBondContact O-NE 2.96Å; Q280-R304 VanDerWaalsContact CA-NH2 3.28Å; Q280-R304 PolarHBondContact O-NH2 3.32Å; R304-S306 PolarHBondContact O-N 3.01Å
305	D	91.7	Very high	85.2	Confident	78 Å²	78	64 Å²	64	42%	0.417	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	61	10.8	177.1	-57.2	-64.6	0	0	0	114.9	R262 K276 R277 L278	R262-D305 IonicContact CZ-OD1 2.98Å; R262-D305 IonicContact NH1-OD1 3.87Å; R262-D305 IonicContact NH1-OD2 3.62Å; R262-D305 IonicContact NH2-OD1 2.71Å; R262-D305 PolarHBondContact NH2-OD1 2.79Å; R262-D305 VanDerWaalsContact NH2-OD1 3.17Å; K276-D305 WeakPolarHBondContact CE-O 3.39Å; R277-D305 PolarHBondContact O-N 2.89Å; L278-D305 WeakPolarHBondContact CD2-OD1 3.29Å
306	S	91.2	Very high	87.7	Confident	51 Å²	51	53.7 Å²	53.7	36%	0.357	29%	0.286	S	S	.	.			trans	-99.9	141.6	171.6	-172.5	0	0	0	0	111.5	K276 R304	K276-S306 WeakPolarHBondContact CA-O 3.4Å; R304-S306 PolarHBondContact O-N 3.01Å
307	V	94.3	Very high	89.5	Confident	90 Å²	90	51.5 Å²	51.5	55%	0.545	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	125.4	172.2	-179.2	0	0	0	0	108.1	F274 I275 K276	F274-V307 HydrophobicContact CB-CG1 4.41Å; F274-V307 HydrophobicContact CD1-CG1 4.45Å; I275-V307 WeakPolarHBondContact O-CA 3.09Å; K276-V307 HydrophobicContact CB-CG2 4.18Å; K276-V307 HydrophobicContact CD-CG2 3.96Å; K276-V307 HydrophobicContact CG-CG2 4.22Å
308	V	93.8	Very high	90.8	Very high	44 Å²	44	56.3 Å²	56.3	27%	0.267	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	147.4	179.5	-61.7	0	0	0	0	111.2	F274 I275 L302 I310	F274-V308 WeakPolarHBondContact CA-O 3.35Å; I275-V308 HydrophobicContact CG2-CG2 3.63Å; I275-V308 PolarHBondContact N-O 2.87Å; I275-V308 PolarHBondContact O-N 3.36Å; L302-V308 HydrophobicContact CD2-CG2 3.89Å; V308-I310 HydrophobicContact CG2-CG2 4.08Å
309	K	94.2	Very high	91.6	Very high	92 Å²	92	50.1 Å²	50.1	40%	0.4	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	122.7	171.6	-176.1	170.9	58.1	173.2	0	109	I273 F274 F311 D312	I273-K309 CarbonylContact O-C 3.4Å; I273-K309 WeakPolarHBondContact O-CA 3.3Å; F274-K309 HydrophobicContact CD1-CB 4Å; F274-K309 HydrophobicContact CE1-CB 3.8Å; F274-K309 HydrophobicContact CE1-CD 4.26Å; F274-K309 HydrophobicContact CE1-CG 4.19Å; F274-K309 HydrophobicContact CZ-CB 4.39Å; F274-K309 HydrophobicContact CZ-CD 4.03Å; F274-K309 HydrophobicContact CZ-CG 4.28Å; K309-F311 VanDerWaalsContact CG-O 3.22Å; K309-F311 WeakPolarHBondContact CG-O 3.33Å; K309-D312 HydrophobicContact CD-CB 4.46Å; K309-D312 WeakPolarHBondContact CE-OD2 3.4Å; K309-D312 IonicContact NZ-OD2 2.71Å; K309-D312 PolarHBondContact NZ-OD2 2.87Å
310	I	94.6	Very high	91.9	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	-14.3	-177	54.7	168.2	0	0	0	113.6	I273 I275 C285 W300 L302 V308 V335 I358	I273-I310 HydrophobicContact CB-CD1 4.5Å; I273-I310 HydrophobicContact CB-CG1 4.02Å; I273-I310 HydrophobicContact CG2-CD1 3.86Å; I273-I310 HydrophobicContact CG2-CG1 3.86Å; I273-I310 WeakPolarHBondContact O-CG1 3.48Å; I273-I310 PolarHBondContact O-N 2.62Å; I275-I310 HydrophobicContact CB-CD1 3.95Å; I275-I310 HydrophobicContact CB-CG1 4.44Å; I275-I310 HydrophobicContact CD1-CD1 4.3Å; I275-I310 HydrophobicContact CG2-CB 4.41Å; I275-I310 HydrophobicContact CG2-CD1 3.94Å; I275-I310 HydrophobicContact CG2-CG1 4.15Å; I275-I310 HydrophobicContact CG2-CG2 3.42Å; I275-I310 VanDerWaalsContact CG2-CG2 3.42Å; C285-I310 VanDerWaalsContact SG-CG2 3.59Å; W300-I310 HydrophobicContact CZ2-CG2 4.2Å; L302-I310 HydrophobicContact CD2-CG2 4.26Å; V308-I310 HydrophobicContact CG2-CG2 4.08Å; I310-V335 HydrophobicContact CB-CG1 4.22Å; I310-V335 HydrophobicContact CD1-CB 4.48Å; I310-V335 HydrophobicContact CD1-CG1 4.08Å; I310-V335 HydrophobicContact CG1-CG1 4.48Å; I310-V335 WeakPolarHBondContact O-CG2 3.47Å; I310-I358 HydrophobicContact CD1-CD1 4.5Å
311	F	93.9	Very high	91.9	Very high	1 Å²	1	50.5 Å²	50.5	0%	0.004	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	135.5	171.8	-175.3	-91.8	0	0	0	108.2	G272 I273 K309 F316 V335 M360 C363	G272-F311 WeakPolarHBondContact CA-O 3.28Å; I273-F311 HydrophobicContact CB-CB 3.75Å; I273-F311 HydrophobicContact CD1-CB 3.83Å; I273-F311 HydrophobicContact CD1-CG 4.18Å; I273-F311 HydrophobicContact CG1-CB 3.72Å; I273-F311 HydrophobicContact CG1-CD1 4.34Å; I273-F311 HydrophobicContact CG1-CG 4.26Å; I273-F311 PolarHBondContact N-O 3.21Å; I273-F311 VanDerWaalsContact N-O 3.11Å; I273-F311 PolarHBondContact O-N 3.23Å; K309-F311 VanDerWaalsContact CG-O 3.22Å; K309-F311 WeakPolarHBondContact CG-O 3.33Å; F311-F316 HydrophobicContact CE1-CB 4.08Å; F311-F316 HydrophobicContact CE1-CG 4.47Å; F311-F316 HydrophobicContact CE2-CB 4.44Å; F311-F316 HydrophobicContact CE2-CD2 4.21Å; F311-F316 HydrophobicContact CZ-CB 3.62Å; F311-F316 AromaticContact CZ-CD2 3.74Å; F311-F316 HydrophobicContact CZ-CD2 3.74Å; F311-F316 AromaticContact CZ-CG 3.72Å; F311-F316 HydrophobicContact CZ-CG 3.72Å; F311-V335 HydrophobicContact CB-CG2 3.78Å; F311-V335 HydrophobicContact CD2-CG2 3.99Å; F311-V335 HydrophobicContact CG-CG2 4.37Å; F311-M360 HydrophobicContact CD1-SD 3.6Å; F311-M360 HydrophobicContact CE1-CB 4.19Å; F311-M360 HydrophobicContact CE1-CG 4.45Å; F311-M360 HydrophobicContact CE1-SD 3.55Å; F311-M360 VanDerWaalsContact CE1-SD 3.55Å; F311-M360 HydrophobicContact CZ-CB 4.4Å; F311-C363 HydrophobicContact CZ-CB 4.22Å
312	D	91.9	Very high	91.8	Very high	27 Å²	27	48.9 Å²	48.9	14%	0.144	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	110.9	178	-172.3	-57.9	0	0	0	109.6	K309 G314 R315 F316	K309-D312 HydrophobicContact CD-CB 4.46Å; K309-D312 WeakPolarHBondContact CE-OD2 3.4Å; K309-D312 IonicContact NZ-OD2 2.71Å; K309-D312 PolarHBondContact NZ-OD2 2.87Å; D312-G314 VanDerWaalsContact C-N 3.3Å; D312-G314 PolarHBondContact O-N 2.69Å; D312-G314 WeakPolarHBondContact OD1-CA 3.16Å; D312-G314 PolarHBondContact OD1-N 2.79Å; D312-R315 HydrophobicContact CB-CB 4.06Å; D312-R315 HydrophobicContact CB-CG 4.05Å; D312-R315 PolarHBondContact O-N 3.34Å; D312-R315 PolarHBondContact OD1-N 2.75Å; D312-F316 PolarHBondContact O-N 3.14Å
313	T	91.4	Very high	91.5	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.012	26%	0.256	C	S	.	.	H	α-helix	trans	-61.7	-38.7	-178	-61.1	0	0	0	0	111.7	Q270 E271 G272 F316 F317	Q270-T313 VanDerWaalsContact O-CB 3.23Å; Q270-T313 WeakPolarHBondContact O-CB 3.38Å; Q270-T313 WeakPolarHBondContact O-CG2 3.37Å; Q270-T313 PolarHBondContact O-OG1 3.23Å; E271-T313 PolarHBondContact O-N 3.07Å; E271-T313 PolarHBondContact O-OG1 3.39Å; G272-T313 WeakPolarHBondContact CA-OG1 2.96Å; G272-T313 PolarHBondContact N-OG1 2.79Å; T313-F316 WeakPolarHBondContact O-CB 3.35Å; T313-F316 PolarHBondContact O-N 2.74Å; T313-F317 HydrophobicContact CG2-CD2 3.76Å; T313-F317 HydrophobicContact CG2-CE2 3.23Å; T313-F317 HydrophobicContact CG2-CZ 4.04Å; T313-F317 WeakPolarHBondContact O-CD2 2.91Å; T313-F317 PolarHBondContact O-N 3.2Å
314	G	90.3	Very high	91.3	Very high	34 Å²	34	49.8 Å²	49.8	35%	0.351	25%	0.254	S	S	.	.	H	α-helix	trans	-64.7	-43.6	179	0	0	0	0	0	112.2	D312 F317 Q318	D312-G314 VanDerWaalsContact C-N 3.3Å; D312-G314 PolarHBondContact O-N 2.69Å; D312-G314 WeakPolarHBondContact OD1-CA 3.16Å; D312-G314 PolarHBondContact OD1-N 2.79Å; G314-F317 PolarHBondContact O-N 3.3Å; G314-Q318 WeakPolarHBondContact O-CG 3.23Å; G314-Q318 PolarHBondContact O-N 2.55Å
315	R	89.8	Confident	91.1	Very high	100 Å²	100	51 Å²	51	38%	0.377	26%	0.263	S	S	.	.	H	α-helix	trans	-64.6	-39.7	174.4	-70.5	-174.1	-178.8	156.5	0.3	112.3	D312 F317 Q318 A319	D312-R315 HydrophobicContact CB-CB 4.06Å; D312-R315 HydrophobicContact CB-CG 4.05Å; D312-R315 PolarHBondContact O-N 3.34Å; D312-R315 PolarHBondContact OD1-N 2.75Å; R315-F317 VanDerWaalsContact C-N 3.29Å; R315-F317 PolarHBondContact O-N 3.13Å; R315-Q318 PolarHBondContact O-N 2.87Å; R315-A319 WeakPolarHBondContact O-CB 3.18Å; R315-A319 PolarHBondContact O-N 3.4Å
