A0A087XAT2_POEFO Loading...

Interferon regulatory factor 3

AlphaFold DB , UniProt , Accession A0A087XAT2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 460 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	32.4	Very low	70.3	Confident	193 Å²	193	97.7 Å²	97.7	95%	0.951	54%	0.54	S	S	*	.				0	121.3	0	-63.2	-176	-166.9	0	0	107.7	H3	M1-H3 PolarHBondContact O-N 3.47Å; M1-H3 VanDerWaalsContact O-N 3.11Å
2	A	36.6	Very low	72.3	Confident	108 Å²	108	89.6 Å²	89.6	89%	0.893	50%	0.495	S	S	*	.			trans	-72	102	172.4	0	0	0	0	0	107.5	S4	A2-S4 PolarHBondContact O-N 3.46Å; A2-S4 VanDerWaalsContact O-N 3.09Å
3	H	46.2	Very low	73.9	Confident	168 Å²	168	89.5 Å²	89.5	78%	0.778	49%	0.487	S	S	*	.			trans	-66.1	111.3	171.7	-66.9	-74.9	0	0	0	107.4	M1 K5	M1-H3 PolarHBondContact O-N 3.47Å; M1-H3 VanDerWaalsContact O-N 3.11Å; H3-K5 PolarHBondContact O-N 3.35Å
4	S	59.5	Low	75.2	Confident	108 Å²	108	88.5 Å²	88.5	76%	0.755	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-56.1	131.3	169.5	45.1	0	0	0	0	108.2	A2 P6	A2-S4 PolarHBondContact O-N 3.46Å; A2-S4 VanDerWaalsContact O-N 3.09Å; S4-P6 WeakPolarHBondContact O-CD 3.46Å; S4-P6 VanDerWaalsContact O-N 3.13Å
5	K	68.4	Low	76.4	Confident	165 Å²	165	82.7 Å²	82.7	72%	0.717	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-59	119.2	179.9	-68.1	178.9	-177.8	176.9	0	108.3	H3	H3-K5 PolarHBondContact O-N 3.35Å
6	P	78.3	Confident	77.4	Confident	46 Å²	46	77.8 Å²	77.8	30%	0.299	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-66.8	140.1	-178.1	26.5	-31.4	0	0	0	110	S4 W11 W57 V60	S4-P6 WeakPolarHBondContact O-CD 3.46Å; S4-P6 VanDerWaalsContact O-N 3.13Å; P6-W11 HydrophobicContact CB-CB 4.39Å; P6-W57 HydrophobicContact CG-CZ3 4.42Å; P6-V60 WeakPolarHBondContact CD-O 3.27Å; P6-V60 HydrophobicContact CG-CB 3.77Å; P6-V60 HydrophobicContact CG-CG2 3.68Å
7	L	86.4	Confident	78.2	Confident	114 Å²	114	77.5 Å²	77.5	60%	0.597	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-68.1	133.9	171.2	-63.2	175.6	0	0	0	109	I9 P10 W11	L7-I9 VanDerWaalsContact C-N 3.34Å; L7-I9 PolarHBondContact O-N 2.97Å; L7-P10 HydrophobicContact CB-CG 4.05Å; L7-P10 WeakPolarHBondContact O-CD 3.26Å; L7-W11 VanDerWaalsContact O-CB 3.31Å; L7-W11 WeakPolarHBondContact O-CB 3.49Å; L7-W11 PolarHBondContact O-N 2.77Å
8	L	89.8	Confident	78.9	Confident	6 Å²	6	75.7 Å²	75.7	3%	0.031	42%	0.422	C	S	.	.	H	α-helix	trans	-56.7	-44.7	-177	177.8	70.9	0	0	0	112.9	W11 L12 W57 A80 L81 K84 F86	L8-W11 HydrophobicContact CD1-CE3 4.43Å; L8-W11 PolarHBondContact O-N 3.14Å; L8-L12 WeakPolarHBondContact O-CB 3.48Å; L8-L12 PolarHBondContact O-N 3.05Å; L8-W57 HydrophobicContact CB-CH2 3.53Å; L8-W57 HydrophobicContact CB-CZ2 3.78Å; L8-W57 HydrophobicContact CB-CZ3 4.22Å; L8-W57 HydrophobicContact CD1-CD2 3.67Å; L8-W57 VanDerWaalsContact CD1-CE2 3.47Å; L8-W57 HydrophobicContact CD1-CE3 3.82Å; L8-W57 HydrophobicContact CD1-CG 4.46Å; L8-W57 HydrophobicContact CD1-CH2 3.64Å; L8-W57 HydrophobicContact CD1-CZ2 3.46Å; L8-W57 VanDerWaalsContact CD1-CZ2 3.46Å; L8-W57 HydrophobicContact CD1-CZ3 3.8Å; L8-W57 HydrophobicContact CG-CH2 4.19Å; L8-W57 HydrophobicContact CG-CZ2 4.16Å; L8-A80 HydrophobicContact CD1-CB 4.3Å; L8-A80 HydrophobicContact CD2-CB 3.62Å; L8-A80 WeakPolarHBondContact CD2-O 3.1Å; L8-L81 HydrophobicContact CD2-CD2 4.3Å; L8-K84 HydrophobicContact CB-CG 4.21Å; L8-K84 HydrophobicContact CD2-CB 4.16Å; L8-K84 HydrophobicContact CD2-CG 3.79Å; L8-F86 HydrophobicContact CD2-CE2 4.31Å
9	I	90.8	Very high	79.5	Confident	54 Å²	54	81.2 Å²	81.2	28%	0.277	44%	0.441	S	S	.	.	H	α-helix	trans	-62.2	-56.6	-173.8	-72	174.3	0	0	0	111.1	L7 W11 L12 K13 K84 F86 W105 P106	L7-I9 VanDerWaalsContact C-N 3.34Å; L7-I9 PolarHBondContact O-N 2.97Å; I9-W11 VanDerWaalsContact C-N 3.32Å; I9-W11 PolarHBondContact O-N 3.35Å; I9-L12 PolarHBondContact O-N 3.46Å; I9-K13 PolarHBondContact O-N 2.89Å; I9-K13 VanDerWaalsContact O-N 3.1Å; I9-K84 HydrophobicContact CD1-CB 4.19Å; I9-K84 HydrophobicContact CD1-CD 4.28Å; I9-K84 HydrophobicContact CG1-CB 4.21Å; I9-K84 HydrophobicContact CG1-CG 4.4Å; I9-F86 HydrophobicContact CG1-CE2 3.81Å; I9-F86 HydrophobicContact CG1-CZ 3.98Å; I9-W105 HydrophobicContact CB-CZ2 4.41Å; I9-W105 HydrophobicContact CG2-CZ2 3.72Å; I9-W105 WeakPolarHBondContact O-CZ2 3.26Å; I9-P106 HydrophobicContact CD1-CG 4.12Å
10	P	90.8	Very high	79.9	Confident	79 Å²	79	85.3 Å²	85.3	51%	0.513	45%	0.449	S	S	.	.	H	α-helix	trans	-59.4	-40.9	175.9	-25.4	33.4	0	0	0	113.5	L7 S14	L7-P10 HydrophobicContact CB-CG 4.05Å; L7-P10 WeakPolarHBondContact O-CD 3.26Å; P10-S14 PolarHBondContact O-N 3.19Å; P10-S14 VanDerWaalsContact O-N 3.15Å
11	W	93.9	Very high	80.5	Confident	34 Å²	34	82.4 Å²	82.4	13%	0.129	43%	0.433	C	S	.	.	H	α-helix	trans	-65.4	-42.8	-179.4	176.8	87.7	0	0	0	112.2	P6 L7 L8 I9 S15 I53 A56 W57 V60 F77	P6-W11 HydrophobicContact CB-CB 4.39Å; L7-W11 VanDerWaalsContact O-CB 3.31Å; L7-W11 WeakPolarHBondContact O-CB 3.49Å; L7-W11 PolarHBondContact O-N 2.77Å; L8-W11 HydrophobicContact CD1-CE3 4.43Å; L8-W11 PolarHBondContact O-N 3.14Å; I9-W11 VanDerWaalsContact C-N 3.32Å; I9-W11 PolarHBondContact O-N 3.35Å; W11-S15 WeakPolarHBondContact CZ2-OG 3.46Å; W11-S15 VanDerWaalsContact O-CB 3.24Å; W11-S15 WeakPolarHBondContact O-CB 3.18Å; W11-S15 PolarHBondContact O-N 3.13Å; W11-S15 PolarHBondContact O-OG 3.49Å; W11-I53 HydrophobicContact CH2-CG1 4.03Å; W11-I53 HydrophobicContact CZ3-CG1 4.43Å; W11-A56 HydrophobicContact CH2-CB 4.41Å; W11-A56 HydrophobicContact CZ2-CB 3.94Å; W11-W57 HydrophobicContact CB-CZ3 4.06Å; W11-W57 AromaticContact CD2-CE3 3.48Å; W11-W57 HydrophobicContact CD2-CE3 3.48Å; W11-W57 VanDerWaalsContact CD2-CE3 3.48Å; W11-W57 AromaticContact CD2-CZ3 3.83Å; W11-W57 HydrophobicContact CD2-CZ3 3.83Å; W11-W57 AromaticContact CE2-CE3 3.98Å; W11-W57 HydrophobicContact CE3-CD2 4.18Å; W11-W57 AromaticContact CE3-CE3 3.29Å; W11-W57 HydrophobicContact CE3-CE3 3.29Å; W11-W57 AromaticContact CE3-CZ3 3.83Å; W11-W57 HydrophobicContact CE3-CZ3 3.83Å; W11-W57 HydrophobicContact CG-CE3 4.07Å; W11-W57 AromaticContact CG-CZ3 3.93Å; W11-W57 HydrophobicContact CG-CZ3 3.93Å; W11-W57 HydrophobicContact CH2-CB 3.56Å; W11-W57 HydrophobicContact CH2-CE3 4.15Å; W11-W57 HydrophobicContact CH2-CG 4.42Å; W11-W57 HydrophobicContact CZ2-CB 4.16Å; W11-W57 HydrophobicContact CZ2-CE3 4.29Å; W11-W57 HydrophobicContact CZ3-CB 3.86Å; W11-W57 HydrophobicContact CZ3-CD2 4.17Å; W11-W57 AromaticContact CZ3-CE3 3.68Å; W11-W57 HydrophobicContact CZ3-CE3 3.68Å; W11-W57 HydrophobicContact CZ3-CG 4.28Å; W11-V60 HydrophobicContact CD2-CG2 4.31Å; W11-V60 HydrophobicContact CG-CG2 4.36Å; W11-V60 HydrophobicContact CZ2-CG2 4.26Å; W11-F77 HydrophobicContact CH2-CE2 4.44Å; W11-F77 AromaticContact CZ3-CE2 3.93Å; W11-F77 HydrophobicContact CZ3-CE2 3.93Å
12	L	94.2	Very high	83.1	Confident	0 Å²	0	76.3 Å²	76.3	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-68.6	-40.5	-178.4	-177.6	57.4	0	0	0	110.7	L8 I9 S15 I16 F34 I53 F77 L81 F86 W105	L8-L12 WeakPolarHBondContact O-CB 3.48Å; L8-L12 PolarHBondContact O-N 3.05Å; I9-L12 PolarHBondContact O-N 3.46Å; L12-S15 WeakPolarHBondContact O-CB 3.37Å; L12-S15 PolarHBondContact O-N 3.33Å; L12-I16 HydrophobicContact CD1-CD1 4.1Å; L12-I16 HydrophobicContact CD1-CG1 4.21Å; L12-I16 HydrophobicContact CG-CD1 3.91Å; L12-I16 HydrophobicContact CG-CG1 4.49Å; L12-I16 WeakPolarHBondContact O-CD1 3.33Å; L12-I16 VanDerWaalsContact O-CG1 3.26Å; L12-I16 WeakPolarHBondContact O-CG1 3.33Å; L12-I16 PolarHBondContact O-N 3.45Å; L12-F34 HydrophobicContact CD2-CE1 4.24Å; L12-F34 HydrophobicContact CD2-CE2 4.21Å; L12-F34 HydrophobicContact CD2-CZ 3.73Å; L12-I53 HydrophobicContact CD1-CD1 4Å; L12-F77 HydrophobicContact CD1-CE2 4.48Å; L12-F77 HydrophobicContact CD1-CZ 3.82Å; L12-F77 HydrophobicContact CD2-CZ 4.49Å; L12-L81 HydrophobicContact CD2-CD2 3.58Å; L12-F86 HydrophobicContact CD2-CE1 4.08Å; L12-F86 HydrophobicContact CD2-CZ 3.93Å; L12-W105 HydrophobicContact CB-CH2 4.12Å; L12-W105 HydrophobicContact CD2-CH2 4.26Å; L12-W105 HydrophobicContact CD2-CZ3 4.28Å; L12-W105 HydrophobicContact CG-CH2 4.09Å; L12-W105 HydrophobicContact CG-CZ3 4.3Å
13	K	92.9	Very high	85.6	Confident	89 Å²	89	73 Å²	73	39%	0.387	38%	0.384	S	S	.	.	H	α-helix	trans	-58.4	-53.1	175.9	-174.2	165.5	-171.3	169.3	0	110.9	I9 S15 I16 D17 W26 Q31 W105	I9-K13 PolarHBondContact O-N 2.89Å; I9-K13 VanDerWaalsContact O-N 3.1Å; K13-S15 VanDerWaalsContact C-N 3.27Å; K13-S15 PolarHBondContact O-N 3.23Å; K13-I16 PolarHBondContact O-N 3.33Å; K13-D17 PolarHBondContact O-N 3.28Å; K13-W26 HydrophobicContact CG-CZ2 4.09Å; K13-Q31 VanDerWaalsContact CE-OE1 3.25Å; K13-W105 HydrophobicContact CB-CH2 3.87Å; K13-W105 HydrophobicContact CB-CZ2 4.02Å
14	S	92.3	Very high	87.8	Confident	75 Å²	75	65.4 Å²	65.4	52%	0.524	35%	0.35	S	S	.	.	H	α-helix	trans	-60	-37.1	176.2	179.7	0	0	0	0	112.7	P10 S18	P10-S14 PolarHBondContact O-N 3.19Å; P10-S14 VanDerWaalsContact O-N 3.15Å; S14-S18 VanDerWaalsContact O-CB 3.29Å; S14-S18 WeakPolarHBondContact O-CB 3.49Å; S14-S18 PolarHBondContact O-N 3.33Å
15	S	92.8	Very high	89.5	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.014	34%	0.335	C	S	.	.	H	α-helix	trans	-65	-43.3	178	-70.2	0	0	0	0	112.6	W11 L12 K13 S18	W11-S15 WeakPolarHBondContact CZ2-OG 3.46Å; W11-S15 VanDerWaalsContact O-CB 3.24Å; W11-S15 WeakPolarHBondContact O-CB 3.18Å; W11-S15 PolarHBondContact O-N 3.13Å; W11-S15 PolarHBondContact O-OG 3.49Å; L12-S15 WeakPolarHBondContact O-CB 3.37Å; L12-S15 PolarHBondContact O-N 3.33Å; K13-S15 VanDerWaalsContact C-N 3.27Å; K13-S15 PolarHBondContact O-N 3.23Å; S15-S18 PolarHBondContact O-OG 3.16Å
16	I	93.8	Very high	90.7	Very high	3 Å²	3	59 Å²	59	2%	0.015	31%	0.308	C	S	.	.	H	α-helix	trans	-67.1	-46.9	176.3	-61.1	159.9	0	0	0	110.1	L12 K13 S18 K19 V24 W26 F34 W105	L12-I16 HydrophobicContact CD1-CD1 4.1Å; L12-I16 HydrophobicContact CD1-CG1 4.21Å; L12-I16 HydrophobicContact CG-CD1 3.91Å; L12-I16 HydrophobicContact CG-CG1 4.49Å; L12-I16 WeakPolarHBondContact O-CD1 3.33Å; L12-I16 VanDerWaalsContact O-CG1 3.26Å; L12-I16 WeakPolarHBondContact O-CG1 3.33Å; L12-I16 PolarHBondContact O-N 3.45Å; K13-I16 PolarHBondContact O-N 3.33Å; I16-S18 PolarHBondContact O-N 3.12Å; I16-K19 PolarHBondContact O-N 3.17Å; I16-K19 VanDerWaalsContact O-N 3.12Å; I16-V24 HydrophobicContact CG1-CG1 3.8Å; I16-W26 HydrophobicContact CB-CZ2 4.22Å; I16-W26 HydrophobicContact CD1-CH2 4.04Å; I16-W26 HydrophobicContact CD1-CZ2 4.01Å; I16-W26 HydrophobicContact CD1-CZ3 4.42Å; I16-W26 HydrophobicContact CG2-CD2 3.91Å; I16-W26 HydrophobicContact CG2-CG 3.92Å; I16-W26 HydrophobicContact CG2-CZ2 4.19Å; I16-F34 HydrophobicContact CD1-CB 3.75Å; I16-F34 HydrophobicContact CD1-CD1 4.05Å; I16-F34 HydrophobicContact CD1-CD2 3.88Å; I16-F34 HydrophobicContact CD1-CG 3.6Å; I16-W105 HydrophobicContact CD1-CZ3 3.99Å