316	F	91.7	Very high	90.9	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-57.6	-44.9	174.4	177.4	-93.5	0	0	0	111	L288 F311 D312 T313 A319 L320 P331 P333 C363 L367	L288-F316 HydrophobicContact CD2-CB 4.02Å; L288-F316 HydrophobicContact CD2-CD2 4.27Å; F311-F316 HydrophobicContact CE1-CB 4.08Å; F311-F316 HydrophobicContact CE1-CG 4.47Å; F311-F316 HydrophobicContact CE2-CB 4.44Å; F311-F316 HydrophobicContact CE2-CD2 4.21Å; F311-F316 HydrophobicContact CZ-CB 3.62Å; F311-F316 AromaticContact CZ-CD2 3.74Å; F311-F316 HydrophobicContact CZ-CD2 3.74Å; F311-F316 AromaticContact CZ-CG 3.72Å; F311-F316 HydrophobicContact CZ-CG 3.72Å; D312-F316 PolarHBondContact O-N 3.14Å; T313-F316 WeakPolarHBondContact O-CB 3.35Å; T313-F316 PolarHBondContact O-N 2.74Å; F316-A319 CarbonylContact O-C 3.44Å; F316-A319 PolarHBondContact O-N 3.07Å; F316-L320 HydrophobicContact CE1-CB 4.44Å; F316-L320 HydrophobicContact CE1-CD1 4.36Å; F316-L320 HydrophobicContact CE1-CD2 4.01Å; F316-L320 HydrophobicContact CZ-CD1 4.23Å; F316-L320 WeakPolarHBondContact O-CB 3.44Å; F316-L320 PolarHBondContact O-N 3.21Å; F316-P331 HydrophobicContact CD2-CB 3.87Å; F316-P331 HydrophobicContact CD2-CG 4.13Å; F316-P331 HydrophobicContact CE2-CB 3.78Å; F316-P331 HydrophobicContact CE2-CG 3.69Å; F316-P331 HydrophobicContact CZ-CG 4.11Å; F316-P333 HydrophobicContact CE2-CB 3.91Å; F316-P333 HydrophobicContact CZ-CB 4.23Å; F316-C363 HydrophobicContact CD1-CB 3.79Å; F316-C363 HydrophobicContact CD2-CB 4.44Å; F316-C363 HydrophobicContact CE1-CB 3.46Å; F316-C363 VanDerWaalsContact CE1-CB 3.46Å; F316-C363 HydrophobicContact CE2-CB 4.15Å; F316-C363 HydrophobicContact CG-CB 4.27Å; F316-C363 HydrophobicContact CZ-CB 3.66Å; F316-C363 WeakPolarHBondContact CZ-O 3.14Å; F316-L367 HydrophobicContact CZ-CB 4.41Å
317	F	89.7	Confident	90.7	Very high	12 Å²	12	53.7 Å²	53.7	5%	0.053	28%	0.283	C	S	.	.	H	α-helix	trans	-66.8	-39.6	178.5	-72	-49.8	0	0	0	114.8	T313 G314 R315 A319 L320 Q321 M366 Y399 L402	T313-F317 HydrophobicContact CG2-CD2 3.76Å; T313-F317 HydrophobicContact CG2-CE2 3.23Å; T313-F317 HydrophobicContact CG2-CZ 4.04Å; T313-F317 WeakPolarHBondContact O-CD2 2.91Å; T313-F317 PolarHBondContact O-N 3.2Å; G314-F317 PolarHBondContact O-N 3.3Å; R315-F317 VanDerWaalsContact C-N 3.29Å; R315-F317 PolarHBondContact O-N 3.13Å; F317-A319 VanDerWaalsContact C-N 3.3Å; F317-A319 PolarHBondContact O-N 3.28Å; F317-L320 HydrophobicContact CD1-CD2 4.21Å; F317-L320 WeakPolarHBondContact O-CB 3.31Å; F317-L320 PolarHBondContact O-N 2.82Å; F317-Q321 PolarHBondContact O-N 2.86Å; F317-M366 HydrophobicContact CD1-CE 4.36Å; F317-M366 HydrophobicContact CE1-CE 3.13Å; F317-M366 HydrophobicContact CE1-SD 3.46Å; F317-M366 WeakPolarHBondContact CE1-SD 3.5Å; F317-M366 HydrophobicContact CZ-CE 3.35Å; F317-M366 HydrophobicContact CZ-SD 3.83Å; F317-Y399 AromaticContact CD1-CD2 3.59Å; F317-Y399 HydrophobicContact CD1-CD2 3.59Å; F317-Y399 AromaticContact CD1-CE2 3.64Å; F317-Y399 HydrophobicContact CD1-CE2 3.64Å; F317-Y399 AromaticContact CE1-CD2 3.6Å; F317-Y399 HydrophobicContact CE1-CD2 3.6Å; F317-Y399 HydrophobicContact CE1-CE2 4.13Å; F317-Y399 HydrophobicContact CG-CD2 4.44Å; F317-Y399 HydrophobicContact CG-CE2 4.36Å; F317-Y399 HydrophobicContact CZ-CD2 4.45Å; F317-L402 HydrophobicContact CD2-CB 4.24Å; F317-L402 HydrophobicContact CD2-CD1 4.3Å; F317-L402 HydrophobicContact CE2-CB 4.01Å; F317-L402 HydrophobicContact CE2-CD1 3.33Å; F317-L402 HydrophobicContact CE2-CG 4.21Å; F317-L402 HydrophobicContact CZ-CD1 3.84Å
318	Q	90.2	Very high	90.4	Very high	128 Å²	128	52.9 Å²	52.9	60%	0.598	27%	0.274	S	S	*	.	H	α-helix	trans	-59.4	-45.9	173.2	-69.8	170.1	16	0	0	110.4	G314 R315 L320 Q321 L322	G314-Q318 WeakPolarHBondContact O-CG 3.23Å; G314-Q318 PolarHBondContact O-N 2.55Å; R315-Q318 PolarHBondContact O-N 2.87Å; Q318-L320 VanDerWaalsContact C-N 3.33Å; Q318-L320 PolarHBondContact O-N 2.82Å; Q318-Q321 PolarHBondContact O-N 2.74Å; Q318-L322 WeakPolarHBondContact O-CG 3.36Å; Q318-L322 PolarHBondContact O-N 2.85Å
319	A	89.8	Confident	90.1	Very high	15 Å²	15	54.8 Å²	54.8	12%	0.124	30%	0.295	C	S	.	.	H	α-helix	trans	-64.1	-38	175.1	0	0	0	0	0	112.1	R315 F316 F317 Q321 L322 Y323 I328 P331	R315-A319 WeakPolarHBondContact O-CB 3.18Å; R315-A319 PolarHBondContact O-N 3.4Å; F316-A319 CarbonylContact O-C 3.44Å; F316-A319 PolarHBondContact O-N 3.07Å; F317-A319 VanDerWaalsContact C-N 3.3Å; F317-A319 PolarHBondContact O-N 3.28Å; A319-Q321 VanDerWaalsContact C-N 3.34Å; A319-Q321 PolarHBondContact O-N 3.08Å; A319-L322 PolarHBondContact O-N 2.8Å; A319-Y323 WeakPolarHBondContact O-CB 3.46Å; A319-Y323 PolarHBondContact O-N 3.29Å; A319-I328 HydrophobicContact CB-CD1 3.85Å; A319-I328 WeakPolarHBondContact O-CD1 3.22Å; A319-P331 HydrophobicContact CB-CB 3.81Å; A319-P331 HydrophobicContact CB-CG 4.26Å
320	L	89.9	Confident	89.8	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-64.7	-38.8	177.9	-166.2	68.7	0	0	0	111.9	F316 F317 Q318 Y323 Q324 P331 M366 L367 L370 Y399	F316-L320 HydrophobicContact CE1-CB 4.44Å; F316-L320 HydrophobicContact CE1-CD1 4.36Å; F316-L320 HydrophobicContact CE1-CD2 4.01Å; F316-L320 HydrophobicContact CZ-CD1 4.23Å; F316-L320 WeakPolarHBondContact O-CB 3.44Å; F316-L320 PolarHBondContact O-N 3.21Å; F317-L320 HydrophobicContact CD1-CD2 4.21Å; F317-L320 WeakPolarHBondContact O-CB 3.31Å; F317-L320 PolarHBondContact O-N 2.82Å; Q318-L320 VanDerWaalsContact C-N 3.33Å; Q318-L320 PolarHBondContact O-N 2.82Å; L320-Y323 WeakPolarHBondContact O-CB 3.49Å; L320-Y323 PolarHBondContact O-N 3.47Å; L320-Q324 WeakPolarHBondContact O-CB 3.45Å; L320-Q324 PolarHBondContact O-N 2.9Å; L320-P331 HydrophobicContact CB-CG 4.24Å; L320-P331 HydrophobicContact CD1-CG 3.87Å; L320-M366 HydrophobicContact CD2-CB 4.19Å; L320-L367 HydrophobicContact CD1-CB 4.17Å; L320-L367 HydrophobicContact CD1-CD1 3.59Å; L320-L367 HydrophobicContact CD1-CG 4.48Å; L320-L370 HydrophobicContact CD1-CD1 3.69Å; L320-L370 HydrophobicContact CD2-CD1 3.6Å; L320-L370 HydrophobicContact CG-CD1 3.43Å; L320-L370 VanDerWaalsContact CG-CD1 3.43Å; L320-Y399 HydrophobicContact CD2-CE2 4.22Å
321	Q	89.1	Confident	89.7	Confident	90 Å²	90	53.2 Å²	53.2	42%	0.421	30%	0.298	S	S	.	.	H	α-helix	trans	-65.6	-48.1	174.3	-176.3	-178.6	-15	0	0	111.3	F317 Q318 A319 Y323 Q324 E325	F317-Q321 PolarHBondContact O-N 2.86Å; Q318-Q321 PolarHBondContact O-N 2.74Å; A319-Q321 VanDerWaalsContact C-N 3.34Å; A319-Q321 PolarHBondContact O-N 3.08Å; Q321-Y323 PolarHBondContact O-N 3.05Å; Q321-Q324 WeakPolarHBondContact O-CB 3.33Å; Q321-Q324 PolarHBondContact O-N 2.9Å; Q321-Q324 VanDerWaalsContact O-N 3.07Å; Q321-E325 WeakPolarHBondContact CG-OE1 3.09Å; Q321-E325 PolarHBondContact NE2-OE1 3.28Å; Q321-E325 VanDerWaalsContact NE2-OE1 3.12Å; Q321-E325 WeakPolarHBondContact O-CG 3.33Å; Q321-E325 PolarHBondContact O-N 2.61Å
322	L	89.4	Confident	89.6	Confident	65 Å²	65	57 Å²	57	34%	0.34	32%	0.318	S	S	.	.	H	α-helix	trans	-60.4	-37.3	175.4	-68.3	173.5	0	0	0	111.7	Q318 A319 E325 G326 Q327 I328	Q318-L322 WeakPolarHBondContact O-CG 3.36Å; Q318-L322 PolarHBondContact O-N 2.85Å; A319-L322 PolarHBondContact O-N 2.8Å; L322-E325 PolarHBondContact O-N 2.97Å; L322-G326 PolarHBondContact O-N 3.43Å; L322-Q327 HydrophobicContact CB-CB 4.43Å; L322-Q327 PolarHBondContact O-N 3.04Å; L322-I328 HydrophobicContact CB-CD1 3.86Å; L322-I328 HydrophobicContact CB-CG1 3.74Å; L322-I328 HydrophobicContact CB-CG2 4.37Å; L322-I328 HydrophobicContact CD1-CD1 4.38Å
323	Y	89	Confident	89.7	Confident	32 Å²	32	56.3 Å²	56.3	13%	0.125	32%	0.316	C	S	.	.	H	α-helix	trans	-62.8	-45.6	173	173.1	-110.6	0	0	0	111	A319 L320 Q321 E325 G326 I328 A329 A330 L367 N371 R374	A319-Y323 WeakPolarHBondContact O-CB 3.46Å; A319-Y323 PolarHBondContact O-N 3.29Å; L320-Y323 WeakPolarHBondContact O-CB 3.49Å; L320-Y323 PolarHBondContact O-N 3.47Å; Q321-Y323 PolarHBondContact O-N 3.05Å; Y323-E325 VanDerWaalsContact C-N 3.27Å; Y323-E325 PolarHBondContact O-N 2.85Å; Y323-G326 WeakPolarHBondContact O-CA 3.44Å; Y323-G326 PolarHBondContact O-N 2.91Å; Y323-I328 WeakPolarHBondContact CD2-O 3.36Å; Y323-A329 VanDerWaalsContact CD2-C 3.49Å; Y323-A330 VanDerWaalsContact CD2-CA 3.43Å; Y323-A330 HydrophobicContact CD2-CB 4.04Å; Y323-A330 VanDerWaalsContact CD2-N 3.28Å; Y323-A330 HydrophobicContact CE1-CB 4.34Å; Y323-A330 HydrophobicContact CE2-CB 3.73Å; Y323-A330 HydrophobicContact CG-CB 4.46Å; Y323-L367 HydrophobicContact CD1-CD1 4.05Å; Y323-L367 HydrophobicContact CE1-CD1 3.96Å; Y323-N371 VanDerWaalsContact CE1-OD1 3.3Å; Y323-N371 WeakPolarHBondContact CE1-OD1 3.28Å; Y323-N371 PolarHBondContact OH-OD1 2.82Å; Y323-R374 PolarHBondContact O-NH2 3.33Å; Y323-R374 PolarHBondContact OH-NH1 3.45Å; Y323-R374 VanDerWaalsContact OH-NH1 3.12Å
324	Q	88.2	Confident	89.8	Confident	102 Å²	102	56.6 Å²	56.6	48%	0.477	32%	0.317	S	S	.	.	H	α-helix	trans	-58	-40	177.3	-179.1	178.2	-16.2	0	0	111.8	L320 Q321 G326 R374	L320-Q324 WeakPolarHBondContact O-CB 3.45Å; L320-Q324 PolarHBondContact O-N 2.9Å; Q321-Q324 WeakPolarHBondContact O-CB 3.33Å; Q321-Q324 PolarHBondContact O-N 2.9Å; Q321-Q324 VanDerWaalsContact O-N 3.07Å; Q324-G326 PolarHBondContact O-N 3.41Å; Q324-R374 PolarHBondContact O-NH2 3.23Å
325	E	89.2	Confident	90	Very high	106 Å²	106	55 Å²	55	50%	0.495	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-4.1	175.6	-65.9	169.5	-167	0	0	113.6	Q321 L322 Y323 Q327	Q321-E325 WeakPolarHBondContact CG-OE1 3.09Å; Q321-E325 PolarHBondContact NE2-OE1 3.28Å; Q321-E325 VanDerWaalsContact NE2-OE1 3.12Å; Q321-E325 WeakPolarHBondContact O-CG 3.33Å; Q321-E325 PolarHBondContact O-N 2.61Å; L322-E325 PolarHBondContact O-N 2.97Å; Y323-E325 VanDerWaalsContact C-N 3.27Å; Y323-E325 PolarHBondContact O-N 2.85Å; E325-Q327 VanDerWaalsContact C-N 3.34Å; E325-Q327 HydrophobicContact CB-CG 4.07Å; E325-Q327 PolarHBondContact OE2-NE2 3.33Å
326	G	87.9	Confident	90.3	Very high	57 Å²	57	50.8 Å²	50.8	59%	0.588	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.5	14.2	177.1	0	0	0	0	0	114.5	L322 Y323 Q324	L322-G326 PolarHBondContact O-N 3.43Å; Y323-G326 WeakPolarHBondContact O-CA 3.44Å; Y323-G326 PolarHBondContact O-N 2.91Å; Q324-G326 PolarHBondContact O-N 3.41Å
327	Q	87.3	Confident	90.6	Very high	128 Å²	128	50.8 Å²	50.8	60%	0.598	29%	0.286	S	S	*	.	S	Bend	trans	-82.7	-31.8	-175.2	-57.4	-165.7	41.6	0	0	113.3	L322 E325	L322-Q327 HydrophobicContact CB-CB 4.43Å; L322-Q327 PolarHBondContact O-N 3.04Å; E325-Q327 VanDerWaalsContact C-N 3.34Å; E325-Q327 HydrophobicContact CB-CG 4.07Å; E325-Q327 PolarHBondContact OE2-NE2 3.33Å
328	I	86.7	Confident	90.9	Very high	73 Å²	73	50.2 Å²	50.2	37%	0.374	28%	0.284	S	S	.	.	S	Bend	trans	-131.7	170	-178.4	67.1	167.9	0	0	0	111.3	A319 L322 Y323	A319-I328 HydrophobicContact CB-CD1 3.85Å; A319-I328 WeakPolarHBondContact O-CD1 3.22Å; L322-I328 HydrophobicContact CB-CD1 3.86Å; L322-I328 HydrophobicContact CB-CG1 3.74Å; L322-I328 HydrophobicContact CB-CG2 4.37Å; L322-I328 HydrophobicContact CD1-CD1 4.38Å; Y323-I328 WeakPolarHBondContact CD2-O 3.36Å
329	A	88.4	Confident	91.3	Very high	84 Å²	84	44.1 Å²	44.1	69%	0.694	26%	0.255	S	S	*	.	P	Polyproline II helix	trans	-71.6	164	169.5	0	0	0	0	0	111.7	Y323	Y323-A329 VanDerWaalsContact CD2-C 3.49Å
330	A	88.5	Confident	91.5	Very high	50 Å²	50	44.4 Å²	44.4	41%	0.413	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-58	130.4	-179.5	0	0	0	0	0	111.2	Y323 L367	Y323-A330 VanDerWaalsContact CD2-CA 3.43Å; Y323-A330 HydrophobicContact CD2-CB 4.04Å; Y323-A330 VanDerWaalsContact CD2-N 3.28Å; Y323-A330 HydrophobicContact CE1-CB 4.34Å; Y323-A330 HydrophobicContact CE2-CB 3.73Å; Y323-A330 HydrophobicContact CG-CB 4.46Å; A330-L367 HydrophobicContact CB-CD1 4.12Å; A330-L367 HydrophobicContact CB-CD2 4.47Å
331	P	91.5	Very high	91.6	Very high	10 Å²	10	46.8 Å²	46.8	7%	0.065	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-69.6	140.3	175.9	28.8	-34.9	0	0	0	111	F316 A319 L320 P333 L367	F316-P331 HydrophobicContact CD2-CB 3.87Å; F316-P331 HydrophobicContact CD2-CG 4.13Å; F316-P331 HydrophobicContact CE2-CB 3.78Å; F316-P331 HydrophobicContact CE2-CG 3.69Å; F316-P331 HydrophobicContact CZ-CG 4.11Å; A319-P331 HydrophobicContact CB-CB 3.81Å; A319-P331 HydrophobicContact CB-CG 4.26Å; L320-P331 HydrophobicContact CB-CG 4.24Å; L320-P331 HydrophobicContact CD1-CG 3.87Å; P331-P333 WeakPolarHBondContact O-CD 3.25Å; P331-L367 WeakPolarHBondContact O-CD2 3.31Å
332	D	90.9	Very high	91.6	Very high	81 Å²	81	47.5 Å²	47.5	43%	0.433	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-79.1	122.3	174.3	-170.5	-11.8	0	0	0	110	S334	D332-S334 PolarHBondContact O-N 3.26Å; D332-S334 WeakPolarHBondContact OD1-CA 3.4Å; D332-S334 WeakPolarHBondContact OD1-CB 3.37Å; D332-S334 PolarHBondContact OD1-N 2.95Å; D332-S334 PolarHBondContact OD1-OG 3.22Å
333	P	94.2	Very high	91.4	Very high	13 Å²	13	44.6 Å²	44.6	8%	0.084	26%	0.259	C	S	.	.			trans	-77.2	7.1	175.4	33.7	-37.4	0	0	0	113.3	F316 P331 T359 M360 C363 Q364	F316-P333 HydrophobicContact CE2-CB 3.91Å; F316-P333 HydrophobicContact CZ-CB 4.23Å; P331-P333 WeakPolarHBondContact O-CD 3.25Å; P333-T359 HydrophobicContact CB-CG2 4.21Å; P333-T359 HydrophobicContact CG-CG2 4.01Å; P333-M360 PolarHBondContact O-N 2.89Å; P333-C363 HydrophobicContact CB-CB 3.79Å; P333-Q364 HydrophobicContact CB-CB 4.18Å; P333-Q364 HydrophobicContact CG-CB 3.93Å; P333-Q364 HydrophobicContact CG-CG 4.44Å
334	S	94.3	Very high	90.8	Very high	7 Å²	7	48.4 Å²	48.4	5%	0.049	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	155.9	-171.9	-38.7	0	0	0	0	113.8	D332 Q357 I358 T359	D332-S334 PolarHBondContact O-N 3.26Å; D332-S334 WeakPolarHBondContact OD1-CA 3.4Å; D332-S334 WeakPolarHBondContact OD1-CB 3.37Å; D332-S334 PolarHBondContact OD1-N 2.95Å; D332-S334 PolarHBondContact OD1-OG 3.22Å; S334-Q357 PolarHBondContact OG-NE2 2.91Å; S334-I358 CarbonylContact C-O 3.5Å; S334-I358 WeakPolarHBondContact CA-O 3.46Å; S334-T359 WeakPolarHBondContact CB-OG1 3.43Å; S334-T359 PolarHBondContact OG-OG1 3.17Å
335	V	94.8	Very high	90.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	138.2	168.2	-177.3	0	0	0	0	108.9	C285 S286 I310 F311 L337 Q357 I358	C285-V335 WeakPolarHBondContact SG-CG1 3.27Å; S286-V335 CarbonylContact O-C 3.43Å; S286-V335 WeakPolarHBondContact O-CG1 3.36Å; I310-V335 HydrophobicContact CB-CG1 4.22Å; I310-V335 HydrophobicContact CD1-CB 4.48Å; I310-V335 HydrophobicContact CD1-CG1 4.08Å; I310-V335 HydrophobicContact CG1-CG1 4.48Å; I310-V335 WeakPolarHBondContact O-CG2 3.47Å; F311-V335 HydrophobicContact CB-CG2 3.78Å; F311-V335 HydrophobicContact CD2-CG2 3.99Å; F311-V335 HydrophobicContact CG-CG2 4.37Å; V335-L337 HydrophobicContact CG1-CD2 4.37Å; V335-Q357 CarbonylContact O-C 3.54Å; V335-Q357 WeakPolarHBondContact O-CA 3.32Å; V335-I358 PolarHBondContact N-O 3.12Å; V335-I358 PolarHBondContact O-N 2.92Å
336	T	95.6	Very high	89.7	Confident	12 Å²	12	45.6 Å²	45.6	7%	0.074	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	126.4	177.1	-62	0	0	0	0	110.1	C285 S286 L343 I355	C285-T336 CarbonylContact C-O 3.5Å; C285-T336 WeakPolarHBondContact CA-O 3.46Å; S286-T336 PolarHBondContact N-O 3.42Å; S286-T336 PolarHBondContact O-N 3.39Å; T336-L343 HydrophobicContact CG2-CD2 4.37Å; T336-I355 HydrophobicContact CG2-CD1 4.37Å; T336-I355 HydrophobicContact CG2-CG2 3.74Å
337	L	97.3	Very high	89.3	Confident	0 Å²	0	47 Å²	47	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	129.1	171.6	-54.8	177.3	0	0	0	110.1	I275 V283 F284 C285 L302 V335 F339 I355 L356 I358	I275-L337 HydrophobicContact CD1-CD1 3.4Å; I275-L337 HydrophobicContact CD1-CD2 4.38Å; V283-L337 HydrophobicContact CG1-CB 4.11Å; V283-L337 HydrophobicContact CG1-CD2 4.43Å; F284-L337 CarbonylContact O-C 3.43Å; F284-L337 VanDerWaalsContact O-CA 3.26Å; F284-L337 WeakPolarHBondContact O-CA 3.32Å; C285-L337 HydrophobicContact CB-CD2 3.62Å; C285-L337 VanDerWaalsContact SG-CD2 3.59Å; L302-L337 HydrophobicContact CD1-CD2 4.07Å; V335-L337 HydrophobicContact CG1-CD2 4.37Å; L337-F339 HydrophobicContact CB-CE2 3.86Å; L337-F339 HydrophobicContact CB-CZ 4.39Å; L337-I355 CarbonylContact O-C 3.5Å; L337-I355 WeakPolarHBondContact O-CA 3.44Å; L337-L356 HydrophobicContact CB-CB 4.23Å; L337-L356 HydrophobicContact CD1-CD2 4.14Å; L337-L356 PolarHBondContact N-O 2.85Å; L337-L356 PolarHBondContact O-N 3.25Å; L337-I358 HydrophobicContact CD1-CD1 3.67Å; L337-I358 HydrophobicContact CG-CD1 4.41Å
338	C	97.4	Very high	89.2	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	124.6	175.7	-177.3	0	0	0	0	110.2	V283 F284 E341 L343 I355	V283-C338 CarbonylContact C-O 3.6Å; V283-C338 VanDerWaalsContact CA-O 3.3Å; V283-C338 WeakPolarHBondContact CA-O 3.48Å; F284-C338 HydrophobicContact CB-CB 4.42Å; F284-C338 PolarHBondContact N-O 3.31Å; F284-C338 PolarHBondContact O-N 3.17Å; C338-E341 PolarHBondContact SG-O 2.87Å; C338-L343 HydrophobicContact CB-CB 3.95Å; C338-L343 HydrophobicContact CB-CD1 4.25Å; C338-L343 HydrophobicContact CB-CD2 4.09Å; C338-L343 HydrophobicContact CB-CG 4.33Å; C338-I355 HydrophobicContact CB-CD1 3.63Å