17	D	91	Very high	91.4	Very high	73 Å²	73	59.9 Å²	59.9	39%	0.39	31%	0.313	S	S	.	.	H	α-helix	trans	-62.9	-30.6	-179.9	-69.5	-26.4	0	0	0	112.6	K13 K19 W26 Q31	K13-D17 PolarHBondContact O-N 3.28Å; D17-K19 PolarHBondContact O-N 2.64Å; D17-W26 PolarHBondContact OD1-NE1 3.09Å; D17-Q31 PolarHBondContact OD1-NE2 2.95Å
18	S	90.6	Very high	91.6	Very high	46 Å²	46	56 Å²	56	32%	0.322	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-16.8	178.3	76.5	0	0	0	0	114.1	S14 S15 I16 R20	S14-S18 VanDerWaalsContact O-CB 3.29Å; S14-S18 WeakPolarHBondContact O-CB 3.49Å; S14-S18 PolarHBondContact O-N 3.33Å; S15-S18 PolarHBondContact O-OG 3.16Å; I16-S18 PolarHBondContact O-N 3.12Å; S18-R20 WeakPolarHBondContact O-CG 3.47Å; S18-R20 PolarHBondContact O-N 2.82Å; S18-R20 PolarHBondContact OG-NE 2.93Å
19	K	89.5	Confident	91.4	Very high	180 Å²	180	62 Å²	62	78%	0.783	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	22.9	-176.7	-59.4	-177	-179	-179.2	0	114.6	I16 D17 Y21	I16-K19 PolarHBondContact O-N 3.17Å; I16-K19 VanDerWaalsContact O-N 3.12Å; D17-K19 PolarHBondContact O-N 2.64Å; K19-Y21 VanDerWaalsContact C-N 3.32Å; K19-Y21 PolarHBondContact O-N 3.44Å
20	R	87.9	Confident	91.2	Very high	163 Å²	163	66.6 Å²	66.6	62%	0.615	35%	0.352	S	S	*	.			trans	-79.3	-13.2	-177.8	-69.2	-172.7	-64	150.8	-2.1	114	S18	S18-R20 WeakPolarHBondContact O-CG 3.47Å; S18-R20 PolarHBondContact O-N 2.82Å; S18-R20 PolarHBondContact OG-NE 2.93Å
21	Y	91.6	Very high	91.1	Very high	25 Å²	25	65.9 Å²	65.9	10%	0.098	34%	0.342	C	S	.	.	S	Bend	trans	-113	112.2	-175.5	-52.3	-69.3	0	0	0	109.4	K19 G23 V24 L52 I53 A56	K19-Y21 VanDerWaalsContact C-N 3.32Å; K19-Y21 PolarHBondContact O-N 3.44Å; Y21-G23 PolarHBondContact O-N 3.38Å; Y21-V24 PolarHBondContact O-N 3.27Å; Y21-V24 VanDerWaalsContact O-N 3.14Å; Y21-L52 HydrophobicContact CD1-CB 3.73Å; Y21-L52 HydrophobicContact CE1-CB 4.24Å; Y21-I53 HydrophobicContact CD1-CB 4.08Å; Y21-I53 HydrophobicContact CD2-CB 4.23Å; Y21-I53 HydrophobicContact CD2-CD1 4.07Å; Y21-I53 HydrophobicContact CD2-CG1 4.17Å; Y21-I53 HydrophobicContact CE2-CG1 4.4Å; Y21-I53 HydrophobicContact CG-CB 3.89Å; Y21-I53 HydrophobicContact CG-CD1 4.47Å; Y21-I53 HydrophobicContact CG-CG1 4.35Å; Y21-A56 HydrophobicContact CE1-CB 3.89Å; Y21-A56 VanDerWaalsContact OH-CB 3.23Å; Y21-A56 WeakPolarHBondContact OH-CB 3.46Å
22	P	88.5	Confident	90.9	Very high	64 Å²	64	66.8 Å²	66.8	42%	0.416	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	136.5	179.6	-28.4	36.7	0	0	0	112.1	V24 P37 E49	P22-V24 PolarHBondContact O-N 3.47Å; P22-P37 WeakPolarHBondContact O-CG 3.24Å; P22-E49 HydrophobicContact CG-CB 4.33Å
23	G	88.1	Confident	90.9	Very high	40 Å²	40	68.4 Å²	68.4	41%	0.412	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	-0.7	179.6	0	0	0	0	0	115.7	Y21 C35 P37	Y21-G23 PolarHBondContact O-N 3.38Å; G23-C35 PolarHBondContact O-SG 2.95Å; G23-P37 WeakPolarHBondContact O-CD 3.47Å
24	V	93.6	Very high	91	Very high	8 Å²	8	64.2 Å²	64.2	5%	0.048	34%	0.341	C	S	.	.			trans	-97.2	115.9	171.8	-177.8	0	0	0	0	110	I16 Y21 P22 C35 I36 I53	I16-V24 HydrophobicContact CG1-CG1 3.8Å; Y21-V24 PolarHBondContact O-N 3.27Å; Y21-V24 VanDerWaalsContact O-N 3.14Å; P22-V24 PolarHBondContact O-N 3.47Å; V24-C35 WeakPolarHBondContact CA-O 3.43Å; V24-I36 HydrophobicContact CG1-CG1 4.33Å; V24-I36 HydrophobicContact CG2-CG1 4.37Å; V24-I53 HydrophobicContact CB-CD1 4.34Å; V24-I53 HydrophobicContact CG1-CD1 3.73Å; V24-I53 HydrophobicContact CG2-CB 4.31Å; V24-I53 HydrophobicContact CG2-CD1 3.91Å; V24-I53 HydrophobicContact CG2-CG2 4.04Å
25	H	94	Very high	91.1	Very high	95 Å²	95	60.9 Å²	60.9	44%	0.44	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	162.7	178.9	56.5	-83	0	0	0	112.4	F34 C35	H25-F34 CarbonylContact O-C 3.59Å; H25-F34 VanDerWaalsContact O-CA 3.27Å; H25-F34 WeakPolarHBondContact O-CA 3.34Å; H25-F34 WeakPolarHBondContact O-CB 3.36Å; H25-C35 PolarHBondContact CE1-SG 3.23Å; H25-C35 PolarHBondContact ND1-SG 2.9Å; H25-C35 PolarHBondContact O-N 2.89Å
26	W	94.8	Very high	91.1	Very high	44 Å²	44	60.8 Å²	60.8	17%	0.167	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	131.8	168.3	-61.5	110.7	0	0	0	110.6	K13 I16 D17 Q31 E33 F34 W105	K13-W26 HydrophobicContact CG-CZ2 4.09Å; I16-W26 HydrophobicContact CB-CZ2 4.22Å; I16-W26 HydrophobicContact CD1-CH2 4.04Å; I16-W26 HydrophobicContact CD1-CZ2 4.01Å; I16-W26 HydrophobicContact CD1-CZ3 4.42Å; I16-W26 HydrophobicContact CG2-CD2 3.91Å; I16-W26 HydrophobicContact CG2-CG 3.92Å; I16-W26 HydrophobicContact CG2-CZ2 4.19Å; D17-W26 PolarHBondContact OD1-NE1 3.09Å; W26-Q31 HydrophobicContact CD2-CB 3.82Å; W26-Q31 HydrophobicContact CD2-CG 3.86Å; W26-Q31 VanDerWaalsContact CE3-CA 3.45Å; W26-Q31 HydrophobicContact CE3-CB 3.78Å; W26-Q31 HydrophobicContact CE3-CG 4.32Å; W26-Q31 HydrophobicContact CG-CB 4.48Å; W26-Q31 HydrophobicContact CG-CG 4.05Å; W26-Q31 HydrophobicContact CH2-CB 4.02Å; W26-Q31 HydrophobicContact CZ2-CB 4.06Å; W26-Q31 HydrophobicContact CZ2-CG 4.37Å; W26-Q31 VanDerWaalsContact CZ3-C 3.43Å; W26-Q31 HydrophobicContact CZ3-CB 3.89Å; W26-Q31 WeakPolarHBondContact CZ3-O 3.36Å; W26-E33 CarbonylContact C-O 3.58Å; W26-E33 WeakPolarHBondContact CA-O 3.47Å; W26-F34 HydrophobicContact CE3-CB 3.93Å; W26-F34 HydrophobicContact CZ3-CB 4.18Å; W26-F34 HydrophobicContact CZ3-CD1 4.29Å; W26-W105 HydrophobicContact CH2-CD2 4.4Å; W26-W105 AromaticContact CH2-CE3 3.54Å; W26-W105 HydrophobicContact CH2-CE3 3.54Å; W26-W105 HydrophobicContact CH2-CH2 4.05Å; W26-W105 AromaticContact CH2-CZ3 3.36Å; W26-W105 HydrophobicContact CH2-CZ3 3.36Å; W26-W105 HydrophobicContact CZ2-CZ3 4.37Å; W26-W105 AromaticContact CZ3-CE3 3.69Å; W26-W105 HydrophobicContact CZ3-CE3 3.69Å; W26-W105 AromaticContact CZ3-CZ3 3.87Å; W26-W105 HydrophobicContact CZ3-CZ3 3.87Å
27	T	91.8	Very high	90.9	Very high	64 Å²	64	61.2 Å²	61.2	39%	0.393	32%	0.32	S	S	.	.	S	Bend	trans	-89	-13.2	176.4	52.6	0	0	0	0	112.3	E33 C35 V102	T27-E33 PolarHBondContact N-O 3Å; T27-E33 WeakPolarHBondContact OG1-CB 3.31Å; T27-E33 PolarHBondContact OG1-O 3.34Å; T27-C35 HydrophobicContact CG2-CB 3.84Å; T27-V102 HydrophobicContact CG2-CG1 4.25Å; T27-V102 HydrophobicContact CG2-CG2 4.41Å
28	N	90	Very high	90.8	Very high	31 Å²	31	59.1 Å²	59.1	17%	0.166	31%	0.306	C	S	.	.	S	Bend	trans	-138.3	152.5	179.3	71.5	-34.7	0	0	0	112.4	E30 Q31 T32 E33	N28-E30 PolarHBondContact O-N 3.41Å; N28-Q31 PolarHBondContact O-N 3.15Å; N28-T32 PolarHBondContact ND2-OG1 3.03Å; N28-T32 PolarHBondContact OD1-N 3.22Å; N28-E33 PolarHBondContact OD1-N 3.24Å; N28-E33 PolarHBondContact OD1-O 3.32Å
29	P	85.5	Confident	90.6	Very high	132 Å²	132	58.3 Å²	58.3	86%	0.857	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-23.3	-178.4	26.3	-34.6	0	0	0	113.4	Q31	P29-Q31 PolarHBondContact O-N 2.89Å
30	E	87.4	Confident	90.1	Very high	151 Å²	151	54.6 Å²	54.6	71%	0.706	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-3.4	179.5	-54.1	177.7	165.3	0	0	113.1	N28 T32	N28-E30 PolarHBondContact O-N 3.41Å; E30-T32 HydrophobicContact CB-CG2 4.09Å; E30-T32 PolarHBondContact O-N 2.88Å
31	Q	89.4	Confident	89.4	Confident	65 Å²	65	50 Å²	50	30%	0.304	28%	0.279	S	S	.	.	S	Bend	trans	52.8	36	-177.2	-58.9	-168.7	-26.8	0	0	113.4	K13 D17 W26 N28 P29	K13-Q31 VanDerWaalsContact CE-OE1 3.25Å; D17-Q31 PolarHBondContact OD1-NE2 2.95Å; W26-Q31 HydrophobicContact CD2-CB 3.82Å; W26-Q31 HydrophobicContact CD2-CG 3.86Å; W26-Q31 VanDerWaalsContact CE3-CA 3.45Å; W26-Q31 HydrophobicContact CE3-CB 3.78Å; W26-Q31 HydrophobicContact CE3-CG 4.32Å; W26-Q31 HydrophobicContact CG-CB 4.48Å; W26-Q31 HydrophobicContact CG-CG 4.05Å; W26-Q31 HydrophobicContact CH2-CB 4.02Å; W26-Q31 HydrophobicContact CZ2-CB 4.06Å; W26-Q31 HydrophobicContact CZ2-CG 4.37Å; W26-Q31 VanDerWaalsContact CZ3-C 3.43Å; W26-Q31 HydrophobicContact CZ3-CB 3.89Å; W26-Q31 WeakPolarHBondContact CZ3-O 3.36Å; N28-Q31 PolarHBondContact O-N 3.15Å; P29-Q31 PolarHBondContact O-N 2.89Å
32	T	89.9	Confident	88.6	Confident	52 Å²	52	57.2 Å²	57.2	32%	0.319	32%	0.318	S	S	.	.	S	Bend	trans	-100	-13.5	175.8	62.8	0	0	0	0	111.8	N28 E30 R104 W105	N28-T32 PolarHBondContact ND2-OG1 3.03Å; N28-T32 PolarHBondContact OD1-N 3.22Å; E30-T32 HydrophobicContact CB-CG2 4.09Å; E30-T32 PolarHBondContact O-N 2.88Å; T32-R104 CarbonylContact O-C 3.59Å; T32-R104 VanDerWaalsContact O-CA 3.25Å; T32-R104 WeakPolarHBondContact O-CA 3.46Å; T32-R104 WeakPolarHBondContact O-CG 3.33Å; T32-W105 PolarHBondContact O-N 2.87Å
33	E	93.8	Very high	88	Confident	35 Å²	35	57.7 Å²	57.7	16%	0.164	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	137.6	178.7	-62.9	-175.2	174.3	0	0	112.4	W26 T27 N28 V102 Y103 R104	W26-E33 CarbonylContact C-O 3.58Å; W26-E33 WeakPolarHBondContact CA-O 3.47Å; T27-E33 PolarHBondContact N-O 3Å; T27-E33 WeakPolarHBondContact OG1-CB 3.31Å; T27-E33 PolarHBondContact OG1-O 3.34Å; N28-E33 PolarHBondContact OD1-N 3.24Å; N28-E33 PolarHBondContact OD1-O 3.32Å; E33-V102 HydrophobicContact CB-CG1 4.29Å; E33-Y103 VanDerWaalsContact CA-O 3.28Å; E33-Y103 WeakPolarHBondContact CA-O 3.06Å; E33-R104 HydrophobicContact CG-CB 4.14Å; E33-R104 HydrophobicContact CG-CG 4.11Å; E33-R104 IonicContact OE1-CZ 2.9Å; E33-R104 IonicContact OE1-NE 2.81Å; E33-R104 PolarHBondContact OE1-NE 2.91Å; E33-R104 IonicContact OE1-NH2 2.75Å; E33-R104 PolarHBondContact OE1-NH2 3.11Å
34	F	95.2	Very high	87.3	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	152.6	177.2	66.7	-83.2	0	0	0	111	L12 I16 H25 W26 I36 L81 F86 V102 Y103 W105	L12-F34 HydrophobicContact CD2-CE1 4.24Å; L12-F34 HydrophobicContact CD2-CE2 4.21Å; L12-F34 HydrophobicContact CD2-CZ 3.73Å; I16-F34 HydrophobicContact CD1-CB 3.75Å; I16-F34 HydrophobicContact CD1-CD1 4.05Å; I16-F34 HydrophobicContact CD1-CD2 3.88Å; I16-F34 HydrophobicContact CD1-CG 3.6Å; H25-F34 CarbonylContact O-C 3.59Å; H25-F34 VanDerWaalsContact O-CA 3.27Å; H25-F34 WeakPolarHBondContact O-CA 3.34Å; H25-F34 WeakPolarHBondContact O-CB 3.36Å; W26-F34 HydrophobicContact CE3-CB 3.93Å; W26-F34 HydrophobicContact CZ3-CB 4.18Å; W26-F34 HydrophobicContact CZ3-CD1 4.29Å; F34-I36 HydrophobicContact CD2-CD1 4.07Å; F34-I36 HydrophobicContact CD2-CG1 3.78Å; F34-I36 HydrophobicContact CE2-CD1 3.49Å; F34-I36 VanDerWaalsContact CE2-CD1 3.49Å; F34-I36 HydrophobicContact CE2-CG1 3.7Å; F34-L81 HydrophobicContact CZ-CD2 4.09Å; F34-F86 AromaticContact CE1-CD1 3.65Å; F34-F86 HydrophobicContact CE1-CD1 3.65Å; F34-F86 AromaticContact CE1-CE1 3.61Å; F34-F86 HydrophobicContact CE1-CE1 3.61Å; F34-F86 HydrophobicContact CZ-CD1 4.03Å; F34-F86 HydrophobicContact CZ-CE1 4.1Å; F34-V102 WeakPolarHBondContact O-CA 3.44Å; F34-Y103 WeakPolarHBondContact CD1-O 3.43Å; F34-Y103 HydrophobicContact CE2-CD2 4.04Å; F34-Y103 HydrophobicContact CE2-CG 4.39Å; F34-Y103 VanDerWaalsContact CZ-CB 3.49Å; F34-Y103 HydrophobicContact CZ-CD2 4.21Å; F34-Y103 HydrophobicContact CZ-CG 4.11Å; F34-Y103 PolarHBondContact N-O 3.18Å; F34-Y103 PolarHBondContact O-N 3.43Å; F34-W105 AromaticContact CD1-CE3 3.88Å; F34-W105 HydrophobicContact CD1-CE3 3.88Å; F34-W105 AromaticContact CD1-CZ3 3.89Å; F34-W105 HydrophobicContact CD1-CZ3 3.89Å; F34-W105 AromaticContact CE1-CE3 3.89Å; F34-W105 HydrophobicContact CE1-CE3 3.89Å; F34-W105 AromaticContact CE1-CZ3 3.89Å; F34-W105 HydrophobicContact CE1-CZ3 3.89Å