339	F	98	Very high	89.2	Confident	1 Å²	1	39.5 Å²	39.5	0%	0.004	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	133.2	-176.6	-66.3	-101.4	0	0	0	110.9	F238 L256 L260 V264 V283 L337 E341 I354 L356	F238-F339 HydrophobicContact CE1-CE2 4.33Å; F238-F339 HydrophobicContact CE1-CZ 4.42Å; F238-F339 HydrophobicContact CZ-CD1 4.46Å; F238-F339 HydrophobicContact CZ-CE1 4Å; F238-F339 HydrophobicContact CZ-CE2 4.26Å; F238-F339 AromaticContact CZ-CZ 3.9Å; F238-F339 HydrophobicContact CZ-CZ 3.9Å; L256-F339 HydrophobicContact CD2-CB 4.44Å; L256-F339 VanDerWaalsContact CD2-O 3.31Å; L256-F339 WeakPolarHBondContact CD2-O 3.47Å; L260-F339 HydrophobicContact CD1-CB 4.21Å; L260-F339 HydrophobicContact CD1-CD1 3.84Å; L260-F339 HydrophobicContact CD1-CG 4.13Å; L260-F339 HydrophobicContact CD2-CB 4.41Å; L260-F339 HydrophobicContact CD2-CD1 3.62Å; L260-F339 HydrophobicContact CD2-CE1 4.38Å; L260-F339 HydrophobicContact CD2-CG 4.42Å; L260-F339 HydrophobicContact CG-CD1 4.41Å; V264-F339 HydrophobicContact CG1-CE1 4.02Å; V264-F339 HydrophobicContact CG1-CZ 4.31Å; V283-F339 HydrophobicContact CG1-CD1 4.3Å; V283-F339 HydrophobicContact CG1-CE1 4.1Å; V283-F339 HydrophobicContact CG1-CE2 4.45Å; V283-F339 HydrophobicContact CG1-CZ 4.18Å; V283-F339 HydrophobicContact CG2-CD1 3.56Å; V283-F339 HydrophobicContact CG2-CE1 3.64Å; V283-F339 HydrophobicContact CG2-CG 4.39Å; L337-F339 HydrophobicContact CB-CE2 3.86Å; L337-F339 HydrophobicContact CB-CZ 4.39Å; F339-E341 PolarHBondContact O-N 2.95Å; F339-I354 HydrophobicContact CB-CB 4.13Å; F339-I354 HydrophobicContact CB-CG2 4.12Å; F339-I354 HydrophobicContact CD2-CG2 3.87Å; F339-I354 HydrophobicContact CG-CG2 4.22Å; F339-I354 PolarHBondContact N-O 3.3Å; F339-I354 VanDerWaalsContact N-O 3.1Å; F339-L356 HydrophobicContact CE2-CB 3.67Å; F339-L356 HydrophobicContact CE2-CD2 4.13Å; F339-L356 HydrophobicContact CZ-CB 4.5Å; F339-L356 HydrophobicContact CZ-CD2 4.16Å
340	G	94.1	Very high	89.1	Confident	21 Å²	21	43.5 Å²	43.5	22%	0.216	25%	0.247	C	C	.	.	S	Bend	trans	79.3	-21.4	170.6	0	0	0	0	0	115	S281 R282	S281-G340 WeakPolarHBondContact OG-CA 3.47Å; S281-G340 PolarHBondContact OG-N 2.62Å; R282-G340 PolarHBondContact NE-O 3.02Å; R282-G340 PolarHBondContact NH2-O 3.06Å; R282-G340 PolarHBondContact O-N 3.11Å
341	E	92.8	Very high	89.1	Confident	51 Å²	51	45.3 Å²	45.3	24%	0.238	26%	0.257	C	S	.	.	S	Bend	trans	-120.1	150.4	-176.8	-66.3	175.6	94.6	0	0	111.2	F284 C338 F339 K352 L353	F284-E341 WeakPolarHBondContact CD2-O 3.32Å; F284-E341 VanDerWaalsContact CE2-O 3.28Å; F284-E341 WeakPolarHBondContact CE2-O 3.44Å; C338-E341 PolarHBondContact SG-O 2.87Å; F339-E341 PolarHBondContact O-N 2.95Å; E341-K352 HydrophobicContact CB-CD 3.87Å; E341-K352 WeakPolarHBondContact OE2-CA 3.39Å; E341-L353 WeakPolarHBondContact OE2-CB 3.46Å; E341-L353 WeakPolarHBondContact OE2-CG 3.17Å; E341-L353 PolarHBondContact OE2-N 3.31Å
342	E	88.3	Confident	89.3	Confident	104 Å²	104	46 Å²	46	49%	0.486	26%	0.259	S	S	.	.			trans	-71.7	136.7	172.5	-166.7	168.1	-176.6	0	0	109.8	F284 K352	F284-E342 HydrophobicContact CE1-CG 3.98Å; F284-E342 HydrophobicContact CE2-CB 4.25Å; F284-E342 HydrophobicContact CZ-CB 4.08Å; F284-E342 HydrophobicContact CZ-CG 3.92Å; E342-K352 VanDerWaalsContact O-CE 3.31Å; E342-K352 WeakPolarHBondContact O-CE 3.46Å; E342-K352 PolarHBondContact O-NZ 2.86Å
343	L	84.4	Confident	89.5	Confident	4 Å²	4	44 Å²	44	2%	0.021	25%	0.247	C	C	.	.			trans	-107.4	108.1	175.7	-170.2	67.6	0	0	0	107.1	F284 P299 T336 C338 D345 A349 K352	F284-L343 HydrophobicContact CB-CB 3.92Å; P299-L343 HydrophobicContact CB-CB 3.91Å; P299-L343 HydrophobicContact CB-CD2 3.95Å; P299-L343 HydrophobicContact CB-CG 4.01Å; P299-L343 WeakPolarHBondContact CB-O 3.21Å; P299-L343 HydrophobicContact CG-CB 4.16Å; P299-L343 HydrophobicContact CG-CD2 3.96Å; P299-L343 HydrophobicContact CG-CG 3.81Å; P299-L343 VanDerWaalsContact CG-O 3.23Å; P299-L343 WeakPolarHBondContact CG-O 3.39Å; T336-L343 HydrophobicContact CG2-CD2 4.37Å; C338-L343 HydrophobicContact CB-CB 3.95Å; C338-L343 HydrophobicContact CB-CD1 4.25Å; C338-L343 HydrophobicContact CB-CD2 4.09Å; C338-L343 HydrophobicContact CB-CG 4.33Å; L343-D345 WeakPolarHBondContact CD1-O 3.44Å; L343-A349 HydrophobicContact CD1-CB 4.39Å; L343-K352 HydrophobicContact CD1-CG 4.43Å
344	N	77.6	Confident	89.7	Confident	113 Å²	113	43.3 Å²	43.3	60%	0.604	24%	0.243	S	C	*	.	S	Bend	trans	-83.9	-39.8	179.1	-62.6	-12.9	0	0	0	110.7	P299	P299-N344 WeakPolarHBondContact CD-O 3.43Å
345	D	78	Confident	89.9	Confident	83 Å²	83	43.4 Å²	43.4	44%	0.444	24%	0.243	S	C	.	.			trans	-149.8	152.3	177.9	178.8	27	0	0	0	109.5	L343 S347 S348	L343-D345 WeakPolarHBondContact CD1-O 3.44Å; D345-S347 PolarHBondContact O-N 2.85Å; D345-S347 WeakPolarHBondContact OD2-CB 3.16Å; D345-S347 PolarHBondContact OD2-OG 2.82Å; D345-S348 WeakPolarHBondContact O-CB 3.48Å; D345-S348 PolarHBondContact O-N 2.94Å; D345-S348 PolarHBondContact O-OG 2.86Å
346	V	75.9	Confident	90	Very high	65 Å²	65	43.4 Å²	43.4	39%	0.394	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-59.2	-31.6	177.1	-178.1	0	0	0	0	111.1	S286 S348 A349	S286-V346 WeakPolarHBondContact OG-CG2 3.46Å; V346-S348 PolarHBondContact O-N 2.85Å; V346-S348 VanDerWaalsContact O-N 3.16Å; V346-A349 WeakPolarHBondContact O-CB 3.48Å; V346-A349 PolarHBondContact O-N 3.4Å
347	S	80.3	Confident	90.1	Very high	87 Å²	87	45 Å²	45	61%	0.608	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-58.1	-29.8	174.5	68.8	0	0	0	0	113	D345 A349	D345-S347 PolarHBondContact O-N 2.85Å; D345-S347 WeakPolarHBondContact OD2-CB 3.16Å; D345-S347 PolarHBondContact OD2-OG 2.82Å; S347-A349 VanDerWaalsContact C-N 3.29Å; S347-A349 PolarHBondContact O-N 3.11Å
348	S	84.1	Confident	90.1	Very high	28 Å²	28	45 Å²	45	20%	0.196	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-78.3	-8.5	178.6	76.9	0	0	0	0	113.8	D345 V346 K350 S351	D345-S348 WeakPolarHBondContact O-CB 3.48Å; D345-S348 PolarHBondContact O-N 2.94Å; D345-S348 PolarHBondContact O-OG 2.86Å; V346-S348 PolarHBondContact O-N 2.85Å; V346-S348 VanDerWaalsContact O-N 3.16Å; S348-K350 PolarHBondContact O-N 3.36Å; S348-K350 VanDerWaalsContact O-N 3.14Å; S348-S351 PolarHBondContact O-N 2.86Å; S348-S351 VanDerWaalsContact O-N 3.12Å; S348-S351 PolarHBondContact O-OG 3.35Å
349	A	86.1	Confident	90.1	Very high	15 Å²	15	45.5 Å²	45.5	12%	0.124	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-57.8	-31.5	-177.4	0	0	0	0	0	112.9	L343 V346 S347 S351 K352 I355	L343-A349 HydrophobicContact CD1-CB 4.39Å; V346-A349 WeakPolarHBondContact O-CB 3.48Å; V346-A349 PolarHBondContact O-N 3.4Å; S347-A349 VanDerWaalsContact C-N 3.29Å; S347-A349 PolarHBondContact O-N 3.11Å; A349-S351 PolarHBondContact O-N 3.23Å; A349-K352 PolarHBondContact O-N 2.9Å; A349-K352 VanDerWaalsContact O-N 3.15Å; A349-I355 HydrophobicContact CB-CD1 3.97Å; A349-I355 HydrophobicContact CB-CG1 4.08Å; A349-I355 WeakPolarHBondContact O-CG1 3.4Å
350	K	88.1	Confident	89.9	Confident	168 Å²	168	45.6 Å²	45.6	73%	0.73	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-64	-22.7	-179.7	-64.4	-177	-178.6	179.1	0	114	G199 G200 S348	G199-K350 CarbonylContact C-O 3.07Å; G200-K350 WeakPolarHBondContact CA-O 3.32Å; G200-K350 PolarHBondContact N-O 3.24Å; G200-K350 VanDerWaalsContact N-O 3.13Å; S348-K350 PolarHBondContact O-N 3.36Å; S348-K350 VanDerWaalsContact O-N 3.14Å
351	S	88.2	Confident	89.9	Confident	88 Å²	88	45 Å²	45	62%	0.615	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-96.1	-3.5	178.6	62.3	0	0	0	0	113.6	S348 A349	S348-S351 PolarHBondContact O-N 2.86Å; S348-S351 VanDerWaalsContact O-N 3.12Å; S348-S351 PolarHBondContact O-OG 3.35Å; A349-S351 PolarHBondContact O-N 3.23Å
352	K	94.6	Very high	89.8	Confident	26 Å²	26	43.1 Å²	43.1	11%	0.113	24%	0.237	C	C	.	.			trans	-82.1	144.4	-177.2	-53.5	-62.8	171.3	178.7	0	111.5	G199 E341 E342 L343 A349 I354 I355	G199-K352 WeakPolarHBondContact CA-O 3.48Å; G199-K352 PolarHBondContact N-O 3.48Å; E341-K352 HydrophobicContact CB-CD 3.87Å; E341-K352 WeakPolarHBondContact OE2-CA 3.39Å; E342-K352 VanDerWaalsContact O-CE 3.31Å; E342-K352 WeakPolarHBondContact O-CE 3.46Å; E342-K352 PolarHBondContact O-NZ 2.86Å; L343-K352 HydrophobicContact CD1-CG 4.43Å; A349-K352 PolarHBondContact O-N 2.9Å; A349-K352 VanDerWaalsContact O-N 3.15Å; K352-I354 PolarHBondContact O-N 2.98Å; K352-I355 HydrophobicContact CB-CD1 3.75Å; K352-I355 HydrophobicContact CB-CG1 3.93Å; K352-I355 HydrophobicContact CG-CD1 3.98Å
353	L	96	Very high	90	Very high	37 Å²	37	38.2 Å²	38.2	19%	0.194	21%	0.214	C	C	.	.	S	Bend	trans	-61.1	-44.5	-179.2	-67.1	175.6	0	0	0	111.9	Y198 G199 Q249 F252 L256 E341	Y198-L353 WeakPolarHBondContact CA-O 3.35Å; Y198-L353 WeakPolarHBondContact CD1-O 3.44Å; G199-L353 PolarHBondContact N-O 2.88Å; Q249-L353 HydrophobicContact CG-CD2 4.12Å; F252-L353 HydrophobicContact CB-CD1 3.8Å; F252-L353 HydrophobicContact CB-CD2 4.15Å; L256-L353 HydrophobicContact CD2-CB 4.31Å; E341-L353 WeakPolarHBondContact OE2-CB 3.46Å; E341-L353 WeakPolarHBondContact OE2-CG 3.17Å; E341-L353 PolarHBondContact OE2-N 3.31Å
354	I	97.9	Very high	90.4	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.227	C	C	.	.			trans	-138.4	114.9	-178.5	-56.2	-177.6	0	0	0	110	Y198 F238 T253 L256 L257 L260 F339 K352	Y198-I354 HydrophobicContact CD1-CB 4.29Å; Y198-I354 HydrophobicContact CD1-CG1 3.82Å; Y198-I354 HydrophobicContact CD1-CG2 4.39Å; Y198-I354 HydrophobicContact CE1-CB 4.2Å; Y198-I354 HydrophobicContact CE1-CD1 4.11Å; Y198-I354 HydrophobicContact CE1-CG1 3.65Å; Y198-I354 HydrophobicContact CE1-CG2 3.94Å; F238-I354 HydrophobicContact CD1-CG2 4.17Å; F238-I354 HydrophobicContact CE1-CG2 3.83Å; T253-I354 HydrophobicContact CG2-CD1 3.95Å; T253-I354 HydrophobicContact CG2-CG1 3.83Å; L256-I354 HydrophobicContact CB-CD1 4.32Å; L256-I354 HydrophobicContact CD2-CB 4.25Å; L256-I354 HydrophobicContact CD2-CD1 3.62Å; L256-I354 HydrophobicContact CD2-CG1 3.84Å; L256-I354 HydrophobicContact CG-CD1 3.85Å; L257-I354 HydrophobicContact CD2-CD1 3.87Å; L257-I354 HydrophobicContact CG-CD1 4.08Å; L260-I354 HydrophobicContact CD1-CD1 4.01Å; F339-I354 HydrophobicContact CB-CB 4.13Å; F339-I354 HydrophobicContact CB-CG2 4.12Å; F339-I354 HydrophobicContact CD2-CG2 3.87Å; F339-I354 HydrophobicContact CG-CG2 4.22Å; F339-I354 PolarHBondContact N-O 3.3Å; F339-I354 VanDerWaalsContact N-O 3.1Å; K352-I354 PolarHBondContact O-N 2.98Å
355	I	97.8	Very high	91.1	Very high	9 Å²	9	39 Å²	39	5%	0.046	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	139.7	168.2	-62.4	-64.1	0	0	0	109.1	Y197 T336 L337 C338 A349 K352	Y197-I355 HydrophobicContact CD2-CG2 4.25Å; Y197-I355 PolarHBondContact N-O 2.63Å; Y197-I355 PolarHBondContact O-N 2.85Å; T336-I355 HydrophobicContact CG2-CD1 4.37Å; T336-I355 HydrophobicContact CG2-CG2 3.74Å; L337-I355 CarbonylContact O-C 3.5Å; L337-I355 WeakPolarHBondContact O-CA 3.44Å; C338-I355 HydrophobicContact CB-CD1 3.63Å; A349-I355 HydrophobicContact CB-CD1 3.97Å; A349-I355 HydrophobicContact CB-CG1 4.08Å; A349-I355 WeakPolarHBondContact O-CG1 3.4Å; K352-I355 HydrophobicContact CB-CD1 3.75Å; K352-I355 HydrophobicContact CB-CG1 3.93Å; K352-I355 HydrophobicContact CG-CD1 3.98Å
356	L	98	Very high	91.6	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	120.1	169.4	-176.3	66.6	0	0	0	108.3	I194 S195 F196 I216 L337 F339 I358	I194-L356 HydrophobicContact CG2-CD1 3.33Å; I194-L356 HydrophobicContact CG2-CG 4.22Å; S195-L356 WeakPolarHBondContact O-CA 3.42Å; F196-L356 HydrophobicContact CD1-CD1 3.56Å; F196-L356 HydrophobicContact CD2-CD1 4.18Å; F196-L356 HydrophobicContact CE1-CD1 3.43Å; F196-L356 VanDerWaalsContact CE1-CD1 3.43Å; F196-L356 HydrophobicContact CE2-CD1 4.08Å; F196-L356 HydrophobicContact CG-CD1 3.94Å; F196-L356 HydrophobicContact CZ-CD1 3.7Å; I216-L356 HydrophobicContact CD1-CD2 3.57Å; I216-L356 HydrophobicContact CG2-CD2 4.33Å; L337-L356 HydrophobicContact CB-CB 4.23Å; L337-L356 HydrophobicContact CD1-CD2 4.14Å; L337-L356 PolarHBondContact N-O 2.85Å; L337-L356 PolarHBondContact O-N 3.25Å; F339-L356 HydrophobicContact CE2-CB 3.67Å; F339-L356 HydrophobicContact CE2-CD2 4.13Å; F339-L356 HydrophobicContact CZ-CB 4.5Å; F339-L356 HydrophobicContact CZ-CD2 4.16Å; L356-I358 HydrophobicContact CD2-CD1 4.34Å; L356-I358 HydrophobicContact CD2-CG1 4.4Å; L356-I358 HydrophobicContact CG-CG1 4.24Å
357	Q	97.3	Very high	92.3	Very high	46 Å²	46	33.5 Å²	33.5	22%	0.215	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	130.9	172.6	-170.3	175.2	9.4	0	0	108.9	I194 S195 Y197 S334 V335	I194-Q357 WeakPolarHBondContact CA-O 3.46Å; S195-Q357 PolarHBondContact N-O 3.38Å; S195-Q357 PolarHBondContact O-N 2.73Å; Y197-Q357 HydrophobicContact CE2-CB 4.05Å; Y197-Q357 PolarHBondContact OH-OE1 3.36Å; S334-Q357 PolarHBondContact OG-NE2 2.91Å; V335-Q357 CarbonylContact O-C 3.54Å; V335-Q357 WeakPolarHBondContact O-CA 3.32Å
358	I	97.7	Very high	92.9	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	114.4	179	-53.7	174.7	0	0	0	107.1	L192 M193 V266 I273 I310 S334 V335 L337 L356	L192-I358 HydrophobicContact CB-CG2 4.43Å; L192-I358 HydrophobicContact CD1-CG2 4.25Å; L192-I358 HydrophobicContact CD2-CG2 4Å; L192-I358 HydrophobicContact CG-CG2 4.48Å; M193-I358 WeakPolarHBondContact O-CA 3.26Å; V266-I358 HydrophobicContact CG1-CD1 4.16Å; V266-I358 HydrophobicContact CG2-CD1 4.02Å; I273-I358 HydrophobicContact CD1-CG2 3.98Å; I310-I358 HydrophobicContact CD1-CD1 4.5Å; S334-I358 CarbonylContact C-O 3.5Å; S334-I358 WeakPolarHBondContact CA-O 3.46Å; V335-I358 PolarHBondContact N-O 3.12Å; V335-I358 PolarHBondContact O-N 2.92Å; L337-I358 HydrophobicContact CD1-CD1 3.67Å; L337-I358 HydrophobicContact CG-CD1 4.41Å; L356-I358 HydrophobicContact CD2-CD1 4.34Å; L356-I358 HydrophobicContact CD2-CG1 4.4Å; L356-I358 HydrophobicContact CG-CG1 4.24Å
359	T	96.4	Very high	93	Very high	10 Å²	10	34.5 Å²	34.5	6%	0.061	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	131.1	-178.6	-56	0	0	0	0	110.1	L192 M193 P333 S334 V361 Q364	L192-T359 WeakPolarHBondContact CA-O 3.2Å; M193-T359 PolarHBondContact N-O 3.31Å; M193-T359 PolarHBondContact O-N 2.83Å; P333-T359 HydrophobicContact CB-CG2 4.21Å; P333-T359 HydrophobicContact CG-CG2 4.01Å; S334-T359 WeakPolarHBondContact CB-OG1 3.43Å; S334-T359 PolarHBondContact OG-OG1 3.17Å; T359-V361 PolarHBondContact O-N 3.43Å; T359-Q364 HydrophobicContact CG2-CB 4.05Å
360	M	93.9	Very high	93	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.01	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	106.2	173.7	-163.1	156.2	-171.8	0	0	109.1	N269 I273 F311 P333 N362 C363 Q364	N269-M360 VanDerWaalsContact O-CE 3.27Å; N269-M360 WeakPolarHBondContact O-CE 3.33Å; I273-M360 HydrophobicContact CD1-CB 4.17Å; I273-M360 HydrophobicContact CG1-SD 4.13Å; F311-M360 HydrophobicContact CD1-SD 3.6Å; F311-M360 HydrophobicContact CE1-CB 4.19Å; F311-M360 HydrophobicContact CE1-CG 4.45Å; F311-M360 HydrophobicContact CE1-SD 3.55Å; F311-M360 VanDerWaalsContact CE1-SD 3.55Å; F311-M360 HydrophobicContact CZ-CB 4.4Å; P333-M360 PolarHBondContact O-N 2.89Å; M360-N362 VanDerWaalsContact C-N 3.35Å; M360-N362 PolarHBondContact O-N 3.22Å; M360-C363 HydrophobicContact CB-CB 4.06Å; M360-C363 HydrophobicContact CG-CB 4.4Å; M360-C363 WeakPolarHBondContact O-CB 3.13Å; M360-C363 PolarHBondContact O-N 3.18Å; M360-Q364 PolarHBondContact O-N 3.48Å
361	V	94.3	Very high	93	Very high	9 Å²	9	29.9 Å²	29.9	6%	0.055	16%	0.16	C	C	.	.	H	α-helix	trans	-61.5	-42.5	-166.1	173.8	0	0	0	0	111.8	Q191 M193 L207 T359 C363 Q364 H365	Q191-V361 HydrophobicContact CB-CB 3.94Å; Q191-V361 HydrophobicContact CB-CG1 4.47Å; Q191-V361 HydrophobicContact CB-CG2 4.26Å; Q191-V361 PolarHBondContact O-N 2.9Å; M193-V361 HydrophobicContact CB-CG2 3.97Å; L207-V361 HydrophobicContact CD1-CG2 3.8Å; T359-V361 PolarHBondContact O-N 3.43Å; V361-C363 VanDerWaalsContact C-N 3.34Å; V361-C363 PolarHBondContact O-N 2.77Å; V361-Q364 WeakPolarHBondContact O-CB 3.39Å; V361-Q364 PolarHBondContact O-N 3.29Å; V361-H365 WeakPolarHBondContact CG1-NE2 3.15Å; V361-H365 PolarHBondContact O-CD2 3.15Å; V361-H365 VanDerWaalsContact O-CD2 3.26Å; V361-H365 PolarHBondContact O-N 3.14Å
362	N	91.2	Very high	92.9	Very high	11 Å²	11	31.8 Å²	31.8	6%	0.059	16%	0.161	C	C	.	.	H	α-helix	trans	-58	-46.5	175.4	-79.1	11.3	0	0	0	112.1	G188 M360 Q364 H365 M366	G188-N362 WeakPolarHBondContact CA-ND2 3.07Å; G188-N362 VanDerWaalsContact O-CG 3.24Å; G188-N362 PolarHBondContact O-ND2 3.21Å; G188-N362 PolarHBondContact O-OD1 3.33Å; M360-N362 VanDerWaalsContact C-N 3.35Å; M360-N362 PolarHBondContact O-N 3.22Å; N362-Q364 VanDerWaalsContact C-N 3.3Å; N362-Q364 PolarHBondContact O-N 3.43Å; N362-H365 PolarHBondContact O-N 3Å; N362-M366 WeakPolarHBondContact O-CE 3.33Å; N362-M366 WeakPolarHBondContact O-CG 3.48Å; N362-M366 PolarHBondContact O-N 3.12Å