35	C	93.8	Very high	86.6	Confident	5 Å²	5	68.8 Å²	68.8	3%	0.034	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	151.2	174.3	82.8	0	0	0	0	111.7	G23 V24 H25 T27 K101 V102	G23-C35 PolarHBondContact O-SG 2.95Å; V24-C35 WeakPolarHBondContact CA-O 3.43Å; H25-C35 PolarHBondContact CE1-SG 3.23Å; H25-C35 PolarHBondContact ND1-SG 2.9Å; H25-C35 PolarHBondContact O-N 2.89Å; T27-C35 HydrophobicContact CG2-CB 3.84Å; C35-K101 CarbonylContact C-O 3.51Å; C35-K101 VanDerWaalsContact CA-O 3.26Å; C35-K101 WeakPolarHBondContact CA-O 3.35Å; C35-V102 HydrophobicContact CB-CG2 4.14Å
36	I	93.3	Very high	85.8	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	134.5	172.7	-66.3	-173.4	0	0	0	109.2	V24 F34 W38 I53 F54 F77 H100 K101	V24-I36 HydrophobicContact CG1-CG1 4.33Å; V24-I36 HydrophobicContact CG2-CG1 4.37Å; F34-I36 HydrophobicContact CD2-CD1 4.07Å; F34-I36 HydrophobicContact CD2-CG1 3.78Å; F34-I36 HydrophobicContact CE2-CD1 3.49Å; F34-I36 VanDerWaalsContact CE2-CD1 3.49Å; F34-I36 HydrophobicContact CE2-CG1 3.7Å; I36-W38 HydrophobicContact CG2-CE3 4.48Å; I36-W38 PolarHBondContact O-N 3.13Å; I36-I53 HydrophobicContact CD1-CD1 4.48Å; I36-I53 HydrophobicContact CG2-CG2 4.22Å; I36-F54 HydrophobicContact CG2-CE1 3.78Å; I36-F54 HydrophobicContact CG2-CE2 4.36Å; I36-F54 HydrophobicContact CG2-CZ 3.4Å; I36-F77 HydrophobicContact CD1-CD1 4.43Å; I36-F77 HydrophobicContact CD1-CE1 3.36Å; I36-F77 HydrophobicContact CD1-CZ 3.72Å; I36-H100 CarbonylContact O-C 3.56Å; I36-H100 WeakPolarHBondContact O-CA 3.28Å; I36-K101 PolarHBondContact N-O 3.2Å; I36-K101 PolarHBondContact O-N 3.07Å
37	P	90.1	Very high	85.2	Confident	12 Å²	12	67 Å²	67	8%	0.078	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	132.5	171.7	-23.5	35.3	0	0	0	111.9	P22 G23	P22-P37 WeakPolarHBondContact O-CG 3.24Å; G23-P37 WeakPolarHBondContact O-CD 3.47Å
38	W	88.3	Confident	84.6	Confident	30 Å²	30	69.1 Å²	69.1	11%	0.114	37%	0.368	C	S	.	.			trans	-129.4	50	-176.6	-151	-81.8	0	0	0	112.5	I36 F54 K74 R78 P99 K101	I36-W38 HydrophobicContact CG2-CE3 4.48Å; I36-W38 PolarHBondContact O-N 3.13Å; W38-F54 HydrophobicContact CE3-CE1 4.29Å; W38-F54 AromaticContact CE3-CZ 3.86Å; W38-F54 HydrophobicContact CE3-CZ 3.86Å; W38-F54 HydrophobicContact CH2-CE1 4.29Å; W38-F54 HydrophobicContact CH2-CZ 4.45Å; W38-F54 AromaticContact CZ3-CE1 3.67Å; W38-F54 HydrophobicContact CZ3-CE1 3.67Å; W38-F54 AromaticContact CZ3-CZ 3.7Å; W38-F54 HydrophobicContact CZ3-CZ 3.7Å; W38-K74 HydrophobicContact CH2-CB 4.28Å; W38-K74 HydrophobicContact CZ2-CB 4.18Å; W38-R78 HydrophobicContact CH2-CB 4Å; W38-P99 PolarHBondContact N-O 3.19Å; W38-K101 HydrophobicContact CB-CD 4.15Å; W38-K101 HydrophobicContact CB-CG 3.83Å; W38-K101 HydrophobicContact CD2-CD 3.67Å; W38-K101 HydrophobicContact CD2-CG 4.27Å; W38-K101 HydrophobicContact CE3-CD 3.93Å; W38-K101 HydrophobicContact CE3-CG 4.44Å; W38-K101 HydrophobicContact CG-CD 3.75Å; W38-K101 VanDerWaalsContact CG-CE 3.47Å; W38-K101 HydrophobicContact CG-CG 4Å
39	K	86.2	Confident	84.3	Confident	28 Å²	28	73.2 Å²	73.2	12%	0.122	39%	0.386	C	S	.	.			trans	-74.3	141.1	-178.7	-154.3	163.8	-163.2	170.6	0	112.7	D45 D50 K74 P99	K39-D45 VanDerWaalsContact CE-O 3.3Å; K39-D45 WeakPolarHBondContact CE-O 3.35Å; K39-D45 WeakPolarHBondContact CE-OD1 3.23Å; K39-D45 WeakPolarHBondContact CE-OD2 3.41Å; K39-D45 PolarHBondContact NZ-O 3.05Å; K39-D45 IonicContact NZ-OD1 3.44Å; K39-D45 PolarHBondContact NZ-OD1 3.5Å; K39-D45 IonicContact NZ-OD2 2.72Å; K39-D45 PolarHBondContact NZ-OD2 3.35Å; K39-D50 HydrophobicContact CB-CB 4.4Å; K39-D50 VanDerWaalsContact CD-OD2 3.32Å; K39-D50 WeakPolarHBondContact CD-OD2 3.29Å; K39-K74 PolarHBondContact O-NZ 3.35Å; K39-P99 HydrophobicContact CB-CB 4.47Å; K39-P99 HydrophobicContact CG-CG 4.21Å
40	H	79	Confident	84.2	Confident	103 Å²	103	68.3 Å²	68.3	48%	0.477	35%	0.353	S	S	.	.			trans	-76.1	137.1	172.8	-78.1	-84.9	0	0	0	111	L42 R43	H40-L42 PolarHBondContact O-N 3.21Å; H40-R43 HydrophobicContact CB-CG 4.17Å; H40-R43 PolarHBondContact O-N 3.34Å; H40-R43 VanDerWaalsContact O-N 3.16Å
41	A	73.2	Confident	84.3	Confident	65 Å²	65	61.7 Å²	61.7	54%	0.537	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-17	-178.1	0	0	0	0	0	114.2	R43 S46	A41-R43 VanDerWaalsContact C-N 3.33Å; A41-S46 PolarHBondContact O-OG 3.27Å
42	L	74.6	Confident	84.4	Confident	177 Å²	177	61.3 Å²	61.3	93%	0.927	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-3.3	178.1	-64.9	171.9	0	0	0	113.1	H40	H40-L42 PolarHBondContact O-N 3.21Å
43	R	76.6	Confident	84.6	Confident	75 Å²	75	59 Å²	59	28%	0.283	31%	0.308	S	S	.	.	S	Bend	trans	-78	139	176.9	-65.1	-179.9	56.7	126.8	-6.6	110.4	H40 A41 D45 S46 A96	H40-R43 HydrophobicContact CB-CG 4.17Å; H40-R43 PolarHBondContact O-N 3.34Å; H40-R43 VanDerWaalsContact O-N 3.16Å; A41-R43 VanDerWaalsContact C-N 3.33Å; R43-D45 WeakPolarHBondContact CB-OD1 3.35Å; R43-D45 IonicContact CZ-OD1 3.65Å; R43-D45 IonicContact CZ-OD2 3.88Å; R43-D45 IonicContact NE-OD1 2.92Å; R43-D45 PolarHBondContact NE-OD1 2.99Å; R43-D45 IonicContact NE-OD2 3.81Å; R43-D45 IonicContact NH2-OD1 3.47Å; R43-D45 PolarHBondContact NH2-OD1 2.78Å; R43-D45 IonicContact NH2-OD2 3.05Å; R43-D45 PolarHBondContact NH2-OD2 3.1Å; R43-D45 PolarHBondContact O-N 3.35Å; R43-S46 WeakPolarHBondContact O-CB 3.46Å; R43-S46 PolarHBondContact O-N 3.24Å; R43-S46 PolarHBondContact O-OG 3.38Å; R43-A96 PolarHBondContact NH2-O 3.39Å
44	Q	73.4	Confident	84.5	Confident	206 Å²	206	57.4 Å²	57.4	96%	0.963	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-28	178.2	-71.3	-177	-18	0	0	113.1
45	D	77.8	Confident	84.3	Confident	74 Å²	74	60.3 Å²	60.3	40%	0.396	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	10.7	178.8	64.8	-22.2	0	0	0	113.2	K39 R43	K39-D45 VanDerWaalsContact CE-O 3.3Å; K39-D45 WeakPolarHBondContact CE-O 3.35Å; K39-D45 WeakPolarHBondContact CE-OD1 3.23Å; K39-D45 WeakPolarHBondContact CE-OD2 3.41Å; K39-D45 PolarHBondContact NZ-O 3.05Å; K39-D45 IonicContact NZ-OD1 3.44Å; K39-D45 PolarHBondContact NZ-OD1 3.5Å; K39-D45 IonicContact NZ-OD2 2.72Å; K39-D45 PolarHBondContact NZ-OD2 3.35Å; R43-D45 WeakPolarHBondContact CB-OD1 3.35Å; R43-D45 IonicContact CZ-OD1 3.65Å; R43-D45 IonicContact CZ-OD2 3.88Å; R43-D45 IonicContact NE-OD1 2.92Å; R43-D45 PolarHBondContact NE-OD1 2.99Å; R43-D45 IonicContact NE-OD2 3.81Å; R43-D45 IonicContact NH2-OD1 3.47Å; R43-D45 PolarHBondContact NH2-OD1 2.78Å; R43-D45 IonicContact NH2-OD2 3.05Å; R43-D45 PolarHBondContact NH2-OD2 3.1Å; R43-D45 PolarHBondContact O-N 3.35Å
46	S	78.3	Confident	84.2	Confident	46 Å²	46	60.7 Å²	60.7	32%	0.322	32%	0.317	S	S	.	.			trans	-76.3	133.2	176.1	66.9	0	0	0	0	111.8	A41 R43	A41-S46 PolarHBondContact O-OG 3.27Å; R43-S46 WeakPolarHBondContact O-CB 3.46Å; R43-S46 PolarHBondContact O-N 3.24Å; R43-S46 PolarHBondContact O-OG 3.38Å
47	S	80.8	Confident	84.1	Confident	56 Å²	56	61.5 Å²	61.5	39%	0.392	32%	0.32	S	S	.	.			trans	-125.4	168.1	-179.4	85.3	0	0	0	0	111.6	E49 D50	S47-E49 PolarHBondContact O-N 3.07Å; S47-E49 WeakPolarHBondContact OG-CB 3.46Å; S47-E49 PolarHBondContact OG-N 3.12Å; S47-E49 VanDerWaalsContact OG-N 3.16Å; S47-D50 PolarHBondContact N-OD2 2.84Å; S47-D50 WeakPolarHBondContact O-CB 3.33Å; S47-D50 PolarHBondContact O-N 3.07Å
48	N	80.3	Confident	84.1	Confident	108 Å²	108	61.1 Å²	61.1	58%	0.578	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-65.9	-21	174.5	-159.7	-13.7	0	0	0	111.8	D50 V51 L52	N48-D50 VanDerWaalsContact C-N 3.31Å; N48-D50 PolarHBondContact O-N 3.1Å; N48-V51 WeakPolarHBondContact O-CG2 3.22Å; N48-V51 PolarHBondContact O-N 2.72Å; N48-V51 WeakPolarHBondContact OD1-CG2 3.41Å; N48-L52 WeakPolarHBondContact O-CG 3.48Å
49	E	83.3	Confident	84	Confident	117 Å²	117	64.5 Å²	64.5	55%	0.547	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-67.3	-33.5	178.6	-60	-174.5	171.1	0	0	112.1	P22 S47 V51 L52	P22-E49 HydrophobicContact CG-CB 4.33Å; S47-E49 PolarHBondContact O-N 3.07Å; S47-E49 WeakPolarHBondContact OG-CB 3.46Å; S47-E49 PolarHBondContact OG-N 3.12Å; S47-E49 VanDerWaalsContact OG-N 3.16Å; E49-V51 PolarHBondContact O-N 3.29Å; E49-L52 HydrophobicContact CB-CD1 4.27Å; E49-L52 HydrophobicContact CG-CD1 4.4Å; E49-L52 PolarHBondContact O-N 2.75Å
50	D	84.1	Confident	84.1	Confident	30 Å²	30	66 Å²	66	16%	0.16	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-64.1	-11.6	179.1	-64.1	-50.4	0	0	0	113.5	K39 S47 N48 F54	K39-D50 HydrophobicContact CB-CB 4.4Å; K39-D50 VanDerWaalsContact CD-OD2 3.32Å; K39-D50 WeakPolarHBondContact CD-OD2 3.29Å; S47-D50 PolarHBondContact N-OD2 2.84Å; S47-D50 WeakPolarHBondContact O-CB 3.33Å; S47-D50 PolarHBondContact O-N 3.07Å; N48-D50 VanDerWaalsContact C-N 3.31Å; N48-D50 PolarHBondContact O-N 3.1Å; D50-F54 WeakPolarHBondContact O-CE2 3.42Å
51	V	89.8	Confident	84.3	Confident	11 Å²	11	61.5 Å²	61.5	7%	0.067	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-118.3	-2.6	-173.5	-54.2	0	0	0	0	114	N48 E49 I53 F54 K55 P70 W73	N48-V51 WeakPolarHBondContact O-CG2 3.22Å; N48-V51 PolarHBondContact O-N 2.72Å; N48-V51 WeakPolarHBondContact OD1-CG2 3.41Å; E49-V51 PolarHBondContact O-N 3.29Å; V51-I53 PolarHBondContact O-N 3.09Å; V51-F54 HydrophobicContact CB-CD2 4.43Å; V51-F54 PolarHBondContact O-N 3.35Å; V51-F54 VanDerWaalsContact O-N 3.13Å; V51-K55 PolarHBondContact O-N 3.45Å; V51-P70 HydrophobicContact CB-CB 4.26Å; V51-P70 HydrophobicContact CG1-CB 3.74Å; V51-P70 HydrophobicContact CG1-CG 4.33Å; V51-P70 HydrophobicContact CG2-CG 4.45Å; V51-W73 HydrophobicContact CG2-CZ3 4.22Å
52	L	91	Very high	84.2	Confident	57 Å²	57	61.3 Å²	61.3	30%	0.298	33%	0.331	S	S	.	.	H	α-helix	trans	-60.8	-43.9	-171.1	-70	174.3	0	0	0	113.6	Y21 N48 E49 F54 K55 A56	Y21-L52 HydrophobicContact CD1-CB 3.73Å; Y21-L52 HydrophobicContact CE1-CB 4.24Å; N48-L52 WeakPolarHBondContact O-CG 3.48Å; E49-L52 HydrophobicContact CB-CD1 4.27Å; E49-L52 HydrophobicContact CG-CD1 4.4Å; E49-L52 PolarHBondContact O-N 2.75Å; L52-F54 VanDerWaalsContact C-N 3.29Å; L52-F54 PolarHBondContact O-N 3.39Å; L52-K55 PolarHBondContact O-N 2.86Å; L52-A56 VanDerWaalsContact O-CB 3.28Å; L52-A56 WeakPolarHBondContact O-CB 3.49Å; L52-A56 PolarHBondContact O-N 2.78Å