363	C	92.6	Very high	92.2	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.007	19%	0.191	C	C	.	.	H	α-helix	trans	-61.6	-40.3	178.9	-65.2	0	0	0	0	111.8	F311 F316 P333 M360 V361 M366 L367	F311-C363 HydrophobicContact CZ-CB 4.22Å; F316-C363 HydrophobicContact CD1-CB 3.79Å; F316-C363 HydrophobicContact CD2-CB 4.44Å; F316-C363 HydrophobicContact CE1-CB 3.46Å; F316-C363 VanDerWaalsContact CE1-CB 3.46Å; F316-C363 HydrophobicContact CE2-CB 4.15Å; F316-C363 HydrophobicContact CG-CB 4.27Å; F316-C363 HydrophobicContact CZ-CB 3.66Å; F316-C363 WeakPolarHBondContact CZ-O 3.14Å; P333-C363 HydrophobicContact CB-CB 3.79Å; M360-C363 HydrophobicContact CB-CB 4.06Å; M360-C363 HydrophobicContact CG-CB 4.4Å; M360-C363 WeakPolarHBondContact O-CB 3.13Å; M360-C363 PolarHBondContact O-N 3.18Å; V361-C363 VanDerWaalsContact C-N 3.34Å; V361-C363 PolarHBondContact O-N 2.77Å; C363-M366 HydrophobicContact CB-CE 4.48Å; C363-L367 PolarHBondContact O-N 2.97Å; C363-L367 VanDerWaalsContact O-N 3.16Å
364	Q	93.5	Very high	91.2	Very high	64 Å²	64	43.7 Å²	43.7	30%	0.299	20%	0.203	S	C	.	.	H	α-helix	trans	-60.7	-50.5	174.2	178.8	176	3.9	0	0	111.7	P333 T359 M360 V361 N362 M366 L367 E368	P333-Q364 HydrophobicContact CB-CB 4.18Å; P333-Q364 HydrophobicContact CG-CB 3.93Å; P333-Q364 HydrophobicContact CG-CG 4.44Å; T359-Q364 HydrophobicContact CG2-CB 4.05Å; M360-Q364 PolarHBondContact O-N 3.48Å; V361-Q364 WeakPolarHBondContact O-CB 3.39Å; V361-Q364 PolarHBondContact O-N 3.29Å; N362-Q364 VanDerWaalsContact C-N 3.3Å; N362-Q364 PolarHBondContact O-N 3.43Å; Q364-M366 PolarHBondContact O-N 3.16Å; Q364-L367 WeakPolarHBondContact O-CB 3.41Å; Q364-L367 PolarHBondContact O-N 2.99Å; Q364-E368 HydrophobicContact CG-CG 4.47Å; Q364-E368 VanDerWaalsContact CG-OE1 3.28Å; Q364-E368 WeakPolarHBondContact CG-OE1 3.44Å; Q364-E368 PolarHBondContact NE2-OE1 3.06Å; Q364-E368 WeakPolarHBondContact O-CG 3.4Å; Q364-E368 PolarHBondContact O-N 2.97Å
365	H	90.9	Very high	89.7	Confident	70 Å²	70	47.8 Å²	47.8	32%	0.324	23%	0.232	S	C	.	.	H	α-helix	trans	-60	-43	179.6	-75.3	-54.5	0	0	0	112.8	V361 N362 L367 E368 S369 M395	V361-H365 WeakPolarHBondContact CG1-NE2 3.15Å; V361-H365 PolarHBondContact O-CD2 3.15Å; V361-H365 VanDerWaalsContact O-CD2 3.26Å; V361-H365 PolarHBondContact O-N 3.14Å; N362-H365 PolarHBondContact O-N 3Å; H365-L367 VanDerWaalsContact C-N 3.3Å; H365-L367 PolarHBondContact O-N 3.36Å; H365-E368 IonicContact ND1-OE2 2.82Å; H365-E368 WeakPolarHBondContact O-CB 3.38Å; H365-E368 PolarHBondContact O-N 3.47Å; H365-E368 VanDerWaalsContact O-N 3.17Å; H365-S369 PolarHBondContact O-N 3.37Å; H365-S369 PolarHBondContact O-OG 3.27Å; H365-M395 HydrophobicContact CB-CE 3.52Å; H365-M395 HydrophobicContact CB-SD 3.74Å
366	M	89.3	Confident	88	Confident	13 Å²	13	54 Å²	54	6%	0.064	26%	0.26	C	S	.	.	H	α-helix	trans	-62.3	-38.5	177.7	-71	179.1	-62.9	0	0	112.6	F317 L320 N362 C363 Q364 L370 M395 Y399	F317-M366 HydrophobicContact CD1-CE 4.36Å; F317-M366 HydrophobicContact CE1-CE 3.13Å; F317-M366 HydrophobicContact CE1-SD 3.46Å; F317-M366 WeakPolarHBondContact CE1-SD 3.5Å; F317-M366 HydrophobicContact CZ-CE 3.35Å; F317-M366 HydrophobicContact CZ-SD 3.83Å; L320-M366 HydrophobicContact CD2-CB 4.19Å; N362-M366 WeakPolarHBondContact O-CE 3.33Å; N362-M366 WeakPolarHBondContact O-CG 3.48Å; N362-M366 PolarHBondContact O-N 3.12Å; C363-M366 HydrophobicContact CB-CE 4.48Å; Q364-M366 PolarHBondContact O-N 3.16Å; M366-L370 WeakPolarHBondContact O-CG 3.08Å; M366-L370 PolarHBondContact O-N 2.63Å; M366-L370 VanDerWaalsContact O-N 3.11Å; M366-M395 HydrophobicContact CG-CB 4.43Å; M366-Y399 HydrophobicContact SD-CD2 4.37Å
367	L	91.1	Very high	85.7	Confident	19 Å²	19	58.8 Å²	58.8	10%	0.099	29%	0.292	C	S	.	.	H	α-helix	trans	-65.1	-43	174.3	179.4	63.3	0	0	0	111.6	F316 L320 Y323 A330 P331 C363 Q364 H365 L370 N371	F316-L367 HydrophobicContact CZ-CB 4.41Å; L320-L367 HydrophobicContact CD1-CB 4.17Å; L320-L367 HydrophobicContact CD1-CD1 3.59Å; L320-L367 HydrophobicContact CD1-CG 4.48Å; Y323-L367 HydrophobicContact CD1-CD1 4.05Å; Y323-L367 HydrophobicContact CE1-CD1 3.96Å; A330-L367 HydrophobicContact CB-CD1 4.12Å; A330-L367 HydrophobicContact CB-CD2 4.47Å; P331-L367 WeakPolarHBondContact O-CD2 3.31Å; C363-L367 PolarHBondContact O-N 2.97Å; C363-L367 VanDerWaalsContact O-N 3.16Å; Q364-L367 WeakPolarHBondContact O-CB 3.41Å; Q364-L367 PolarHBondContact O-N 2.99Å; H365-L367 VanDerWaalsContact C-N 3.3Å; H365-L367 PolarHBondContact O-N 3.36Å; L367-L370 PolarHBondContact O-N 2.76Å; L367-N371 WeakPolarHBondContact O-CB 3.2Å; L367-N371 VanDerWaalsContact O-CG 3.22Å; L367-N371 PolarHBondContact O-N 2.9Å; L367-N371 PolarHBondContact O-ND2 3.16Å
368	E	91	Very high	83.4	Confident	88 Å²	88	68.2 Å²	68.2	41%	0.411	33%	0.327	S	S	.	.	H	α-helix	trans	-61.2	-46.5	176.1	-71.5	168.8	-179.6	0	0	111.6	Q364 H365 L370 N371 M372	Q364-E368 HydrophobicContact CG-CG 4.47Å; Q364-E368 VanDerWaalsContact CG-OE1 3.28Å; Q364-E368 WeakPolarHBondContact CG-OE1 3.44Å; Q364-E368 PolarHBondContact NE2-OE1 3.06Å; Q364-E368 WeakPolarHBondContact O-CG 3.4Å; Q364-E368 PolarHBondContact O-N 2.97Å; H365-E368 IonicContact ND1-OE2 2.82Å; H365-E368 WeakPolarHBondContact O-CB 3.38Å; H365-E368 PolarHBondContact O-N 3.47Å; H365-E368 VanDerWaalsContact O-N 3.17Å; E368-L370 VanDerWaalsContact C-N 3.33Å; E368-L370 PolarHBondContact O-N 2.94Å; E368-N371 PolarHBondContact O-N 3.49Å; E368-M372 PolarHBondContact O-N 3.37Å
369	S	87.4	Confident	80.6	Confident	48 Å²	48	74 Å²	74	34%	0.336	36%	0.362	S	S	.	.	H	α-helix	trans	-60.5	-39.7	176.8	-55.2	0	0	0	0	112.6	H365 M372 R373	H365-S369 PolarHBondContact O-N 3.37Å; H365-S369 PolarHBondContact O-OG 3.27Å; S369-M372 PolarHBondContact O-N 2.94Å; S369-R373 PolarHBondContact O-N 3.5Å; S369-R373 VanDerWaalsContact O-N 3.16Å
370	L	86.9	Confident	78.1	Confident	30 Å²	30	79 Å²	79	16%	0.157	40%	0.398	C	S	.	.	H	α-helix	trans	-68.1	-40.9	175.8	-75.1	172.1	0	0	0	112.2	L320 M366 L367 E368 M372 R373 R374	L320-L370 HydrophobicContact CD1-CD1 3.69Å; L320-L370 HydrophobicContact CD2-CD1 3.6Å; L320-L370 HydrophobicContact CG-CD1 3.43Å; L320-L370 VanDerWaalsContact CG-CD1 3.43Å; M366-L370 WeakPolarHBondContact O-CG 3.08Å; M366-L370 PolarHBondContact O-N 2.63Å; M366-L370 VanDerWaalsContact O-N 3.11Å; L367-L370 PolarHBondContact O-N 2.76Å; E368-L370 VanDerWaalsContact C-N 3.33Å; E368-L370 PolarHBondContact O-N 2.94Å; L370-M372 VanDerWaalsContact C-N 3.28Å; L370-M372 PolarHBondContact O-N 3.42Å; L370-R373 PolarHBondContact O-N 3.37Å; L370-R374 PolarHBondContact O-N 2.9Å
371	N	88.1	Confident	75.4	Confident	56 Å²	56	84.4 Å²	84.4	30%	0.299	44%	0.436	S	S	.	.	H	α-helix	trans	-62	-38.2	175.7	-73.1	-23.5	0	0	0	111.7	Y323 L367 E368 R374 S375	Y323-N371 VanDerWaalsContact CE1-OD1 3.3Å; Y323-N371 WeakPolarHBondContact CE1-OD1 3.28Å; Y323-N371 PolarHBondContact OH-OD1 2.82Å; L367-N371 WeakPolarHBondContact O-CB 3.2Å; L367-N371 VanDerWaalsContact O-CG 3.22Å; L367-N371 PolarHBondContact O-N 2.9Å; L367-N371 PolarHBondContact O-ND2 3.16Å; E368-N371 PolarHBondContact O-N 3.49Å; N371-R374 PolarHBondContact O-N 2.71Å; N371-S375 WeakPolarHBondContact O-CB 3.5Å; N371-S375 PolarHBondContact O-N 3.27Å; N371-S375 PolarHBondContact O-OG 3.45Å; N371-S375 VanDerWaalsContact O-OG 3.11Å
372	M	84.6	Confident	73.3	Confident	129 Å²	129	89.6 Å²	89.6	64%	0.635	47%	0.47	S	S	*	.	H	α-helix	trans	-67.7	-38.6	178	-157.8	139.2	176.2	0	0	112.4	E368 S369 L370 R374 S375 Q376	E368-M372 PolarHBondContact O-N 3.37Å; S369-M372 PolarHBondContact O-N 2.94Å; L370-M372 VanDerWaalsContact C-N 3.28Å; L370-M372 PolarHBondContact O-N 3.42Å; M372-R374 VanDerWaalsContact C-N 3.34Å; M372-S375 WeakPolarHBondContact CA-OG 3.39Å; M372-S375 PolarHBondContact O-N 3.03Å; M372-S375 PolarHBondContact O-OG 2.86Å; M372-S375 VanDerWaalsContact O-OG 3.14Å; M372-Q376 PolarHBondContact O-N 3.17Å
373	R	80.2	Confident	71.1	Confident	194 Å²	194	96.6 Å²	96.6	73%	0.732	51%	0.507	S	S	*	.	H	α-helix	trans	-67.4	-31.8	172.4	-78.4	-147.9	-91.7	-149	-5.7	113.6	S369 L370	S369-R373 PolarHBondContact O-N 3.5Å; S369-R373 VanDerWaalsContact O-N 3.16Å; L370-R373 PolarHBondContact O-N 3.37Å
374	R	74.2	Confident	69.1	Low	118 Å²	118	102.9 Å²	102.9	45%	0.445	55%	0.545	S	S	.	.	H	α-helix	trans	-75.4	-30	176.8	-177.2	177.2	-74.9	-177.8	-8.7	112.6	Y323 Q324 L370 N371 M372	Y323-R374 PolarHBondContact O-NH2 3.33Å; Y323-R374 PolarHBondContact OH-NH1 3.45Å; Y323-R374 VanDerWaalsContact OH-NH1 3.12Å; Q324-R374 PolarHBondContact O-NH2 3.23Å; L370-R374 PolarHBondContact O-N 2.9Å; N371-R374 PolarHBondContact O-N 2.71Å; M372-R374 VanDerWaalsContact C-N 3.34Å
375	S	67.1	Low	66.6	Low	87 Å²	87	106.6 Å²	106.6	61%	0.608	56%	0.562	S	S	*	*	H	α-helix	trans	-88.7	-12.5	-176.5	63.3	0	0	0	0	114.5	N371 M372 P377	N371-S375 WeakPolarHBondContact O-CB 3.5Å; N371-S375 PolarHBondContact O-N 3.27Å; N371-S375 PolarHBondContact O-OG 3.45Å; N371-S375 VanDerWaalsContact O-OG 3.11Å; M372-S375 WeakPolarHBondContact CA-OG 3.39Å; M372-S375 PolarHBondContact O-N 3.03Å; M372-S375 PolarHBondContact O-OG 2.86Å; M372-S375 VanDerWaalsContact O-OG 3.14Å; S375-P377 WeakPolarHBondContact O-CD 3.5Å
376	Q	62.2	Low	64.4	Low	139 Å²	139	111.5 Å²	111.5	65%	0.65	59%	0.588	S	S	*	*			trans	-73.8	112.2	172.1	-86.6	179	-8	0	0	111.1	M372	M372-Q376 PolarHBondContact O-N 3.17Å
377	P	49.9	Very low	62.5	Low	101 Å²	101	116.1 Å²	116.1	66%	0.656	62%	0.621	S	S	*	*			trans	-69	144.7	161.6	27.7	-23.1	0	0	0	108.2	S375 T379	S375-P377 WeakPolarHBondContact O-CD 3.5Å; P377-T379 VanDerWaalsContact C-N 3.34Å; P377-T379 PolarHBondContact O-N 3.11Å
378	Y	48.4	Very low	60.6	Low	243 Å²	243	119.7 Å²	119.7	95%	0.953	64%	0.64	S	S	*	*	S	Bend	trans	-53	91.2	176.9	-76	-96.2	0	0	0	111.8
379	T	39	Very low	59	Low	122 Å²	122	120.3 Å²	120.3	75%	0.748	65%	0.646	S	S	*	*			trans	-134.2	98.8	160	55.8	0	0	0	0	107.8	P377 S381	P377-T379 VanDerWaalsContact C-N 3.34Å; P377-T379 PolarHBondContact O-N 3.11Å; T379-S381 PolarHBondContact O-N 3.39Å
380	S	44.3	Very low	57.6	Low	116 Å²	116	122.6 Å²	122.6	81%	0.811	66%	0.658	S	S	*	*			trans	-52.6	122.8	168	39.8	0	0	0	0	112.1
381	S	36.3	Very low	56.2	Low	114 Å²	114	123 Å²	123	80%	0.797	67%	0.666	S	S	*	*			trans	-156.8	117.6	148.1	-77.5	0	0	0	0	108.7	T379 N383	T379-S381 PolarHBondContact O-N 3.39Å; S381-N383 PolarHBondContact O-N 3.19Å
382	P	50.3	Low	54.9	Low	119 Å²	119	122.8 Å²	122.8	77%	0.773	67%	0.667	S	S	*	*			trans	-92.2	98.6	179.2	33.2	-24.2	0	0	0	107.6
383	N	45.8	Very low	54	Low	158 Å²	158	121.5 Å²	121.5	85%	0.845	66%	0.659	S	S	*	*			trans	-170.1	133.2	155.3	-99.1	-29.6	0	0	0	111.5	S381	S381-N383 PolarHBondContact O-N 3.19Å
384	V	49.9	Very low	53.4	Low	132 Å²	132	116.8 Å²	116.8	80%	0.8	65%	0.646	S	S	*	*			trans	84	96.4	169.5	-163.7	0	0	0	0	115.3
385	E	42.5	Very low	53	Low	142 Å²	142	112.9 Å²	112.9	66%	0.664	63%	0.633	S	S	*	*			trans	179.9	76.2	131.4	-99.8	172.6	179.4	0	0	112.4	S387	E385-S387 PolarHBondContact O-N 3.16Å
386	M	44.8	Very low	52.9	Low	174 Å²	174	111.1 Å²	111.1	86%	0.857	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-1.4	-177.7	-128.6	138.7	80.8	0	0	114.4
387	S	48.7	Very low	53.2	Low	109 Å²	109	111.5 Å²	111.5	76%	0.762	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-26.8	179.8	-169.7	0	0	0	0	113.3	E385	E385-S387 PolarHBondContact O-N 3.16Å
388	D	52	Low	54.1	Low	94 Å²	94	107 Å²	107	50%	0.503	59%	0.589	S	S	.	*	H	α-helix	trans	-85.1	-21.3	178.8	-149.7	22.6	0	0	0	111.4	V390 A391 T392	D388-V390 PolarHBondContact O-N 2.96Å; D388-A391 PolarHBondContact O-N 3.25Å; D388-T392 WeakPolarHBondContact O-CB 3.4Å; D388-T392 PolarHBondContact O-N 3.12Å; D388-T392 PolarHBondContact O-OG1 2.99Å
389	D	55.8	Low	55	Low	101 Å²	101	98.1 Å²	98.1	54%	0.54	55%	0.554	S	S	.	*	H	α-helix	trans	-60.7	-38.2	177	-96.9	-19.7	0	0	0	112.9	E393	D389-E393 WeakPolarHBondContact O-CA 3.37Å; D389-E393 WeakPolarHBondContact O-CB 3.33Å; D389-E393 PolarHBondContact O-N 3.07Å
390	V	58.4	Low	56.5	Low	96 Å²	96	98.5 Å²	98.5	58%	0.582	55%	0.547	S	S	*	.	H	α-helix	trans	-71.6	-42	-177.1	-178.3	0	0	0	0	111.7	D388 Q394	D388-V390 PolarHBondContact O-N 2.96Å; V390-Q394 WeakPolarHBondContact O-CB 3.49Å; V390-Q394 PolarHBondContact O-N 3.36Å
391	A	56.8	Low	57.7	Low	39 Å²	39	97.3 Å²	97.3	32%	0.322	53%	0.532	S	S	.	.	H	α-helix	trans	-68.4	-43.3	176.3	0	0	0	0	0	110.6	D388 E393 Q394 M395	D388-A391 PolarHBondContact O-N 3.25Å; A391-E393 PolarHBondContact O-N 3.33Å; A391-Q394 PolarHBondContact O-N 3.47Å; A391-M395 WeakPolarHBondContact O-CB 3.33Å; A391-M395 WeakPolarHBondContact O-CG 3.42Å; A391-M395 PolarHBondContact O-N 3.13Å
392	T	61.2	Low	59	Low	52 Å²	52	94 Å²	94	32%	0.319	51%	0.505	S	S	.	.	H	α-helix	trans	-63.6	-40	176.1	-58.4	0	0	0	0	111.9	D388 M395 A396	D388-T392 WeakPolarHBondContact O-CB 3.4Å; D388-T392 PolarHBondContact O-N 3.12Å; D388-T392 PolarHBondContact O-OG1 2.99Å; T392-M395 PolarHBondContact O-N 2.88Å; T392-A396 VanDerWaalsContact O-CB 3.31Å; T392-A396 WeakPolarHBondContact O-CB 3.36Å; T392-A396 PolarHBondContact O-N 2.7Å
393	E	65.8	Low	59.6	Low	102 Å²	102	91.6 Å²	91.6	48%	0.477	49%	0.49	S	S	.	.	H	α-helix	trans	-69.7	-41.7	176.8	-168	-176.1	151.8	0	0	111.2	D389 A391 M395 A396 R397	D389-E393 WeakPolarHBondContact O-CA 3.37Å; D389-E393 WeakPolarHBondContact O-CB 3.33Å; D389-E393 PolarHBondContact O-N 3.07Å; A391-E393 PolarHBondContact O-N 3.33Å; E393-M395 VanDerWaalsContact C-N 3.31Å; E393-M395 PolarHBondContact O-N 3.41Å; E393-A396 PolarHBondContact O-N 2.82Å; E393-R397 WeakPolarHBondContact O-CG 3.33Å; E393-R397 PolarHBondContact O-N 3.4Å; E393-R397 IonicContact OE1-CZ 3.66Å; E393-R397 IonicContact OE1-NE 2.67Å; E393-R397 IonicContact OE1-NH2 2.76Å; E393-R397 PolarHBondContact OE1-NH2 3.45Å
394	Q	67.2	Low	60.5	Low	95 Å²	95	87.8 Å²	87.8	44%	0.444	48%	0.476	S	S	.	.	H	α-helix	trans	-61.7	-40.8	173.9	-173	177.2	-0.1	0	0	111.5	N186 V390 A391 R397 I398	N186-Q394 PolarHBondContact OD1-NE2 2.82Å; V390-Q394 WeakPolarHBondContact O-CB 3.49Å; V390-Q394 PolarHBondContact O-N 3.36Å; A391-Q394 PolarHBondContact O-N 3.47Å; Q394-R397 PolarHBondContact O-N 3.2Å; Q394-I398 HydrophobicContact CG-CD1 4.34Å; Q394-I398 WeakPolarHBondContact O-CG1 3.36Å; Q394-I398 PolarHBondContact O-N 2.94Å
395	M	66.2	Low	60.4	Low	35 Å²	35	90.5 Å²	90.5	17%	0.172	47%	0.473	C	S	.	.	H	α-helix	trans	-67.1	-40.3	174.8	-71.5	175.7	-167	0	0	112.2	H365 M366 A391 T392 E393 R397 I398 Y399	H365-M395 HydrophobicContact CB-CE 3.52Å; H365-M395 HydrophobicContact CB-SD 3.74Å; M366-M395 HydrophobicContact CG-CB 4.43Å; A391-M395 WeakPolarHBondContact O-CB 3.33Å; A391-M395 WeakPolarHBondContact O-CG 3.42Å; A391-M395 PolarHBondContact O-N 3.13Å; T392-M395 PolarHBondContact O-N 2.88Å; E393-M395 VanDerWaalsContact C-N 3.31Å; E393-M395 PolarHBondContact O-N 3.41Å; M395-R397 VanDerWaalsContact C-N 3.3Å; M395-R397 PolarHBondContact O-N 2.97Å; M395-I398 WeakPolarHBondContact O-CB 3.47Å; M395-I398 PolarHBondContact O-N 3.27Å; M395-Y399 WeakPolarHBondContact O-CB 3.44Å; M395-Y399 PolarHBondContact O-N 2.53Å
396	A	64.6	Low	60.4	Low	50 Å²	50	88.5 Å²	88.5	41%	0.413	48%	0.475	S	S	.	.	H	α-helix	trans	-61.4	-40.5	175	0	0	0	0	0	111.2	T392 E393 Y399 Q400	T392-A396 VanDerWaalsContact O-CB 3.31Å; T392-A396 WeakPolarHBondContact O-CB 3.36Å; T392-A396 PolarHBondContact O-N 2.7Å; E393-A396 PolarHBondContact O-N 2.82Å; A396-Y399 PolarHBondContact O-N 2.75Å; A396-Q400 WeakPolarHBondContact O-CB 3.19Å; A396-Q400 PolarHBondContact O-N 3.42Å
397	R	69.4	Low	60.1	Low	148 Å²	148	86 Å²	86	56%	0.558	47%	0.469	S	S	*	.	H	α-helix	trans	-64.7	-44.2	173	-68.4	-168.3	-155.2	-168.4	7.9	112.3	E393 Q394 M395 Y399 Q400 D401	E393-R397 WeakPolarHBondContact O-CG 3.33Å; E393-R397 PolarHBondContact O-N 3.4Å; E393-R397 IonicContact OE1-CZ 3.66Å; E393-R397 IonicContact OE1-NE 2.67Å; E393-R397 IonicContact OE1-NH2 2.76Å; E393-R397 PolarHBondContact OE1-NH2 3.45Å; Q394-R397 PolarHBondContact O-N 3.2Å; M395-R397 VanDerWaalsContact C-N 3.3Å; M395-R397 PolarHBondContact O-N 2.97Å; R397-Y399 PolarHBondContact O-N 3.38Å; R397-Q400 PolarHBondContact O-N 3.38Å; R397-D401 WeakPolarHBondContact O-CB 3.46Å; R397-D401 VanDerWaalsContact O-CG 3.24Å; R397-D401 PolarHBondContact O-N 3.16Å
398	I	68	Low	59.4	Low	6 Å²	6	86 Å²	86	3%	0.031	47%	0.467	C	S	.	.	H	α-helix	trans	-57.5	-48.5	175.2	-78.4	166.7	0	0	0	111.3	F189 Q394 M395 L402	F189-I398 HydrophobicContact CE1-CG2 3.49Å; F189-I398 VanDerWaalsContact CE1-CG2 3.49Å; F189-I398 HydrophobicContact CE2-CD1 4.21Å; F189-I398 HydrophobicContact CE2-CG1 4.01Å; F189-I398 HydrophobicContact CE2-CG2 4.38Å; F189-I398 HydrophobicContact CZ-CB 4Å; F189-I398 HydrophobicContact CZ-CD1 4.1Å; F189-I398 HydrophobicContact CZ-CG1 3.7Å; F189-I398 HydrophobicContact CZ-CG2 3.3Å; Q394-I398 HydrophobicContact CG-CD1 4.34Å; Q394-I398 WeakPolarHBondContact O-CG1 3.36Å; Q394-I398 PolarHBondContact O-N 2.94Å; M395-I398 WeakPolarHBondContact O-CB 3.47Å; M395-I398 PolarHBondContact O-N 3.27Å; I398-L402 HydrophobicContact CG2-CD1 3.95Å; I398-L402 WeakPolarHBondContact O-CB 3.3Å; I398-L402 VanDerWaalsContact O-CD1 3.29Å; I398-L402 WeakPolarHBondContact O-CD1 3.36Å; I398-L402 VanDerWaalsContact O-CG 3.27Å; I398-L402 WeakPolarHBondContact O-CG 3.46Å; I398-L402 PolarHBondContact O-N 2.68Å