53	I	93.1	Very high	83.5	Confident	4 Å²	4	57.8 Å²	57.8	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-66	-34.7	179.1	-169.4	161.3	0	0	0	112	W11 L12 Y21 V24 I36 V51 W57 F77	W11-I53 HydrophobicContact CH2-CG1 4.03Å; W11-I53 HydrophobicContact CZ3-CG1 4.43Å; L12-I53 HydrophobicContact CD1-CD1 4Å; Y21-I53 HydrophobicContact CD1-CB 4.08Å; Y21-I53 HydrophobicContact CD2-CB 4.23Å; Y21-I53 HydrophobicContact CD2-CD1 4.07Å; Y21-I53 HydrophobicContact CD2-CG1 4.17Å; Y21-I53 HydrophobicContact CE2-CG1 4.4Å; Y21-I53 HydrophobicContact CG-CB 3.89Å; Y21-I53 HydrophobicContact CG-CD1 4.47Å; Y21-I53 HydrophobicContact CG-CG1 4.35Å; V24-I53 HydrophobicContact CB-CD1 4.34Å; V24-I53 HydrophobicContact CG1-CD1 3.73Å; V24-I53 HydrophobicContact CG2-CB 4.31Å; V24-I53 HydrophobicContact CG2-CD1 3.91Å; V24-I53 HydrophobicContact CG2-CG2 4.04Å; I36-I53 HydrophobicContact CD1-CD1 4.48Å; I36-I53 HydrophobicContact CG2-CG2 4.22Å; V51-I53 PolarHBondContact O-N 3.09Å; I53-W57 PolarHBondContact O-N 3.4Å; I53-F77 HydrophobicContact CD1-CZ 4.49Å; I53-F77 HydrophobicContact CG1-CE2 4.29Å; I53-F77 HydrophobicContact CG1-CZ 4.38Å
54	F	92.9	Very high	82.6	Confident	1 Å²	1	55.3 Å²	55.3	0%	0.004	31%	0.311	C	S	.	.	H	α-helix	trans	-71.1	-41.7	177.8	-50	-59.3	0	0	0	111.1	I36 W38 D50 V51 L52 W57 A58 W73 K74 F77	I36-F54 HydrophobicContact CG2-CE1 3.78Å; I36-F54 HydrophobicContact CG2-CE2 4.36Å; I36-F54 HydrophobicContact CG2-CZ 3.4Å; W38-F54 HydrophobicContact CE3-CE1 4.29Å; W38-F54 AromaticContact CE3-CZ 3.86Å; W38-F54 HydrophobicContact CE3-CZ 3.86Å; W38-F54 HydrophobicContact CH2-CE1 4.29Å; W38-F54 HydrophobicContact CH2-CZ 4.45Å; W38-F54 AromaticContact CZ3-CE1 3.67Å; W38-F54 HydrophobicContact CZ3-CE1 3.67Å; W38-F54 AromaticContact CZ3-CZ 3.7Å; W38-F54 HydrophobicContact CZ3-CZ 3.7Å; D50-F54 WeakPolarHBondContact O-CE2 3.42Å; V51-F54 HydrophobicContact CB-CD2 4.43Å; V51-F54 PolarHBondContact O-N 3.35Å; V51-F54 VanDerWaalsContact O-N 3.13Å; L52-F54 VanDerWaalsContact C-N 3.29Å; L52-F54 PolarHBondContact O-N 3.39Å; F54-W57 PolarHBondContact O-N 3.3Å; F54-A58 PolarHBondContact O-N 2.85Å; F54-W73 HydrophobicContact CB-CB 3.65Å; F54-K74 HydrophobicContact CD1-CG 4.24Å; F54-K74 HydrophobicContact CD2-CD 4.19Å; F54-K74 HydrophobicContact CD2-CG 3.39Å; F54-K74 HydrophobicContact CE1-CG 4.31Å; F54-K74 HydrophobicContact CE2-CD 4.07Å; F54-K74 HydrophobicContact CE2-CG 3.54Å; F54-K74 HydrophobicContact CG-CG 3.8Å; F54-K74 HydrophobicContact CZ-CG 3.98Å; F54-F77 HydrophobicContact CD1-CB 3.65Å; F54-F77 AromaticContact CD1-CD1 3.75Å; F54-F77 HydrophobicContact CD1-CD1 3.75Å; F54-F77 HydrophobicContact CD1-CD2 4Å; F54-F77 HydrophobicContact CD1-CE1 4.38Å; F54-F77 AromaticContact CD1-CG 3.54Å; F54-F77 HydrophobicContact CD1-CG 3.54Å; F54-F77 HydrophobicContact CE1-CB 4.3Å; F54-F77 AromaticContact CE1-CD1 3.7Å; F54-F77 HydrophobicContact CE1-CD1 3.7Å; F54-F77 HydrophobicContact CE1-CE1 4.17Å; F54-F77 HydrophobicContact CE1-CG 4Å
55	K	90.6	Very high	81.9	Confident	62 Å²	62	55.8 Å²	55.8	27%	0.27	30%	0.304	S	S	.	.	H	α-helix	trans	-61.7	-49.4	174.2	-173.2	180	-178.5	-172	0	111.2	V51 L52 W57 A58 E59 A66 W73	V51-K55 PolarHBondContact O-N 3.45Å; L52-K55 PolarHBondContact O-N 2.86Å; K55-W57 VanDerWaalsContact C-N 3.29Å; K55-W57 PolarHBondContact O-N 2.82Å; K55-A58 WeakPolarHBondContact O-CB 3.38Å; K55-A58 PolarHBondContact O-N 2.73Å; K55-E59 WeakPolarHBondContact CE-OE1 3.19Å; K55-E59 WeakPolarHBondContact O-CG 3.38Å; K55-E59 PolarHBondContact O-N 3Å; K55-A66 WeakPolarHBondContact CE-O 3.4Å; K55-W73 HydrophobicContact CB-CD2 4.18Å; K55-W73 HydrophobicContact CB-CE3 3.68Å; K55-W73 HydrophobicContact CB-CH2 4.03Å; K55-W73 HydrophobicContact CB-CZ2 4.44Å; K55-W73 HydrophobicContact CB-CZ3 3.62Å; K55-W73 HydrophobicContact CD-CH2 3.67Å; K55-W73 HydrophobicContact CD-CZ2 4.33Å; K55-W73 HydrophobicContact CD-CZ3 3.91Å; K55-W73 HydrophobicContact CG-CD2 4.47Å; K55-W73 HydrophobicContact CG-CE3 4.16Å; K55-W73 HydrophobicContact CG-CH2 3.6Å; K55-W73 HydrophobicContact CG-CZ2 3.88Å; K55-W73 HydrophobicContact CG-CZ3 3.75Å
56	A	91.1	Very high	80.9	Confident	12 Å²	12	54.2 Å²	54.2	10%	0.099	30%	0.301	C	S	.	.	H	α-helix	trans	-59.4	-40.8	179.3	0	0	0	0	0	111.6	W11 Y21 L52 E59 V60	W11-A56 HydrophobicContact CH2-CB 4.41Å; W11-A56 HydrophobicContact CZ2-CB 3.94Å; Y21-A56 HydrophobicContact CE1-CB 3.89Å; Y21-A56 VanDerWaalsContact OH-CB 3.23Å; Y21-A56 WeakPolarHBondContact OH-CB 3.46Å; L52-A56 VanDerWaalsContact O-CB 3.28Å; L52-A56 WeakPolarHBondContact O-CB 3.49Å; L52-A56 PolarHBondContact O-N 2.78Å; A56-E59 PolarHBondContact O-N 2.93Å; A56-V60 WeakPolarHBondContact O-CG1 3.27Å; A56-V60 WeakPolarHBondContact O-CG2 3.43Å; A56-V60 PolarHBondContact O-N 3.48Å; A56-V60 VanDerWaalsContact O-N 3.15Å
57	W	91.4	Very high	80.1	Confident	17 Å²	17	60.6 Å²	60.6	6%	0.064	33%	0.326	C	S	.	.	H	α-helix	trans	-64	-41.9	173.4	179.8	-116.5	0	0	0	112.5	P6 L8 W11 I53 F54 K55 E59 V60 S61 F77 A80	P6-W57 HydrophobicContact CG-CZ3 4.42Å; L8-W57 HydrophobicContact CB-CH2 3.53Å; L8-W57 HydrophobicContact CB-CZ2 3.78Å; L8-W57 HydrophobicContact CB-CZ3 4.22Å; L8-W57 HydrophobicContact CD1-CD2 3.67Å; L8-W57 VanDerWaalsContact CD1-CE2 3.47Å; L8-W57 HydrophobicContact CD1-CE3 3.82Å; L8-W57 HydrophobicContact CD1-CG 4.46Å; L8-W57 HydrophobicContact CD1-CH2 3.64Å; L8-W57 HydrophobicContact CD1-CZ2 3.46Å; L8-W57 VanDerWaalsContact CD1-CZ2 3.46Å; L8-W57 HydrophobicContact CD1-CZ3 3.8Å; L8-W57 HydrophobicContact CG-CH2 4.19Å; L8-W57 HydrophobicContact CG-CZ2 4.16Å; W11-W57 HydrophobicContact CB-CZ3 4.06Å; W11-W57 AromaticContact CD2-CE3 3.48Å; W11-W57 HydrophobicContact CD2-CE3 3.48Å; W11-W57 VanDerWaalsContact CD2-CE3 3.48Å; W11-W57 AromaticContact CD2-CZ3 3.83Å; W11-W57 HydrophobicContact CD2-CZ3 3.83Å; W11-W57 AromaticContact CE2-CE3 3.98Å; W11-W57 HydrophobicContact CE3-CD2 4.18Å; W11-W57 AromaticContact CE3-CE3 3.29Å; W11-W57 HydrophobicContact CE3-CE3 3.29Å; W11-W57 AromaticContact CE3-CZ3 3.83Å; W11-W57 HydrophobicContact CE3-CZ3 3.83Å; W11-W57 HydrophobicContact CG-CE3 4.07Å; W11-W57 AromaticContact CG-CZ3 3.93Å; W11-W57 HydrophobicContact CG-CZ3 3.93Å; W11-W57 HydrophobicContact CH2-CB 3.56Å; W11-W57 HydrophobicContact CH2-CE3 4.15Å; W11-W57 HydrophobicContact CH2-CG 4.42Å; W11-W57 HydrophobicContact CZ2-CB 4.16Å; W11-W57 HydrophobicContact CZ2-CE3 4.29Å; W11-W57 HydrophobicContact CZ3-CB 3.86Å; W11-W57 HydrophobicContact CZ3-CD2 4.17Å; W11-W57 AromaticContact CZ3-CE3 3.68Å; W11-W57 HydrophobicContact CZ3-CE3 3.68Å; W11-W57 HydrophobicContact CZ3-CG 4.28Å; I53-W57 PolarHBondContact O-N 3.4Å; F54-W57 PolarHBondContact O-N 3.3Å; K55-W57 VanDerWaalsContact C-N 3.29Å; K55-W57 PolarHBondContact O-N 2.82Å; W57-E59 VanDerWaalsContact C-N 3.34Å; W57-E59 PolarHBondContact O-N 2.69Å; W57-V60 HydrophobicContact CE3-CG2 3.72Å; W57-V60 HydrophobicContact CZ3-CG2 4.05Å; W57-V60 PolarHBondContact O-N 3.11Å; W57-S61 WeakPolarHBondContact O-CB 3.43Å; W57-S61 PolarHBondContact O-N 2.83Å; W57-S61 PolarHBondContact O-OG 3.42Å; W57-F77 HydrophobicContact CB-CD2 3.59Å; W57-F77 HydrophobicContact CB-CE2 3.86Å; W57-F77 AromaticContact CD1-CD2 3.58Å; W57-F77 AromaticContact CG-CD2 3.63Å; W57-F77 HydrophobicContact CG-CD2 3.63Å; W57-F77 HydrophobicContact CG-CE2 4.04Å; W57-A80 HydrophobicContact CZ2-CB 4.38Å
58	A	89.8	Confident	79.5	Confident	5 Å²	5	59 Å²	59	4%	0.041	32%	0.319	C	S	.	.	H	α-helix	trans	-61.9	-43.3	178.6	0	0	0	0	0	111.7	F54 K55 G62 W73	F54-A58 PolarHBondContact O-N 2.85Å; K55-A58 WeakPolarHBondContact O-CB 3.38Å; K55-A58 PolarHBondContact O-N 2.73Å; A58-G62 PolarHBondContact O-N 2.79Å; A58-W73 VanDerWaalsContact CB-CD1 3.44Å; A58-W73 HydrophobicContact CB-CG 4.06Å
59	E	87.5	Confident	79.5	Confident	101 Å²	101	59 Å²	59	47%	0.472	32%	0.319	S	S	.	.	H	α-helix	trans	-59.7	-47.4	176.8	-74	173.7	175.3	0	0	112	K55 A56 W57 A66	K55-E59 WeakPolarHBondContact CE-OE1 3.19Å; K55-E59 WeakPolarHBondContact O-CG 3.38Å; K55-E59 PolarHBondContact O-N 3Å; A56-E59 PolarHBondContact O-N 2.93Å; W57-E59 VanDerWaalsContact C-N 3.34Å; W57-E59 PolarHBondContact O-N 2.69Å; E59-A66 HydrophobicContact CG-CB 3.69Å
60	V	87.9	Confident	79.6	Confident	60 Å²	60	55.6 Å²	55.6	36%	0.364	31%	0.306	S	S	.	.	H	α-helix	trans	-82	-31.6	-174.6	-56.4	0	0	0	0	113.5	P6 W11 A56 W57	P6-V60 WeakPolarHBondContact CD-O 3.27Å; P6-V60 HydrophobicContact CG-CB 3.77Å; P6-V60 HydrophobicContact CG-CG2 3.68Å; W11-V60 HydrophobicContact CD2-CG2 4.31Å; W11-V60 HydrophobicContact CG-CG2 4.36Å; W11-V60 HydrophobicContact CZ2-CG2 4.26Å; A56-V60 WeakPolarHBondContact O-CG1 3.27Å; A56-V60 WeakPolarHBondContact O-CG2 3.43Å; A56-V60 PolarHBondContact O-N 3.48Å; A56-V60 VanDerWaalsContact O-N 3.15Å; W57-V60 HydrophobicContact CE3-CG2 3.72Å; W57-V60 HydrophobicContact CZ3-CG2 4.05Å; W57-V60 PolarHBondContact O-N 3.11Å
61	S	82.8	Confident	79.6	Confident	7 Å²	7	58.1 Å²	58.1	5%	0.049	33%	0.326	C	S	.	.	H	α-helix	trans	-83.3	-16	-176.2	65.1	0	0	0	0	113.4	W57 N63	W57-S61 WeakPolarHBondContact O-CB 3.43Å; W57-S61 PolarHBondContact O-N 2.83Å; W57-S61 PolarHBondContact O-OG 3.42Å; S61-N63 PolarHBondContact O-N 2.84Å; S61-N63 PolarHBondContact OG-N 2.74Å
62	G	70.1	Confident	79.4	Confident	61 Å²	61	59.7 Å²	59.7	63%	0.629	34%	0.336	S	S	*	.	S	Bend	trans	70.5	7.8	-174.8	0	0	0	0	0	114.1	A58 G64	A58-G62 PolarHBondContact O-N 2.79Å; G62-G64 VanDerWaalsContact C-N 3.33Å; G62-G64 PolarHBondContact O-N 3.19Å
63	N	61.2	Low	79.3	Confident	103 Å²	103	57.7 Å²	57.7	55%	0.551	32%	0.324	S	S	*	.	S	Bend	trans	-95.2	28.3	-178.6	-76.2	-17.7	0	0	0	113.1	S61 N76	S61-N63 PolarHBondContact O-N 2.84Å; S61-N63 PolarHBondContact OG-N 2.74Å; N63-N76 PolarHBondContact O-ND2 2.79Å
64	G	57.5	Low	79.2	Confident	24 Å²	24	58.6 Å²	58.6	25%	0.247	33%	0.328	C	S	.	.	S	Bend	trans	178.7	138.5	173.4	0	0	0	0	0	109.3	G62	G62-G64 VanDerWaalsContact C-N 3.33Å; G62-G64 PolarHBondContact O-N 3.19Å
65	R	58	Low	78.9	Confident	216 Å²	216	65.4 Å²	65.4	82%	0.815	35%	0.354	S	S	*	.			trans	-61.7	142.5	170.5	-64.7	-178.3	-178.2	180	0.7	107.8	Q67 G68 W73	R65-Q67 PolarHBondContact O-N 2.91Å; R65-G68 PolarHBondContact O-N 3.25Å; R65-W73 PolarHBondContact O-NE1 3.37Å
66	A	57.3	Low	78.9	Confident	40 Å²	40	64.9 Å²	64.9	33%	0.331	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-16.4	172.8	0	0	0	0	0	113	K55 E59 W73	K55-A66 WeakPolarHBondContact CE-O 3.4Å; E59-A66 HydrophobicContact CG-CB 3.69Å; A66-W73 VanDerWaalsContact O-CZ2 3.29Å; A66-W73 WeakPolarHBondContact O-CZ2 3.4Å
67	Q	60.9	Low	79	Confident	181 Å²	181	64.3 Å²	64.3	85%	0.846	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	17.7	174.7	-58.2	-65.7	-8.1	0	0	113.1	R65	R65-Q67 PolarHBondContact O-N 2.91Å