399	Y	68.6	Low	58.6	Low	57 Å²	57	90.4 Å²	90.4	22%	0.224	48%	0.484	C	S	.	.	H	α-helix	trans	-62.9	-45.6	177.8	-176.6	-100.8	0	0	0	111	F317 L320 M366 M395 A396 R397 L402 C403	F317-Y399 AromaticContact CD1-CD2 3.59Å; F317-Y399 HydrophobicContact CD1-CD2 3.59Å; F317-Y399 AromaticContact CD1-CE2 3.64Å; F317-Y399 HydrophobicContact CD1-CE2 3.64Å; F317-Y399 AromaticContact CE1-CD2 3.6Å; F317-Y399 HydrophobicContact CE1-CD2 3.6Å; F317-Y399 HydrophobicContact CE1-CE2 4.13Å; F317-Y399 HydrophobicContact CG-CD2 4.44Å; F317-Y399 HydrophobicContact CG-CE2 4.36Å; F317-Y399 HydrophobicContact CZ-CD2 4.45Å; L320-Y399 HydrophobicContact CD2-CE2 4.22Å; M366-Y399 HydrophobicContact SD-CD2 4.37Å; M395-Y399 WeakPolarHBondContact O-CB 3.44Å; M395-Y399 PolarHBondContact O-N 2.53Å; A396-Y399 PolarHBondContact O-N 2.75Å; R397-Y399 PolarHBondContact O-N 3.38Å; Y399-L402 PolarHBondContact O-N 2.94Å; Y399-C403 VanDerWaalsContact CE1-SG 3.59Å; Y399-C403 VanDerWaalsContact CZ-SG 3.54Å; Y399-C403 WeakPolarHBondContact O-CB 3.19Å; Y399-C403 PolarHBondContact O-N 2.87Å; Y399-C403 PolarHBondContact O-SG 3.12Å
400	Q	70.6	Confident	57.4	Low	129 Å²	129	96.8 Å²	96.8	60%	0.603	50%	0.501	S	S	*	.	H	α-helix	trans	-65.2	-43.9	-179.8	-171	170.2	11	0	0	112.6	A396 R397 L402 C403 S404	A396-Q400 WeakPolarHBondContact O-CB 3.19Å; A396-Q400 PolarHBondContact O-N 3.42Å; R397-Q400 PolarHBondContact O-N 3.38Å; Q400-L402 VanDerWaalsContact C-N 3.26Å; Q400-L402 PolarHBondContact O-N 2.92Å; Q400-C403 PolarHBondContact O-N 3.37Å; Q400-S404 WeakPolarHBondContact O-CB 3.48Å; Q400-S404 PolarHBondContact O-N 3.36Å; Q400-S404 PolarHBondContact O-OG 3.19Å
401	D	67.8	Low	56.2	Low	91 Å²	91	97.8 Å²	97.8	49%	0.487	51%	0.509	S	S	.	.	H	α-helix	trans	-58.6	-39.7	175.8	-76.3	-10.9	0	0	0	111	R397 S404 Y405	R397-D401 WeakPolarHBondContact O-CB 3.46Å; R397-D401 VanDerWaalsContact O-CG 3.24Å; R397-D401 PolarHBondContact O-N 3.16Å; D401-S404 WeakPolarHBondContact CA-OG 3.5Å; D401-S404 PolarHBondContact O-OG 3.23Å; D401-Y405 PolarHBondContact O-N 2.95Å; D401-Y405 VanDerWaalsContact O-N 3.11Å
402	L	64.4	Low	55.1	Low	45 Å²	45	100.4 Å²	100.4	24%	0.236	53%	0.531	C	S	.	.	H	α-helix	trans	-78.1	-35.8	-179	-68.8	163	0	0	0	112.5	F189 F317 I398 Y399 Q400 S404 Y405	F189-L402 HydrophobicContact CE1-CD1 3.66Å; F189-L402 HydrophobicContact CZ-CD1 3.83Å; F317-L402 HydrophobicContact CD2-CB 4.24Å; F317-L402 HydrophobicContact CD2-CD1 4.3Å; F317-L402 HydrophobicContact CE2-CB 4.01Å; F317-L402 HydrophobicContact CE2-CD1 3.33Å; F317-L402 HydrophobicContact CE2-CG 4.21Å; F317-L402 HydrophobicContact CZ-CD1 3.84Å; I398-L402 HydrophobicContact CG2-CD1 3.95Å; I398-L402 WeakPolarHBondContact O-CB 3.3Å; I398-L402 VanDerWaalsContact O-CD1 3.29Å; I398-L402 WeakPolarHBondContact O-CD1 3.36Å; I398-L402 VanDerWaalsContact O-CG 3.27Å; I398-L402 WeakPolarHBondContact O-CG 3.46Å; I398-L402 PolarHBondContact O-N 2.68Å; Y399-L402 PolarHBondContact O-N 2.94Å; Q400-L402 VanDerWaalsContact C-N 3.26Å; Q400-L402 PolarHBondContact O-N 2.92Å; L402-S404 VanDerWaalsContact C-N 3.33Å; L402-Y405 PolarHBondContact O-N 3.33Å
403	C	63.8	Low	53.7	Low	68 Å²	68	103 Å²	103	46%	0.459	55%	0.55	S	S	.	*	H	α-helix	trans	-70	-28.3	172.4	-71.8	0	0	0	0	112.9	Y399 Q400	Y399-C403 VanDerWaalsContact CE1-SG 3.59Å; Y399-C403 VanDerWaalsContact CZ-SG 3.54Å; Y399-C403 WeakPolarHBondContact O-CB 3.19Å; Y399-C403 PolarHBondContact O-N 2.87Å; Y399-C403 PolarHBondContact O-SG 3.12Å; Q400-C403 PolarHBondContact O-N 3.37Å
404	S	63.2	Low	52.3	Low	78 Å²	78	108.1 Å²	108.1	55%	0.545	57%	0.566	S	S	.	*	H	α-helix	trans	-86.7	-13.8	177.4	49.6	0	0	0	0	113.4	Q400 D401 L402 S406	Q400-S404 WeakPolarHBondContact O-CB 3.48Å; Q400-S404 PolarHBondContact O-N 3.36Å; Q400-S404 PolarHBondContact O-OG 3.19Å; D401-S404 WeakPolarHBondContact CA-OG 3.5Å; D401-S404 PolarHBondContact O-OG 3.23Å; L402-S404 VanDerWaalsContact C-N 3.33Å; S404-S406 VanDerWaalsContact C-N 3.32Å; S404-S406 PolarHBondContact O-N 3.42Å
405	Y	48.8	Very low	50.8	Low	190 Å²	190	114 Å²	114	75%	0.745	59%	0.585	S	S	*	*			trans	-72.1	82.3	169.6	-118.6	-93	0	0	0	111.3	D401 L402 V407	D401-Y405 PolarHBondContact O-N 2.95Å; D401-Y405 VanDerWaalsContact O-N 3.11Å; L402-Y405 PolarHBondContact O-N 3.33Å; Y405-V407 PolarHBondContact O-N 3.31Å
406	S	41.8	Very low	49.2	Very low	100 Å²	100	119.1 Å²	119.1	70%	0.699	61%	0.613	S	S	*	*			trans	-74.5	116	160.2	40	0	0	0	0	108.3	S404 P408	S404-S406 VanDerWaalsContact C-N 3.32Å; S404-S406 PolarHBondContact O-N 3.42Å; S406-P408 WeakPolarHBondContact O-CD 3.44Å
407	V	39.2	Very low	47.8	Very low	120 Å²	120	124.4 Å²	124.4	73%	0.727	63%	0.634	S	S	*	*			trans	-54.2	122.7	171.6	177.5	0	0	0	0	107.7	Y405 Q409	Y405-V407 PolarHBondContact O-N 3.31Å; V407-Q409 PolarHBondContact O-N 3.14Å
408	P	34.6	Very low	46.2	Very low	111 Å²	111	125.1 Å²	125.1	72%	0.721	65%	0.646	S	S	*	*			trans	-61.7	111.9	169.5	-15.1	27.6	0	0	0	106.9	S406 R410	S406-P408 WeakPolarHBondContact O-CD 3.44Å; P408-R410 PolarHBondContact O-N 3.43Å
409	Q	35.1	Very low	44.7	Very low	185 Å²	185	129.8 Å²	129.8	86%	0.864	68%	0.676	S	S	*	*			trans	-59	113.8	164.7	-68.7	-143.8	-10.3	0	0	106.4	V407 P411	V407-Q409 PolarHBondContact O-N 3.14Å; Q409-P411 WeakPolarHBondContact O-CD 3.17Å; Q409-P411 VanDerWaalsContact O-N 3.14Å
410	R	29.9	Very low	43	Very low	235 Å²	235	135.2 Å²	135.2	89%	0.887	71%	0.708	S	S	*	*			trans	-52.9	123.4	169	-88.8	-176.4	178	159.6	0.3	106.9	P408 A412	P408-R410 PolarHBondContact O-N 3.43Å; R410-A412 PolarHBondContact O-N 3.02Å
411	P	32.2	Very low	41.4	Very low	117 Å²	117	135.1 Å²	135.1	76%	0.76	72%	0.716	S	S	*	*			trans	-60.3	133.4	171.3	23.7	-29.1	0	0	0	107.6	Q409 C413	Q409-P411 WeakPolarHBondContact O-CD 3.17Å; Q409-P411 VanDerWaalsContact O-N 3.14Å; P411-C413 PolarHBondContact O-N 3.11Å
412	A	34.9	Very low	39.9	Very low	94 Å²	94	139 Å²	139	78%	0.777	76%	0.76	S	S	*	*			trans	-55.4	104.6	174.6	0	0	0	0	0	108.5	R410 Y414	R410-A412 PolarHBondContact O-N 3.02Å; A412-Y414 PolarHBondContact O-N 3.3Å
413	C	32.3	Very low	38.6	Very low	107 Å²	107	143.7 Å²	143.7	72%	0.723	79%	0.786	S	S	*	*			trans	-70.9	84.1	169.5	164.2	0	0	0	0	107.4	P411 R415	P411-C413 PolarHBondContact O-N 3.11Å; C413-R415 PolarHBondContact O-N 3.06Å
414	Y	35.8	Very low	37.3	Very low	209 Å²	209	147.6 Å²	147.6	82%	0.82	80%	0.803	S	S	*	*			trans	-65.9	105.2	151.7	-110.3	-93.1	0	0	0	106	A412	A412-Y414 PolarHBondContact O-N 3.3Å
415	R	35.3	Very low	35.9	Very low	219 Å²	219	151.5 Å²	151.5	83%	0.826	82%	0.818	S	S	*	*			trans	-103.9	109.2	160.6	-99.9	-166.7	173.9	-171	-0.4	107.2	C413	C413-R415 PolarHBondContact O-N 3.06Å
416	D	33.1	Very low	35.1	Very low	143 Å²	143	149.2 Å²	149.2	77%	0.765	82%	0.822	S	S	*	*			trans	-53.2	138.3	168.4	-80	-45.5	0	0	0	111	M418	D416-M418 PolarHBondContact O-N 3.46Å
417	N	34.8	Very low	34.7	Very low	160 Å²	160	152.3 Å²	152.3	86%	0.856	83%	0.83	S	S	*	*			trans	-63.2	114.7	171.1	-66.8	-45.8	0	0	0	109.5
418	M	36.7	Very low	34.4	Very low	164 Å²	164	154.5 Å²	154.5	81%	0.808	84%	0.837	S	S	*	*			trans	-104.9	123.5	161.1	-83.8	-65	-62.6	0	0	109.2	D416 I420	D416-M418 PolarHBondContact O-N 3.46Å; M418-I420 PolarHBondContact O-N 3.43Å
419	P	35.3	Very low	34.4	Very low	103 Å²	103	157.6 Å²	157.6	67%	0.669	85%	0.845	S	S	*	*			trans	-73.3	126.2	176.3	28.5	-31.2	0	0	0	110.3	T421	P419-T421 PolarHBondContact O-N 2.73Å
420	I	33.7	Very low	34.3	Very low	172 Å²	172	155.5 Å²	155.5	88%	0.882	84%	0.843	S	S	*	*			trans	-70.2	122.3	169.7	-61.7	171.6	0	0	0	107.2	M418	M418-I420 PolarHBondContact O-N 3.43Å
421	T	37.6	Very low	34.7	Very low	127 Å²	127	148.8 Å²	148.8	78%	0.779	84%	0.84	S	S	*	*			trans	-111.2	128	171.5	-28.5	0	0	0	0	108.4	P419	P419-T421 PolarHBondContact O-N 2.73Å
422	A	35	Very low	34.9	Very low	171 Å²	171	151.7 Å²	151.7	100%	1.413	85%	0.847	S	S	*	*			trans	46.5	0	166.7	0	0	0	0	0	119

Retrieved 422 of 422 residues in 380.8 ms (Link to these results)

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