68	G	67.9	Low	79	Confident	23 Å²	23	66.8 Å²	66.8	24%	0.237	36%	0.359	C	S	.	.	S	Bend	trans	-80.2	169	179.5	0	0	0	0	0	113.6	R65 W73	R65-G68 PolarHBondContact O-N 3.25Å; G68-W73 VanDerWaalsContact O-CE2 3.27Å; G68-W73 VanDerWaalsContact O-CH2 3.28Å; G68-W73 WeakPolarHBondContact O-CH2 3.41Å; G68-W73 WeakPolarHBondContact O-CZ2 3.35Å
69	D	81.1	Confident	79	Confident	108 Å²	108	70 Å²	70	58%	0.578	38%	0.381	S	S	*	.			trans	-75.4	142.3	178.6	-58.9	-52.4	0	0	0	112	S71 V72 W73	D69-S71 PolarHBondContact O-N 2.82Å; D69-S71 VanDerWaalsContact O-N 3.1Å; D69-V72 HydrophobicContact CB-CG2 4.2Å; D69-V72 WeakPolarHBondContact O-CA 3.39Å; D69-V72 WeakPolarHBondContact O-CB 3.38Å; D69-V72 PolarHBondContact O-N 2.87Å; D69-W73 PolarHBondContact O-N 3Å; D69-W73 VanDerWaalsContact O-N 3.15Å
70	P	85.6	Confident	79.2	Confident	45 Å²	45	66.1 Å²	66.1	29%	0.292	37%	0.366	S	S	.	.	H	α-helix	trans	-52.7	-34.1	175.3	-31	36.8	0	0	0	114.9	V51 V72 W73 K74	V51-P70 HydrophobicContact CB-CB 4.26Å; V51-P70 HydrophobicContact CG1-CB 3.74Å; V51-P70 HydrophobicContact CG1-CG 4.33Å; V51-P70 HydrophobicContact CG2-CG 4.45Å; P70-V72 VanDerWaalsContact C-N 3.31Å; P70-V72 PolarHBondContact O-N 3.24Å; P70-W73 HydrophobicContact CB-CE3 4.4Å; P70-W73 HydrophobicContact CG-CE3 4.43Å; P70-W73 HydrophobicContact CG-CZ3 4.23Å; P70-W73 PolarHBondContact O-N 3.11Å; P70-K74 WeakPolarHBondContact O-CB 3.46Å; P70-K74 WeakPolarHBondContact O-CG 3.48Å; P70-K74 PolarHBondContact O-N 2.89Å
71	S	84.1	Confident	79.5	Confident	83 Å²	83	63.3 Å²	63.3	58%	0.58	35%	0.349	S	S	*	.	H	α-helix	trans	-63.1	-37.6	175.9	-62.6	0	0	0	0	112.2	D69 R75	D69-S71 PolarHBondContact O-N 2.82Å; D69-S71 VanDerWaalsContact O-N 3.1Å; S71-R75 WeakPolarHBondContact O-CB 3.28Å; S71-R75 PolarHBondContact O-N 3.2Å; S71-R75 VanDerWaalsContact O-N 3.1Å
72	V	84.7	Confident	79.8	Confident	44 Å²	44	70.7 Å²	70.7	27%	0.267	38%	0.376	S	S	.	.	H	α-helix	trans	-71.1	-45.2	177.1	177.5	0	0	0	0	110.3	D69 P70 K74 R75 N76	D69-V72 HydrophobicContact CB-CG2 4.2Å; D69-V72 WeakPolarHBondContact O-CA 3.39Å; D69-V72 WeakPolarHBondContact O-CB 3.38Å; D69-V72 PolarHBondContact O-N 2.87Å; P70-V72 VanDerWaalsContact C-N 3.31Å; P70-V72 PolarHBondContact O-N 3.24Å; V72-K74 PolarHBondContact O-N 3.49Å; V72-R75 PolarHBondContact O-N 3.31Å; V72-N76 VanDerWaalsContact O-CG 3.27Å; V72-N76 PolarHBondContact O-N 2.87Å; V72-N76 PolarHBondContact O-OD1 3.38Å
73	W	89.4	Confident	80.6	Confident	15 Å²	15	71.7 Å²	71.7	6%	0.057	38%	0.379	C	S	.	.	H	α-helix	trans	-60.4	-46.3	177.3	-57.6	-29.2	0	0	0	112	V51 F54 K55 A58 R65 A66 G68 D69 P70 R75 N76 F77	V51-W73 HydrophobicContact CG2-CZ3 4.22Å; F54-W73 HydrophobicContact CB-CB 3.65Å; K55-W73 HydrophobicContact CB-CD2 4.18Å; K55-W73 HydrophobicContact CB-CE3 3.68Å; K55-W73 HydrophobicContact CB-CH2 4.03Å; K55-W73 HydrophobicContact CB-CZ2 4.44Å; K55-W73 HydrophobicContact CB-CZ3 3.62Å; K55-W73 HydrophobicContact CD-CH2 3.67Å; K55-W73 HydrophobicContact CD-CZ2 4.33Å; K55-W73 HydrophobicContact CD-CZ3 3.91Å; K55-W73 HydrophobicContact CG-CD2 4.47Å; K55-W73 HydrophobicContact CG-CE3 4.16Å; K55-W73 HydrophobicContact CG-CH2 3.6Å; K55-W73 HydrophobicContact CG-CZ2 3.88Å; K55-W73 HydrophobicContact CG-CZ3 3.75Å; A58-W73 VanDerWaalsContact CB-CD1 3.44Å; A58-W73 HydrophobicContact CB-CG 4.06Å; R65-W73 PolarHBondContact O-NE1 3.37Å; A66-W73 VanDerWaalsContact O-CZ2 3.29Å; A66-W73 WeakPolarHBondContact O-CZ2 3.4Å; G68-W73 VanDerWaalsContact O-CE2 3.27Å; G68-W73 VanDerWaalsContact O-CH2 3.28Å; G68-W73 WeakPolarHBondContact O-CH2 3.41Å; G68-W73 WeakPolarHBondContact O-CZ2 3.35Å; D69-W73 PolarHBondContact O-N 3Å; D69-W73 VanDerWaalsContact O-N 3.15Å; P70-W73 HydrophobicContact CB-CE3 4.4Å; P70-W73 HydrophobicContact CG-CE3 4.43Å; P70-W73 HydrophobicContact CG-CZ3 4.23Å; P70-W73 PolarHBondContact O-N 3.11Å; W73-R75 VanDerWaalsContact C-N 3.35Å; W73-R75 PolarHBondContact O-N 3.09Å; W73-N76 PolarHBondContact O-N 2.95Å; W73-F77 VanDerWaalsContact O-CB 3.26Å; W73-F77 WeakPolarHBondContact O-CB 3.31Å; W73-F77 PolarHBondContact O-N 3.26Å
74	K	90.4	Very high	82	Confident	22 Å²	22	71.3 Å²	71.3	10%	0.096	37%	0.372	C	S	.	.	H	α-helix	trans	-58.7	-43.5	175.5	-78.1	173.7	173.7	168.9	0	112.1	W38 K39 F54 P70 V72 R78	W38-K74 HydrophobicContact CH2-CB 4.28Å; W38-K74 HydrophobicContact CZ2-CB 4.18Å; K39-K74 PolarHBondContact O-NZ 3.35Å; F54-K74 HydrophobicContact CD1-CG 4.24Å; F54-K74 HydrophobicContact CD2-CD 4.19Å; F54-K74 HydrophobicContact CD2-CG 3.39Å; F54-K74 HydrophobicContact CE1-CG 4.31Å; F54-K74 HydrophobicContact CE2-CD 4.07Å; F54-K74 HydrophobicContact CE2-CG 3.54Å; F54-K74 HydrophobicContact CG-CG 3.8Å; F54-K74 HydrophobicContact CZ-CG 3.98Å; P70-K74 WeakPolarHBondContact O-CB 3.46Å; P70-K74 WeakPolarHBondContact O-CG 3.48Å; P70-K74 PolarHBondContact O-N 2.89Å; V72-K74 PolarHBondContact O-N 3.49Å; K74-R78 WeakPolarHBondContact O-CB 3.18Å; K74-R78 PolarHBondContact O-N 3.34Å
75	R	88.4	Confident	83.6	Confident	144 Å²	144	72 Å²	72	54%	0.543	38%	0.379	S	S	.	.	H	α-helix	trans	-62.3	-47.9	177.2	-178.7	175.4	65.8	-178.9	-1.7	111.7	S71 V72 W73 R78 S79	S71-R75 WeakPolarHBondContact O-CB 3.28Å; S71-R75 PolarHBondContact O-N 3.2Å; S71-R75 VanDerWaalsContact O-N 3.1Å; V72-R75 PolarHBondContact O-N 3.31Å; W73-R75 VanDerWaalsContact C-N 3.35Å; W73-R75 PolarHBondContact O-N 3.09Å; R75-R78 PolarHBondContact O-N 2.84Å; R75-S79 PolarHBondContact O-N 2.86Å
76	N	89.7	Confident	85.3	Confident	52 Å²	52	62.3 Å²	62.3	28%	0.278	34%	0.343	S	S	.	.	H	α-helix	trans	-68.7	-40.2	-177.1	-66.7	-2.5	0	0	0	111.5	N63 V72 W73 S79 A80	N63-N76 PolarHBondContact O-ND2 2.79Å; V72-N76 VanDerWaalsContact O-CG 3.27Å; V72-N76 PolarHBondContact O-N 2.87Å; V72-N76 PolarHBondContact O-OD1 3.38Å; W73-N76 PolarHBondContact O-N 2.95Å; N76-S79 WeakPolarHBondContact O-CB 3.49Å; N76-S79 PolarHBondContact O-N 2.78Å; N76-A80 PolarHBondContact O-N 3.06Å
77	F	92.7	Very high	87	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-60.7	-47.2	174.6	-168.7	-89.3	0	0	0	112	W11 L12 I36 I53 F54 W57 W73 S79 A80 L81	W11-F77 HydrophobicContact CH2-CE2 4.44Å; W11-F77 AromaticContact CZ3-CE2 3.93Å; W11-F77 HydrophobicContact CZ3-CE2 3.93Å; L12-F77 HydrophobicContact CD1-CE2 4.48Å; L12-F77 HydrophobicContact CD1-CZ 3.82Å; L12-F77 HydrophobicContact CD2-CZ 4.49Å; I36-F77 HydrophobicContact CD1-CD1 4.43Å; I36-F77 HydrophobicContact CD1-CE1 3.36Å; I36-F77 HydrophobicContact CD1-CZ 3.72Å; I53-F77 HydrophobicContact CD1-CZ 4.49Å; I53-F77 HydrophobicContact CG1-CE2 4.29Å; I53-F77 HydrophobicContact CG1-CZ 4.38Å; F54-F77 HydrophobicContact CD1-CB 3.65Å; F54-F77 AromaticContact CD1-CD1 3.75Å; F54-F77 HydrophobicContact CD1-CD1 3.75Å; F54-F77 HydrophobicContact CD1-CD2 4Å; F54-F77 HydrophobicContact CD1-CE1 4.38Å; F54-F77 AromaticContact CD1-CG 3.54Å; F54-F77 HydrophobicContact CD1-CG 3.54Å; F54-F77 HydrophobicContact CE1-CB 4.3Å; F54-F77 AromaticContact CE1-CD1 3.7Å; F54-F77 HydrophobicContact CE1-CD1 3.7Å; F54-F77 HydrophobicContact CE1-CE1 4.17Å; F54-F77 HydrophobicContact CE1-CG 4Å; W57-F77 HydrophobicContact CB-CD2 3.59Å; W57-F77 HydrophobicContact CB-CE2 3.86Å; W57-F77 AromaticContact CD1-CD2 3.58Å; W57-F77 AromaticContact CG-CD2 3.63Å; W57-F77 HydrophobicContact CG-CD2 3.63Å; W57-F77 HydrophobicContact CG-CE2 4.04Å; W73-F77 VanDerWaalsContact O-CB 3.26Å; W73-F77 WeakPolarHBondContact O-CB 3.31Å; W73-F77 PolarHBondContact O-N 3.26Å; F77-S79 VanDerWaalsContact C-N 3.28Å; F77-S79 PolarHBondContact O-N 2.87Å; F77-A80 WeakPolarHBondContact O-CB 3.47Å; F77-A80 PolarHBondContact O-N 3.09Å; F77-A80 VanDerWaalsContact O-N 3.12Å; F77-L81 HydrophobicContact CD1-CD1 3.9Å; F77-L81 HydrophobicContact CD1-CG 4.09Å; F77-L81 HydrophobicContact CE1-CD1 3.66Å; F77-L81 HydrophobicContact CE1-CD2 4.17Å; F77-L81 HydrophobicContact CE1-CG 3.9Å; F77-L81 PolarHBondContact O-N 3.28Å
78	R	92.6	Very high	88.5	Confident	68 Å²	68	62.7 Å²	62.7	26%	0.257	34%	0.336	S	S	.	.	H	α-helix	trans	-59.1	-40	175.1	-178.5	173.6	57.2	78.1	-3.1	112.3	W38 K74 R75 A80 R82	W38-R78 HydrophobicContact CH2-CB 4Å; K74-R78 WeakPolarHBondContact O-CB 3.18Å; K74-R78 PolarHBondContact O-N 3.34Å; R75-R78 PolarHBondContact O-N 2.84Å; R78-A80 VanDerWaalsContact C-N 3.35Å; R78-R82 WeakPolarHBondContact O-CG 3.36Å; R78-R82 PolarHBondContact O-N 2.88Å; R78-R82 VanDerWaalsContact O-N 3.13Å
79	S	89.2	Confident	89.6	Confident	72 Å²	72	64.8 Å²	64.8	50%	0.503	34%	0.344	S	S	.	.	H	α-helix	trans	-63.9	-42.5	175.9	-164.6	0	0	0	0	111.5	R75 N76 F77 R82 A83	R75-S79 PolarHBondContact O-N 2.86Å; N76-S79 WeakPolarHBondContact O-CB 3.49Å; N76-S79 PolarHBondContact O-N 2.78Å; F77-S79 VanDerWaalsContact C-N 3.28Å; F77-S79 PolarHBondContact O-N 2.87Å; S79-R82 PolarHBondContact O-N 2.94Å; S79-A83 WeakPolarHBondContact O-CB 3.13Å; S79-A83 PolarHBondContact O-N 2.8Å
80	A	91.6	Very high	90	Very high	21 Å²	21	61.4 Å²	61.4	17%	0.174	33%	0.329	C	S	.	.	H	α-helix	trans	-63.4	-42.4	178.9	0	0	0	0	0	111.6	L8 W57 N76 F77 R78 A83 K84	L8-A80 HydrophobicContact CD1-CB 4.3Å; L8-A80 HydrophobicContact CD2-CB 3.62Å; L8-A80 WeakPolarHBondContact CD2-O 3.1Å; W57-A80 HydrophobicContact CZ2-CB 4.38Å; N76-A80 PolarHBondContact O-N 3.06Å; F77-A80 WeakPolarHBondContact O-CB 3.47Å; F77-A80 PolarHBondContact O-N 3.09Å; F77-A80 VanDerWaalsContact O-N 3.12Å; R78-A80 VanDerWaalsContact C-N 3.35Å; A80-A83 PolarHBondContact O-N 2.79Å; A80-K84 WeakPolarHBondContact O-CG 3.29Å; A80-K84 PolarHBondContact O-N 2.81Å; A80-K84 VanDerWaalsContact O-N 3.15Å
81	L	93.3	Very high	90.1	Very high	1 Å²	1	62.4 Å²	62.4	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-58.2	-49.6	173.3	-70.8	-179.2	0	0	0	111.7	L8 L12 F34 F77 A83 K84 G85 F86 Y103	L8-L81 HydrophobicContact CD2-CD2 4.3Å; L12-L81 HydrophobicContact CD2-CD2 3.58Å; F34-L81 HydrophobicContact CZ-CD2 4.09Å; F77-L81 HydrophobicContact CD1-CD1 3.9Å; F77-L81 HydrophobicContact CD1-CG 4.09Å; F77-L81 HydrophobicContact CE1-CD1 3.66Å; F77-L81 HydrophobicContact CE1-CD2 4.17Å; F77-L81 HydrophobicContact CE1-CG 3.9Å; F77-L81 PolarHBondContact O-N 3.28Å; L81-A83 PolarHBondContact O-N 3.08Å; L81-K84 CarbonylContact O-C 3.54Å; L81-K84 PolarHBondContact O-N 3.48Å; L81-K84 VanDerWaalsContact O-N 3.15Å; L81-G85 PolarHBondContact O-N 2.72Å; L81-F86 HydrophobicContact CB-CB 4.06Å; L81-F86 HydrophobicContact CB-CD2 4.32Å; L81-F86 HydrophobicContact CB-CG 4.35Å; L81-F86 HydrophobicContact CD2-CB 4.32Å; L81-F86 HydrophobicContact CD2-CD1 4.12Å; L81-F86 HydrophobicContact CD2-CD2 3.8Å; L81-F86 HydrophobicContact CD2-CE1 4.34Å; L81-F86 HydrophobicContact CD2-CE2 4.05Å; L81-F86 HydrophobicContact CD2-CG 3.82Å; L81-F86 HydrophobicContact CD2-CZ 4.31Å; L81-F86 WeakPolarHBondContact O-CB 3.44Å; L81-F86 VanDerWaalsContact O-CD2 3.29Å; L81-F86 WeakPolarHBondContact O-CD2 3.44Å; L81-F86 PolarHBondContact O-N 2.94Å; L81-F86 VanDerWaalsContact O-N 3.13Å; L81-Y103 HydrophobicContact CD1-CD1 4Å; L81-Y103 HydrophobicContact CD1-CD2 4.12Å; L81-Y103 HydrophobicContact CD1-CE1 3.82Å; L81-Y103 HydrophobicContact CD1-CE2 3.95Å; L81-Y103 HydrophobicContact CD1-CG 4.13Å
82	R	89.3	Confident	90.2	Very high	161 Å²	161	61.3 Å²	61.3	61%	0.608	32%	0.32	S	S	*	.	H	α-helix	trans	-60.7	-44.5	178.9	-72.3	179.8	-179.3	179.5	-3.2	112.2	R78 S79 K84 G85	R78-R82 WeakPolarHBondContact O-CG 3.36Å; R78-R82 PolarHBondContact O-N 2.88Å; R78-R82 VanDerWaalsContact O-N 3.13Å; S79-R82 PolarHBondContact O-N 2.94Å; R82-K84 PolarHBondContact O-N 3.11Å; R82-G85 PolarHBondContact O-N 2.78Å; R82-G85 VanDerWaalsContact O-N 3.09Å
83	A	87.4	Confident	90	Very high	83 Å²	83	62.7 Å²	62.7	69%	0.686	32%	0.322	S	S	*	.	H	α-helix	trans	-63.8	-22	179.2	0	0	0	0	0	113.4	S79 A80 L81	S79-A83 WeakPolarHBondContact O-CB 3.13Å; S79-A83 PolarHBondContact O-N 2.8Å; A80-A83 PolarHBondContact O-N 2.79Å; L81-A83 PolarHBondContact O-N 3.08Å
84	K	90.4	Very high	89.3	Confident	94 Å²	94	68.4 Å²	68.4	41%	0.409	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	9.4	177	-68.9	-62.2	-175.9	-176.4	0	113.8	L8 I9 A80 L81 R82 F86 P106	L8-K84 HydrophobicContact CB-CG 4.21Å; L8-K84 HydrophobicContact CD2-CB 4.16Å; L8-K84 HydrophobicContact CD2-CG 3.79Å; I9-K84 HydrophobicContact CD1-CB 4.19Å; I9-K84 HydrophobicContact CD1-CD 4.28Å; I9-K84 HydrophobicContact CG1-CB 4.21Å; I9-K84 HydrophobicContact CG1-CG 4.4Å; A80-K84 WeakPolarHBondContact O-CG 3.29Å; A80-K84 PolarHBondContact O-N 2.81Å; A80-K84 VanDerWaalsContact O-N 3.15Å; L81-K84 CarbonylContact O-C 3.54Å; L81-K84 PolarHBondContact O-N 3.48Å; L81-K84 VanDerWaalsContact O-N 3.15Å; R82-K84 PolarHBondContact O-N 3.11Å; K84-F86 HydrophobicContact CB-CD2 3.77Å; K84-F86 HydrophobicContact CB-CE2 3.69Å; K84-P106 WeakPolarHBondContact O-CG 3.33Å
85	G	90.4	Very high	88.8	Confident	39 Å²	39	70.4 Å²	70.4	40%	0.402	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	13.6	173.2	0	0	0	0	0	115.1	L81 R82	L81-G85 PolarHBondContact O-N 2.72Å; R82-G85 PolarHBondContact O-N 2.78Å; R82-G85 VanDerWaalsContact O-N 3.09Å
86	F	94	Very high	88	Confident	12 Å²	12	67.4 Å²	67.4	5%	0.053	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-68.1	133.4	172.8	-69.5	-96.5	0	0	0	110.6	L8 I9 L12 F34 L81 K84 R104 W105	L8-F86 HydrophobicContact CD2-CE2 4.31Å; I9-F86 HydrophobicContact CG1-CE2 3.81Å; I9-F86 HydrophobicContact CG1-CZ 3.98Å; L12-F86 HydrophobicContact CD2-CE1 4.08Å; L12-F86 HydrophobicContact CD2-CZ 3.93Å; F34-F86 AromaticContact CE1-CD1 3.65Å; F34-F86 HydrophobicContact CE1-CD1 3.65Å; F34-F86 AromaticContact CE1-CE1 3.61Å; F34-F86 HydrophobicContact CE1-CE1 3.61Å; F34-F86 HydrophobicContact CZ-CD1 4.03Å; F34-F86 HydrophobicContact CZ-CE1 4.1Å; L81-F86 HydrophobicContact CB-CB 4.06Å; L81-F86 HydrophobicContact CB-CD2 4.32Å; L81-F86 HydrophobicContact CB-CG 4.35Å; L81-F86 HydrophobicContact CD2-CB 4.32Å; L81-F86 HydrophobicContact CD2-CD1 4.12Å; L81-F86 HydrophobicContact CD2-CD2 3.8Å; L81-F86 HydrophobicContact CD2-CE1 4.34Å; L81-F86 HydrophobicContact CD2-CE2 4.05Å; L81-F86 HydrophobicContact CD2-CG 3.82Å; L81-F86 HydrophobicContact CD2-CZ 4.31Å; L81-F86 WeakPolarHBondContact O-CB 3.44Å; L81-F86 VanDerWaalsContact O-CD2 3.29Å; L81-F86 WeakPolarHBondContact O-CD2 3.44Å; L81-F86 PolarHBondContact O-N 2.94Å; L81-F86 VanDerWaalsContact O-N 3.13Å; K84-F86 HydrophobicContact CB-CD2 3.77Å; K84-F86 HydrophobicContact CB-CE2 3.69Å; F86-R104 WeakPolarHBondContact CA-O 3.46Å; F86-W105 HydrophobicContact CD1-CE3 4.41Å; F86-W105 AromaticContact CE1-CD2 3.58Å; F86-W105 HydrophobicContact CE1-CD2 3.58Å; F86-W105 AromaticContact CE1-CE2 4Å; F86-W105 AromaticContact CE1-CE3 3.44Å; F86-W105 HydrophobicContact CE1-CE3 3.44Å; F86-W105 VanDerWaalsContact CE1-CE3 3.44Å; F86-W105 HydrophobicContact CE1-CG 4.16Å; F86-W105 HydrophobicContact CE1-CH2 4.07Å; F86-W105 HydrophobicContact CE1-CZ2 4.25Å; F86-W105 AromaticContact CE1-CZ3 3.68Å; F86-W105 HydrophobicContact CE1-CZ3 3.68Å; F86-W105 HydrophobicContact CZ-CD2 4.05Å; F86-W105 AromaticContact CZ-CE2 3.97Å; F86-W105 HydrophobicContact CZ-CE3 4.15Å; F86-W105 HydrophobicContact CZ-CH2 4.03Å; F86-W105 AromaticContact CZ-CZ2 3.99Å; F86-W105 HydrophobicContact CZ-CZ2 3.99Å; F86-W105 HydrophobicContact CZ-CZ3 4.12Å
87	K	92.7	Very high	87.2	Confident	156 Å²	156	69.2 Å²	69.2	68%	0.678	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	135.7	178.3	-65.6	-178.9	-179.2	175.6	0	110	V89 Y103 R104	K87-V89 PolarHBondContact O-N 3.49Å; K87-Y103 CarbonylContact O-C 3.15Å; K87-Y103 VanDerWaalsContact O-CA 3.29Å; K87-Y103 WeakPolarHBondContact O-CA 3.4Å; K87-R104 PolarHBondContact N-O 2.85Å; K87-R104 VanDerWaalsContact N-O 3.1Å; K87-R104 PolarHBondContact O-N 2.72Å
88	M	94.3	Very high	86.6	Confident	73 Å²	73	73.3 Å²	73.3	36%	0.36	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	119.6	173.7	-172.8	-179.2	-60	0	0	108.7	D91 K101 Y103	M88-D91 HydrophobicContact SD-CB 3.93Å; M88-K101 HydrophobicContact CE-CD 3.91Å; M88-K101 HydrophobicContact SD-CD 4.22Å; M88-Y103 HydrophobicContact CB-CD1 4.1Å; M88-Y103 HydrophobicContact CB-CE1 4.02Å; M88-Y103 HydrophobicContact CE-CE1 3.7Å; M88-Y103 WeakPolarHBondContact CE-OH 3.5Å; M88-Y103 HydrophobicContact CG-CD1 4.47Å; M88-Y103 HydrophobicContact CG-CE1 4.2Å
89	V	90.4	Very high	86.3	Confident	67 Å²	67	70.4 Å²	70.4	41%	0.406	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-36.9	-178.9	-177.5	0	0	0	0	110.7	K87 V102 R104	K87-V89 PolarHBondContact O-N 3.49Å; V89-V102 HydrophobicContact CB-CG1 4.35Å; V89-V102 PolarHBondContact N-O 3.3Å; V89-R104 HydrophobicContact CG2-CB 3.55Å
90	S	88.4	Confident	86.4	Confident	38 Å²	38	68.5 Å²	68.5	27%	0.266	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	138.8	-178.9	-171	0	0	0	0	111.6	N92 K101 V102	S90-N92 PolarHBondContact OG-ND2 2.91Å; S90-N92 VanDerWaalsContact OG-ND2 3.12Å; S90-N92 PolarHBondContact OG-OD1 2.97Å; S90-K101 WeakPolarHBondContact O-CA 3.47Å; S90-V102 PolarHBondContact N-O 2.81Å; S90-V102 PolarHBondContact O-N 3.33Å
91	D	88.8	Confident	86.5	Confident	66 Å²	66	68.1 Å²	68.1	35%	0.353	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	87.4	174.2	-168.8	-8.1	0	0	0	110	M88 K93 K101	M88-D91 HydrophobicContact SD-CB 3.93Å; D91-K93 VanDerWaalsContact C-N 3.31Å; D91-K93 VanDerWaalsContact OD1-CB 3.23Å; D91-K93 WeakPolarHBondContact OD1-CB 3.4Å; D91-K93 WeakPolarHBondContact OD1-CD 3.47Å; D91-K93 WeakPolarHBondContact OD1-CG 3.33Å; D91-K93 PolarHBondContact OD1-N 2.79Å; D91-K93 IonicContact OD2-NZ 2.67Å; D91-K101 VanDerWaalsContact CG-NZ 3.27Å; D91-K101 WeakPolarHBondContact OD1-CE 3.28Å; D91-K101 IonicContact OD1-NZ 3.5Å; D91-K101 PolarHBondContact OD1-NZ 3Å; D91-K101 IonicContact OD2-NZ 2.79Å; D91-K101 PolarHBondContact OD2-NZ 3.47Å
92	N	86.8	Confident	86.5	Confident	60 Å²	60	68.8 Å²	68.8	32%	0.321	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	30.2	177.1	-60.4	-40	0	0	0	111.4	S90 N94 D95 P99 H100	S90-N92 PolarHBondContact OG-ND2 2.91Å; S90-N92 VanDerWaalsContact OG-ND2 3.12Å; S90-N92 PolarHBondContact OG-OD1 2.97Å; N92-N94 PolarHBondContact O-N 2.81Å; N92-D95 VanDerWaalsContact O-CB 3.29Å; N92-D95 WeakPolarHBondContact O-CB 3.03Å; N92-D95 PolarHBondContact O-N 3.29Å; N92-D95 VanDerWaalsContact O-N 3.15Å; N92-P99 WeakPolarHBondContact O-CA 3.44Å; N92-H100 CarbonylContact C-O 3.53Å; N92-H100 VanDerWaalsContact CA-O 3.27Å; N92-H100 WeakPolarHBondContact CA-O 3.44Å; N92-H100 WeakPolarHBondContact CB-O 3.24Å; N92-H100 PolarHBondContact N-O 2.96Å; N92-H100 PolarHBondContact ND2-CE1 2.67Å; N92-H100 PolarHBondContact ND2-NE2 3.47Å; N92-H100 PolarHBondContact O-N 2.81Å
93	K	79.5	Confident	86.8	Confident	72 Å²	72	61.4 Å²	61.4	31%	0.313	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-21	-178.6	74.2	-172	177.4	-158.3	0	114.2	D91 H100	D91-K93 VanDerWaalsContact C-N 3.31Å; D91-K93 VanDerWaalsContact OD1-CB 3.23Å; D91-K93 WeakPolarHBondContact OD1-CB 3.4Å; D91-K93 WeakPolarHBondContact OD1-CD 3.47Å; D91-K93 WeakPolarHBondContact OD1-CG 3.33Å; D91-K93 PolarHBondContact OD1-N 2.79Å; D91-K93 IonicContact OD2-NZ 2.67Å; K93-H100 PolarHBondContact N-O 3.05Å
94	N	75.8	Confident	87.2	Confident	136 Å²	136	62.9 Å²	62.9	73%	0.727	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-0.5	-179.8	-67.4	-17.1	0	0	0	112.7	N92 A96	N92-N94 PolarHBondContact O-N 2.81Å; N94-A96 PolarHBondContact O-N 3.19Å
95	D	78.8	Confident	87.3	Confident	64 Å²	64	60.5 Å²	60.5	34%	0.342	34%	0.336	S	S	.	.			trans	-59.6	128.4	175.8	-172	-47.1	0	0	0	109.9	N92 A97 N98 P99	N92-D95 VanDerWaalsContact O-CB 3.29Å; N92-D95 WeakPolarHBondContact O-CB 3.03Å; N92-D95 PolarHBondContact O-N 3.29Å; N92-D95 VanDerWaalsContact O-N 3.15Å; D95-A97 VanDerWaalsContact C-N 3.33Å; D95-A97 PolarHBondContact O-N 2.71Å; D95-A97 PolarHBondContact OD1-N 3.28Å; D95-N98 PolarHBondContact OD1-N 2.83Å; D95-P99 WeakPolarHBondContact O-CD 3.42Å; D95-P99 VanDerWaalsContact O-CG 3.27Å; D95-P99 WeakPolarHBondContact O-CG 3.37Å
96	A	71.3	Confident	87.3	Confident	80 Å²	80	60.4 Å²	60.4	66%	0.661	33%	0.328	S	S	*	.	S	Bend	trans	-68.3	-33.9	-176.4	0	0	0	0	0	112.4	R43 N94	R43-A96 PolarHBondContact NH2-O 3.39Å; N94-A96 PolarHBondContact O-N 3.19Å
97	A	73.5	Confident	86.7	Confident	91 Å²	91	68.4 Å²	68.4	75%	0.752	37%	0.365	S	S	*	.	S	Bend	trans	-96.6	-40.2	-173.9	0	0	0	0	0	112.6	D95	D95-A97 VanDerWaalsContact C-N 3.33Å; D95-A97 PolarHBondContact O-N 2.71Å; D95-A97 PolarHBondContact OD1-N 3.28Å
98	N	79.3	Confident	85.4	Confident	86 Å²	86	70.1 Å²	70.1	46%	0.46	38%	0.376	S	S	.	.			trans	-140.3	79.1	-178	-173.3	20.4	0	0	0	112.8	D95 H100	D95-N98 PolarHBondContact OD1-N 2.83Å; N98-H100 PolarHBondContact O-N 2.9Å; N98-H100 VanDerWaalsContact O-N 3.09Å; N98-H100 PolarHBondContact O-ND1 3.5Å
99	P	87.8	Confident	83	Confident	6 Å²	6	72.1 Å²	72.1	4%	0.039	40%	0.397	C	S	.	.			trans	-60.2	109.7	173.9	-22.1	30.9	0	0	0	112.4	W38 K39 N92 D95	W38-P99 PolarHBondContact N-O 3.19Å; K39-P99 HydrophobicContact CB-CB 4.47Å; K39-P99 HydrophobicContact CG-CG 4.21Å; N92-P99 WeakPolarHBondContact O-CA 3.44Å; D95-P99 WeakPolarHBondContact O-CD 3.42Å; D95-P99 VanDerWaalsContact O-CG 3.27Å; D95-P99 WeakPolarHBondContact O-CG 3.37Å
100	H	90.4	Very high	80.4	Confident	32 Å²	32	73.8 Å²	73.8	15%	0.148	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	167.2	-179.2	68.3	-80.1	0	0	0	113.2	I36 N92 K93 N98	I36-H100 CarbonylContact O-C 3.56Å; I36-H100 WeakPolarHBondContact O-CA 3.28Å; N92-H100 CarbonylContact C-O 3.53Å; N92-H100 VanDerWaalsContact CA-O 3.27Å; N92-H100 WeakPolarHBondContact CA-O 3.44Å; N92-H100 WeakPolarHBondContact CB-O 3.24Å; N92-H100 PolarHBondContact N-O 2.96Å; N92-H100 PolarHBondContact ND2-CE1 2.67Å; N92-H100 PolarHBondContact ND2-NE2 3.47Å; N92-H100 PolarHBondContact O-N 2.81Å; K93-H100 PolarHBondContact N-O 3.05Å; N98-H100 PolarHBondContact O-N 2.9Å; N98-H100 VanDerWaalsContact O-N 3.09Å; N98-H100 PolarHBondContact O-ND1 3.5Å
101	K	94	Very high	78.2	Confident	13 Å²	13	77.8 Å²	77.8	6%	0.057	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	142.6	172.9	-66.2	-171.6	178.6	-139.8	0	110.4	C35 I36 W38 M88 S90 D91 Y103	C35-K101 CarbonylContact C-O 3.51Å; C35-K101 VanDerWaalsContact CA-O 3.26Å; C35-K101 WeakPolarHBondContact CA-O 3.35Å; I36-K101 PolarHBondContact N-O 3.2Å; I36-K101 PolarHBondContact O-N 3.07Å; W38-K101 HydrophobicContact CB-CD 4.15Å; W38-K101 HydrophobicContact CB-CG 3.83Å; W38-K101 HydrophobicContact CD2-CD 3.67Å; W38-K101 HydrophobicContact CD2-CG 4.27Å; W38-K101 HydrophobicContact CE3-CD 3.93Å; W38-K101 HydrophobicContact CE3-CG 4.44Å; W38-K101 HydrophobicContact CG-CD 3.75Å; W38-K101 VanDerWaalsContact CG-CE 3.47Å; W38-K101 HydrophobicContact CG-CG 4Å; M88-K101 HydrophobicContact CE-CD 3.91Å; M88-K101 HydrophobicContact SD-CD 4.22Å; S90-K101 WeakPolarHBondContact O-CA 3.47Å; D91-K101 VanDerWaalsContact CG-NZ 3.27Å; D91-K101 WeakPolarHBondContact OD1-CE 3.28Å; D91-K101 IonicContact OD1-NZ 3.5Å; D91-K101 PolarHBondContact OD1-NZ 3Å; D91-K101 IonicContact OD2-NZ 2.79Å; D91-K101 PolarHBondContact OD2-NZ 3.47Å; K101-Y103 HydrophobicContact CB-CD2 4.37Å; K101-Y103 HydrophobicContact CB-CE2 3.67Å
102	V	94.3	Very high	75.6	Confident	15 Å²	15	78.3 Å²	78.3	9%	0.091	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	130.5	176.1	-174.8	0	0	0	0	109.3	T27 E33 F34 C35 V89 S90	T27-V102 HydrophobicContact CG2-CG1 4.25Å; T27-V102 HydrophobicContact CG2-CG2 4.41Å; E33-V102 HydrophobicContact CB-CG1 4.29Å; F34-V102 WeakPolarHBondContact O-CA 3.44Å; C35-V102 HydrophobicContact CB-CG2 4.14Å; V89-V102 HydrophobicContact CB-CG1 4.35Å; V89-V102 PolarHBondContact N-O 3.3Å; S90-V102 PolarHBondContact N-O 2.81Å; S90-V102 PolarHBondContact O-N 3.33Å
103	Y	95.3	Very high	73.1	Confident	7 Å²	7	80 Å²	80	3%	0.027	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	142.8	178.7	-65.1	-89.7	0	0	0	110.4	E33 F34 L81 K87 M88 K101	E33-Y103 VanDerWaalsContact CA-O 3.28Å; E33-Y103 WeakPolarHBondContact CA-O 3.06Å; F34-Y103 WeakPolarHBondContact CD1-O 3.43Å; F34-Y103 HydrophobicContact CE2-CD2 4.04Å; F34-Y103 HydrophobicContact CE2-CG 4.39Å; F34-Y103 VanDerWaalsContact CZ-CB 3.49Å; F34-Y103 HydrophobicContact CZ-CD2 4.21Å; F34-Y103 HydrophobicContact CZ-CG 4.11Å; F34-Y103 PolarHBondContact N-O 3.18Å; F34-Y103 PolarHBondContact O-N 3.43Å; L81-Y103 HydrophobicContact CD1-CD1 4Å; L81-Y103 HydrophobicContact CD1-CD2 4.12Å; L81-Y103 HydrophobicContact CD1-CE1 3.82Å; L81-Y103 HydrophobicContact CD1-CE2 3.95Å; L81-Y103 HydrophobicContact CD1-CG 4.13Å; K87-Y103 CarbonylContact O-C 3.15Å; K87-Y103 VanDerWaalsContact O-CA 3.29Å; K87-Y103 WeakPolarHBondContact O-CA 3.4Å; M88-Y103 HydrophobicContact CB-CD1 4.1Å; M88-Y103 HydrophobicContact CB-CE1 4.02Å; M88-Y103 HydrophobicContact CE-CE1 3.7Å; M88-Y103 WeakPolarHBondContact CE-OH 3.5Å; M88-Y103 HydrophobicContact CG-CD1 4.47Å; M88-Y103 HydrophobicContact CG-CE1 4.2Å; K101-Y103 HydrophobicContact CB-CD2 4.37Å; K101-Y103 HydrophobicContact CB-CE2 3.67Å
104	R	94.5	Very high	70.9	Confident	113 Å²	113	82.5 Å²	82.5	43%	0.426	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	137.6	173.5	-171.2	174.6	-68.4	175.5	-1	110.9	T32 E33 F86 K87 V89	T32-R104 CarbonylContact O-C 3.59Å; T32-R104 VanDerWaalsContact O-CA 3.25Å; T32-R104 WeakPolarHBondContact O-CA 3.46Å; T32-R104 WeakPolarHBondContact O-CG 3.33Å; E33-R104 HydrophobicContact CG-CB 4.14Å; E33-R104 HydrophobicContact CG-CG 4.11Å; E33-R104 IonicContact OE1-CZ 2.9Å; E33-R104 IonicContact OE1-NE 2.81Å; E33-R104 PolarHBondContact OE1-NE 2.91Å; E33-R104 IonicContact OE1-NH2 2.75Å; E33-R104 PolarHBondContact OE1-NH2 3.11Å; F86-R104 WeakPolarHBondContact CA-O 3.46Å; K87-R104 PolarHBondContact N-O 2.85Å; K87-R104 VanDerWaalsContact N-O 3.1Å; K87-R104 PolarHBondContact O-N 2.72Å; V89-R104 HydrophobicContact CG2-CB 3.55Å
105	W	94	Very high	69.1	Low	45 Å²	45	86 Å²	86	17%	0.17	52%	0.524	C	S	.	.	P	Polyproline II helix	trans	-63.3	145.3	175.3	-140.4	-94.2	0	0	0	110.7	I9 L12 K13 I16 W26 T32 F34 F86	I9-W105 HydrophobicContact CB-CZ2 4.41Å; I9-W105 HydrophobicContact CG2-CZ2 3.72Å; I9-W105 WeakPolarHBondContact O-CZ2 3.26Å; L12-W105 HydrophobicContact CB-CH2 4.12Å; L12-W105 HydrophobicContact CD2-CH2 4.26Å; L12-W105 HydrophobicContact CD2-CZ3 4.28Å; L12-W105 HydrophobicContact CG-CH2 4.09Å; L12-W105 HydrophobicContact CG-CZ3 4.3Å; K13-W105 HydrophobicContact CB-CH2 3.87Å; K13-W105 HydrophobicContact CB-CZ2 4.02Å; I16-W105 HydrophobicContact CD1-CZ3 3.99Å; W26-W105 HydrophobicContact CH2-CD2 4.4Å; W26-W105 AromaticContact CH2-CE3 3.54Å; W26-W105 HydrophobicContact CH2-CE3 3.54Å; W26-W105 HydrophobicContact CH2-CH2 4.05Å; W26-W105 AromaticContact CH2-CZ3 3.36Å; W26-W105 HydrophobicContact CH2-CZ3 3.36Å; W26-W105 HydrophobicContact CZ2-CZ3 4.37Å; W26-W105 AromaticContact CZ3-CE3 3.69Å; W26-W105 HydrophobicContact CZ3-CE3 3.69Å; W26-W105 AromaticContact CZ3-CZ3 3.87Å; W26-W105 HydrophobicContact CZ3-CZ3 3.87Å; T32-W105 PolarHBondContact O-N 2.87Å; F34-W105 AromaticContact CD1-CE3 3.88Å; F34-W105 HydrophobicContact CD1-CE3 3.88Å; F34-W105 AromaticContact CD1-CZ3 3.89Å; F34-W105 HydrophobicContact CD1-CZ3 3.89Å; F34-W105 AromaticContact CE1-CE3 3.89Å; F34-W105 HydrophobicContact CE1-CE3 3.89Å; F34-W105 AromaticContact CE1-CZ3 3.89Å; F34-W105 HydrophobicContact CE1-CZ3 3.89Å; F86-W105 HydrophobicContact CD1-CE3 4.41Å; F86-W105 AromaticContact CE1-CD2 3.58Å; F86-W105 HydrophobicContact CE1-CD2 3.58Å; F86-W105 AromaticContact CE1-CE2 4Å; F86-W105 AromaticContact CE1-CE3 3.44Å; F86-W105 HydrophobicContact CE1-CE3 3.44Å; F86-W105 VanDerWaalsContact CE1-CE3 3.44Å; F86-W105 HydrophobicContact CE1-CG 4.16Å; F86-W105 HydrophobicContact CE1-CH2 4.07Å; F86-W105 HydrophobicContact CE1-CZ2 4.25Å; F86-W105 AromaticContact CE1-CZ3 3.68Å; F86-W105 HydrophobicContact CE1-CZ3 3.68Å; F86-W105 HydrophobicContact CZ-CD2 4.05Å; F86-W105 AromaticContact CZ-CE2 3.97Å; F86-W105 HydrophobicContact CZ-CE3 4.15Å; F86-W105 HydrophobicContact CZ-CH2 4.03Å; F86-W105 AromaticContact CZ-CZ2 3.99Å; F86-W105 HydrophobicContact CZ-CZ2 3.99Å; F86-W105 HydrophobicContact CZ-CZ3 4.12Å
106	P	89.9	Confident	66.8	Low	37 Å²	37	87.3 Å²	87.3	24%	0.24	54%	0.544	C	S	.	.	P	Polyproline II helix	trans	-62.6	136.3	169.7	27.3	-36.6	0	0	0	110.7	I9 K84 E108	I9-P106 HydrophobicContact CD1-CG 4.12Å; K84-P106 WeakPolarHBondContact O-CG 3.33Å; P106-E108 PolarHBondContact O-N 2.8Å
107	E	80.8	Confident	65.8	Low	179 Å²	179	89.1 Å²	89.1	84%	0.836	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-68.2	126.3	170	-74.2	174.3	-171.9	0	0	109.3	S109	E107-S109 PolarHBondContact O-N 3.4Å
108	E	65.6	Low	63.8	Low	193 Å²	193	89.9 Å²	89.9	90%	0.902	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-65.1	116.9	171.2	-110.4	170	-175	0	0	108.3	P106 A110	P106-E108 PolarHBondContact O-N 2.8Å; E108-A110 VanDerWaalsContact C-N 3.32Å; E108-A110 PolarHBondContact O-N 2.83Å
109	S	44.1	Very low	61.3	Low	115 Å²	115	90.7 Å²	90.7	80%	0.804	56%	0.561	S	S	*	*			trans	-66.8	93.1	174.9	-48.8	0	0	0	0	108.8	E107 S111	E107-S109 PolarHBondContact O-N 3.4Å; S109-S111 PolarHBondContact O-N 2.76Å
110	A	36.6	Very low	58.6	Low	102 Å²	102	95.4 Å²	95.4	84%	0.843	59%	0.594	S	S	*	*			trans	-62.7	101.9	167.8	0	0	0	0	0	108.7	E108	E108-A110 VanDerWaalsContact C-N 3.32Å; E108-A110 PolarHBondContact O-N 2.83Å
111	S	41.8	Very low	55.6	Low	122 Å²	122	104.9 Å²	104.9	85%	0.853	63%	0.629	S	S	*	*			trans	-75.2	119.2	168.7	51.6	0	0	0	0	110.3	S109	S109-S111 PolarHBondContact O-N 2.76Å
112	G	34.7	Very low	52.5	Low	76 Å²	76	109.1 Å²	109.1	78%	0.784	66%	0.66	S	S	*	*			trans	114	99.6	150.9	0	0	0	0	0	116.9
113	A	32.8	Very low	49.5	Very low	97 Å²	97	115.1 Å²	115.1	80%	0.802	69%	0.687	S	S	*	*				174.3	128.5	126.8	0	0	0	0	0	112.8
114	S	33.4	Very low	46.3	Very low	124 Å²	124	121.6 Å²	121.6	87%	0.867	72%	0.718	S	S	*	*			trans	87	126.1	143.7	-54.7	0	0	0	0	121.6
115	K	37.5	Very low	43.2	Very low	209 Å²	209	124.3 Å²	124.3	91%	0.909	74%	0.735	S	S	*	*			trans	-69.6	136.4	175.2	-76.3	172.9	168.7	175.6	0	113.5
116	A	31.3	Very low	40.3	Very low	91 Å²	91	130.9 Å²	130.9	75%	0.752	77%	0.768	S	S	*	*			trans	62	168.1	133.9	0	0	0	0	0	120.8
117	P	50.7	Low	37.2	Very low	118 Å²	118	137 Å²	137	77%	0.766	80%	0.799	S	S	*	*			cis	-132.3	169.8	-32.5	31.1	-12.3	0	0	0	113.6
118	S	30.2	Very low	34.9	Very low	107 Å²	107	132.1 Å²	132.1	75%	0.748	79%	0.789	S	S	*	*				159.3	130.9	126.9	64.1	0	0	0	0	115
119	S	28.6	Very low	33.2	Very low	103 Å²	103	130.2 Å²	130.2	72%	0.72	78%	0.784	S	S	*	*			trans	47.6	131.5	140.2	66.5	0	0	0	0	119.8
120	S	30.3	Very low	32.4	Very low	105 Å²	105	130.5 Å²	130.5	73%	0.734	78%	0.781	S	S	*	*			cis	-171	125.8	48.6	-43.8	0	0	0	0	107.4
121	R	27.4	Very low	31.9	Very low	232 Å²	232	133.1 Å²	133.1	88%	0.875	78%	0.78	S	S	*	*				52.9	112.5	95.2	-157.4	178.1	-153.1	175.1	5.9	115.5
122	S	29.1	Very low	31.1	Very low	101 Å²	101	134.4 Å²	134.4	71%	0.706	78%	0.777	S	S	*	*				-174.3	104.3	124.2	-76.8	0	0	0	0	108.5
123	Q	31	Very low	30.6	Very low	141 Å²	141	133.3 Å²	133.3	66%	0.659	77%	0.766	S	S	*	*				87.4	104.2	101.1	-77.6	-171.8	-65.2	0	0	112.5
124	E	28.5	Very low	30.1	Very low	144 Å²	144	139.9 Å²	139.9	67%	0.673	77%	0.772	S	S	*	*				84.3	135.7	95.8	-76.3	164.7	-172.5	0	0	109.9
125	Q	28	Very low	29.8	Very low	169 Å²	169	141.2 Å²	141.2	79%	0.79	77%	0.769	S	S	*	*			cis	-167.7	145.2	25.4	-147.2	149.6	2.7	0	0	109.5
126	E	33.7	Very low	30.2	Very low	184 Å²	184	135.8 Å²	135.8	86%	0.86	76%	0.756	S	S	*	*			trans	-74.2	149.1	160.3	-67.2	174.4	146.9	0	0	109.7
127	D	24.8	Very low	29.9	Very low	166 Å²	166	141.1 Å²	141.1	89%	0.888	77%	0.765	S	S	*	*			trans	-155.5	139.4	136.3	-124.5	-21.8	0	0	0	112.2
128	A	33.6	Very low	28.8	Very low	76 Å²	76	139.1 Å²	139.1	63%	0.628	77%	0.765	S	S	*	*			trans	-98.5	146.5	173.7	0	0	0	0	0	109.5
129	N	28.7	Very low	28.7	Very low	152 Å²	152	140.2 Å²	140.2	81%	0.813	77%	0.773	S	S	*	*			trans	-172.3	114.6	139.1	-96.6	-37.2	0	0	0	113.7
130	V	26.7	Very low	28.6	Very low	121 Å²	121	138.3 Å²	138.3	73%	0.733	77%	0.77	S	S	*	*				57.4	113.5	115.8	-176.5	0	0	0	0	120.7
131	L	26.3	Very low	28.4	Very low	157 Å²	157	139.9 Å²	139.9	82%	0.822	77%	0.774	S	S	*	*			trans	66.9	117.9	132.2	-154.4	80.9	0	0	0	121
132	N	26.5	Very low	28.5	Very low	149 Å²	149	135.3 Å²	135.3	80%	0.797	77%	0.772	S	S	*	*				-155.9	134.6	121.4	-144.7	5.7	0	0	0	111.4
133	G	23.2	Very low	28.7	Very low	53 Å²	53	135.8 Å²	135.8	55%	0.546	77%	0.773	S	S	.	*			trans	-84.5	170	176	0	0	0	0	0	113.1
134	Y	23.3	Very low	28.4	Very low	236 Å²	236	137 Å²	137	93%	0.925	78%	0.776	S	S	*	*			trans	175.7	139.7	132.4	-93.9	-71.9	0	0	0	109
135	N	26.8	Very low	28.4	Very low	152 Å²	152	140.4 Å²	140.4	81%	0.813	79%	0.789	S	S	*	*			trans	-103.7	-166.7	-171.6	-161.7	22	0	0	0	110.4
136	P	44.7	Very low	28.5	Very low	95 Å²	95	137.6 Å²	137.6	62%	0.617	78%	0.784	S	S	*	*				-111.8	172.1	-103.8	37.1	-21	0	0	0	114.2
137	Q	26.8	Very low	28.2	Very low	203 Å²	203	132.1 Å²	132.1	95%	0.949	78%	0.777	S	S	*	*			trans	-164.2	142.5	146.1	-73.3	-152.2	-6.7	0	0	114.3
138	G	26.4	Very low	28.6	Very low	75 Å²	75	130.7 Å²	130.7	77%	0.773	78%	0.776	S	S	*	*			trans	108.4	91	154.3	0	0	0	0	0	115.9
139	S	27.5	Very low	28.3	Very low	131 Å²	131	133.9 Å²	133.9	92%	0.916	78%	0.781	S	S	*	*				78.6	127.1	76.1	-165.4	0	0	0	0	115.4
140	G	26.5	Very low	28.2	Very low	63 Å²	63	137.9 Å²	137.9	65%	0.649	79%	0.787	S	S	*	*			trans	144.7	59.5	172.6	0	0	0	0	0	114
141	V	27.1	Very low	28.3	Very low	137 Å²	137	138.5 Å²	138.5	83%	0.83	79%	0.786	S	S	*	*				56.1	107.9	105.6	-165.9	0	0	0	0	114.8
142	V	29.9	Very low	28.6	Very low	136 Å²	136	135.9 Å²	135.9	82%	0.824	78%	0.779	S	S	*	*			trans	-131.8	131.6	159.5	-162.2	0	0	0	0	107.1
143	P	32.8	Very low	28.6	Very low	112 Å²	112	137.3 Å²	137.3	73%	0.727	78%	0.78	S	S	*	*			trans	-79.9	131.4	-167.7	30.4	-32.5	0	0	0	113.1
144	F	25.5	Very low	28.7	Very low	166 Å²	166	141.6 Å²	141.6	73%	0.728	79%	0.791	S	S	*	*			trans	-27	132.1	148.5	-132.5	-125.5	0	0	0	115.4	T146	F144-T146 HydrophobicContact CD1-CG2 3.71Å; F144-T146 HydrophobicContact CE1-CG2 3.18Å; F144-T146 HydrophobicContact CZ-CG2 3.93Å
145	F	27.4	Very low	28.9	Very low	215 Å²	215	136.7 Å²	136.7	94%	0.943	78%	0.779	S	S	*	*			trans	-121.1	123.5	143.3	-91.2	-81.5	0	0	0	108.5
146	T	29.3	Very low	28.9	Very low	110 Å²	110	136.5 Å²	136.5	68%	0.675	78%	0.777	S	S	*	*			trans	-98.9	125.7	179.5	11.5	0	0	0	0	111.9	F144	F144-T146 HydrophobicContact CD1-CG2 3.71Å; F144-T146 HydrophobicContact CE1-CG2 3.18Å; F144-T146 HydrophobicContact CZ-CG2 3.93Å
147	G	28.9	Very low	28.2	Very low	69 Å²	69	139.9 Å²	139.9	71%	0.711	79%	0.788	S	S	*	*			trans	78.1	162.8	138.4	0	0	0	0	0	119.3
148	P	32.7	Very low	28.2	Very low	136 Å²	136	134.8 Å²	134.8	88%	0.883	78%	0.781	S	S	*	*			cis	-116.1	163.2	20.2	38	-25.5	0	0	0	116
149	I	27.4	Very low	28.2	Very low	143 Å²	143	135.4 Å²	135.4	73%	0.733	78%	0.779	S	S	*	*			trans	-73.1	138.1	-177.7	-65.1	157.8	0	0	0	110.6
150	Y	26.1	Very low	28.3	Very low	236 Å²	236	138.6 Å²	138.6	93%	0.925	78%	0.78	S	S	*	*			trans	-130.3	132.1	145.3	-138.2	-94.8	0	0	0	109
151	N	28.9	Very low	28.4	Very low	135 Å²	135	140.9 Å²	140.9	72%	0.722	79%	0.786	S	S	*	*			trans	-75.6	155.3	-165.7	-125.9	11.4	0	0	0	112.5
152	P	32.8	Very low	28.7	Very low	102 Å²	102	140.5 Å²	140.5	66%	0.662	79%	0.786	S	S	*	*			trans	-88.7	175.5	175.3	37.8	-30.2	0	0	0	111.4
153	E	26.8	Very low	29	Very low	178 Å²	178	137.1 Å²	137.1	83%	0.832	78%	0.779	S	S	*	*			trans	114.6	95.7	166.6	-61.9	-164.5	165	0	0	114.9
154	D	26.2	Very low	29.3	Very low	144 Å²	144	137.9 Å²	137.9	77%	0.77	79%	0.786	S	S	*	*			trans	165.5	130.2	131.5	-87	-15.6	0	0	0	105.3
155	I	27.4	Very low	30.1	Very low	132 Å²	132	137.7 Å²	137.7	68%	0.677	79%	0.788	S	S	*	*			cis	-176.6	149.9	22.2	-117.6	165.9	0	0	0	107.9
156	L	25.8	Very low	31.2	Very low	148 Å²	148	131.8 Å²	131.8	78%	0.775	77%	0.766	S	S	*	*			trans	66.1	109.7	156.6	-77.5	92.2	0	0	0	123.4
157	I	30.5	Very low	32.4	Very low	166 Å²	166	131.4 Å²	131.4	85%	0.851	76%	0.759	S	S	*	*			trans	-11.3	123.6	132.2	-56.9	163.8	0	0	0	115.2
158	A	26.8	Very low	33.4	Very low	96 Å²	96	133.9 Å²	133.9	79%	0.793	76%	0.755	S	S	*	*			trans	-144	110.3	151	0	0	0	0	0	110.9
159	A	26.9	Very low	34.2	Very low	88 Å²	88	133.4 Å²	133.4	73%	0.727	74%	0.741	S	S	*	*			trans	47.3	112.7	147	0	0	0	0	0	119.9	S161	A159-S161 PolarHBondContact O-N 2.8Å
160	E	28.5	Very low	35.4	Very low	199 Å²	199	133 Å²	133	93%	0.93	74%	0.736	S	S	*	*			trans	-48.6	125.8	148.5	-63.4	-177.9	151.6	0	0	110.2
161	S	28.1	Very low	36.5	Very low	111 Å²	111	125.5 Å²	125.5	78%	0.776	72%	0.717	S	S	*	*			trans	-115	119.7	164.8	-175.6	0	0	0	0	108.9	A159 G163	A159-S161 PolarHBondContact O-N 2.8Å; S161-G163 PolarHBondContact O-N 3.09Å
162	P	33.9	Very low	37.5	Very low	129 Å²	129	124.6 Å²	124.6	84%	0.838	71%	0.712	S	S	*	*			trans	-83.1	113.7	176	32.3	-27.8	0	0	0	108.4
163	G	35.8	Very low	38.3	Very low	65 Å²	65	130.4 Å²	130.4	67%	0.67	72%	0.721	S	S	*	*			trans	-175	28.6	-174.7	0	0	0	0	0	117.3	S161 Q165	S161-G163 PolarHBondContact O-N 3.09Å; G163-Q165 PolarHBondContact O-N 3.05Å; G163-Q165 VanDerWaalsContact O-N 3.12Å
164	S	40.7	Very low	39.1	Very low	127 Å²	127	125.2 Å²	125.2	89%	0.888	72%	0.715	S	S	*	*			trans	-81.8	77.4	161.2	57.4	0	0	0	0	108.5	D166	S164-D166 PolarHBondContact O-N 3.09Å
165	Q	41	Very low	40.1	Very low	162 Å²	162	123.6 Å²	123.6	76%	0.757	71%	0.706	S	S	*	*			trans	-66.8	118.3	164.2	-83.4	-177.9	-13.2	0	0	107.8	G163 I167	G163-Q165 PolarHBondContact O-N 3.05Å; G163-Q165 VanDerWaalsContact O-N 3.12Å; Q165-I167 PolarHBondContact O-N 2.94Å; Q165-I167 VanDerWaalsContact O-N 3.09Å
166	D	50.3	Low	40.7	Very low	91 Å²	91	124.3 Å²	124.3	49%	0.487	71%	0.711	S	S	.	*			trans	-61.3	108.5	175.8	-174.3	-2.3	0	0	0	109.1	S164 L168 Q169 E170	S164-D166 PolarHBondContact O-N 3.09Å; D166-L168 PolarHBondContact O-N 2.9Å; D166-L168 WeakPolarHBondContact OD1-CB 3.39Å; D166-L168 PolarHBondContact OD1-N 3.23Å; D166-L168 VanDerWaalsContact OD1-N 3.12Å; D166-Q169 HydrophobicContact CB-CB 4.17Å; D166-Q169 WeakPolarHBondContact O-CA 3.33Å; D166-Q169 VanDerWaalsContact O-CB 3.26Å; D166-Q169 WeakPolarHBondContact O-CB 3.46Å; D166-Q169 PolarHBondContact O-N 2.75Å; D166-E170 PolarHBondContact O-N 2.78Å
167	I	55	Low	41.4	Very low	103 Å²	103	124.4 Å²	124.4	53%	0.528	71%	0.711	S	S	.	*	H	α-helix	trans	-55.7	-26.8	-179.3	-63.9	167	0	0	0	110.3	Q165 C171	Q165-I167 PolarHBondContact O-N 2.94Å; Q165-I167 VanDerWaalsContact O-N 3.09Å; I167-C171 PolarHBondContact O-N 2.91Å; I167-C171 VanDerWaalsContact O-N 3.13Å; I167-C171 PolarHBondContact O-SG 2.92Å
168	L	49.1	Very low	41.6	Very low	121 Å²	121	121.2 Å²	121.2	63%	0.634	70%	0.703	S	S	*	*	H	α-helix	trans	-68.2	-34.9	174.3	-72.9	162	0	0	0	112.5	D166 E170 C171 L172	D166-L168 PolarHBondContact O-N 2.9Å; D166-L168 WeakPolarHBondContact OD1-CB 3.39Å; D166-L168 PolarHBondContact OD1-N 3.23Å; D166-L168 VanDerWaalsContact OD1-N 3.12Å; L168-E170 VanDerWaalsContact C-N 3.33Å; L168-E170 PolarHBondContact O-N 2.66Å; L168-C171 WeakPolarHBondContact O-CB 3.39Å; L168-C171 PolarHBondContact O-N 2.81Å; L168-L172 WeakPolarHBondContact O-CG 3.23Å; L168-L172 PolarHBondContact O-N 3.16Å; L168-L172 VanDerWaalsContact O-N 3.1Å
169	Q	50.3	Low	42.1	Very low	125 Å²	125	122.9 Å²	122.9	58%	0.584	71%	0.706	S	S	*	*	H	α-helix	trans	-68.7	-34.4	179.6	-158	80.5	5.5	0	0	111.7	D166 R173	D166-Q169 HydrophobicContact CB-CB 4.17Å; D166-Q169 WeakPolarHBondContact O-CA 3.33Å; D166-Q169 VanDerWaalsContact O-CB 3.26Å; D166-Q169 WeakPolarHBondContact O-CB 3.46Å; D166-Q169 PolarHBondContact O-N 2.75Å; Q169-R173 PolarHBondContact O-N 2.97Å
170	E	52.4	Low	42.2	Very low	135 Å²	135	122.4 Å²	122.4	63%	0.631	71%	0.709	S	S	*	*	H	α-helix	trans	-73.1	-37.7	174.6	-167.4	164.1	-166.9	0	0	111.7	D166 L168 L172 R173 G174	D166-E170 PolarHBondContact O-N 2.78Å; L168-E170 VanDerWaalsContact C-N 3.33Å; L168-E170 PolarHBondContact O-N 2.66Å; E170-L172 VanDerWaalsContact C-N 3.26Å; E170-L172 PolarHBondContact O-N 2.93Å; E170-R173 PolarHBondContact O-N 3.37Å; E170-G174 PolarHBondContact O-N 3.44Å
171	C	48.4	Very low	42.2	Very low	79 Å²	79	118.1 Å²	118.1	53%	0.534	71%	0.708	S	S	.	*	H	α-helix	trans	-59.8	-36	172.4	-66.3	0	0	0	0	112.6	I167 L168	I167-C171 PolarHBondContact O-N 2.91Å; I167-C171 VanDerWaalsContact O-N 3.13Å; I167-C171 PolarHBondContact O-SG 2.92Å; L168-C171 WeakPolarHBondContact O-CB 3.39Å; L168-C171 PolarHBondContact O-N 2.81Å
172	L	50.2	Low	42.6	Very low	116 Å²	116	122.4 Å²	122.4	61%	0.607	72%	0.716	S	S	*	*	H	α-helix	trans	-76	-27.2	179.8	-70.4	170.2	0	0	0	113.2	L168 E170	L168-L172 WeakPolarHBondContact O-CG 3.23Å; L168-L172 PolarHBondContact O-N 3.16Å; L168-L172 VanDerWaalsContact O-N 3.1Å; E170-L172 VanDerWaalsContact C-N 3.26Å; E170-L172 PolarHBondContact O-N 2.93Å
173	R	50.8	Low	42.4	Very low	223 Å²	223	120 Å²	120	84%	0.842	71%	0.714	S	S	*	*	H	α-helix	trans	-72.4	-28.7	176.9	-94.2	-175.9	165.7	177.7	-3	113.6	Q169 E170 L175	Q169-R173 PolarHBondContact O-N 2.97Å; E170-R173 PolarHBondContact O-N 3.37Å; R173-L175 PolarHBondContact O-N 2.8Å
174	G	43.1	Very low	42.2	Very low	69 Å²	69	123.4 Å²	123.4	71%	0.711	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-9.2	178.9	0	0	0	0	0	115.2	E170	E170-G174 PolarHBondContact O-N 3.44Å
175	L	46.9	Very low	41.7	Very low	110 Å²	110	124.4 Å²	124.4	58%	0.576	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-2.6	-173.1	-71.6	175.5	0	0	0	115.1	R173 I177	R173-L175 PolarHBondContact O-N 2.8Å; L175-I177 HydrophobicContact CB-CG1 4.27Å; L175-I177 VanDerWaalsContact O-CG1 3.26Å; L175-I177 WeakPolarHBondContact O-CG1 3.46Å; L175-I177 PolarHBondContact O-N 3.25Å
176	N	40.1	Very low	41.1	Very low	148 Å²	148	119.7 Å²	119.7	79%	0.791	72%	0.718	S	S	*	*			trans	35.2	43.4	175.8	-147.5	18.5	0	0	0	115.4	S178	N176-S178 PolarHBondContact O-N 3.22Å
177	I	41.5	Very low	40.2	Very low	150 Å²	150	125.8 Å²	125.8	77%	0.769	74%	0.741	S	S	*	*			trans	-87.3	85.7	173.7	-49.9	-177.6	0	0	0	107.2	L175	L175-I177 HydrophobicContact CB-CG1 4.27Å; L175-I177 VanDerWaalsContact O-CG1 3.26Å; L175-I177 WeakPolarHBondContact O-CG1 3.46Å; L175-I177 PolarHBondContact O-N 3.25Å
178	S	33.1	Very low	38.9	Very low	98 Å²	98	129.4 Å²	129.4	69%	0.685	76%	0.755	S	S	*	*			trans	-98	141.6	155.6	-66.2	0	0	0	0	108.7	N176	N176-S178 PolarHBondContact O-N 3.22Å
179	P	37.2	Very low	38.2	Very low	132 Å²	132	127.7 Å²	127.7	86%	0.857	75%	0.751	S	S	*	*			trans	-82.2	127.8	-176.9	30.9	-30.1	0	0	0	111.5
180	G	30	Very low	37.2	Very low	78 Å²	78	128 Å²	128	80%	0.804	76%	0.764	S	S	*	*			trans	109.9	113.6	153.9	0	0	0	0	0	116.3
181	A	28.1	Very low	36.1	Very low	109 Å²	109	128.1 Å²	128.1	90%	0.901	77%	0.774	S	S	*	*				168.2	147.3	113.1	0	0	0	0	0	110.7
182	E	36.1	Very low	35.2	Very low	201 Å²	201	132.9 Å²	132.9	94%	0.939	79%	0.789	S	S	*	*			trans	-65	158.9	-171.8	-57	174.3	158.2	0	0	114.3
183	G	29.3	Very low	34.2	Very low	77 Å²	77	135.8 Å²	135.8	79%	0.794	80%	0.799	S	S	*	*			trans	178.7	85.8	172	0	0	0	0	0	113.7
184	T	32.5	Very low	33.2	Very low	137 Å²	137	134.3 Å²	134.3	84%	0.84	80%	0.802	S	S	*	*			trans	-63.8	140.6	170.3	34.1	0	0	0	0	113
185	T	31.3	Very low	32.5	Very low	149 Å²	149	139.9 Å²	139.9	91%	0.914	81%	0.809	S	S	*	*			trans	169	125.3	147.4	40.9	0	0	0	0	105.2
186	G	28.5	Very low	31.6	Very low	63 Å²	63	143.2 Å²	143.2	65%	0.649	83%	0.827	S	S	*	*			cis	120.9	86	32.8	0	0	0	0	0	106.2
187	F	29.9	Very low	31	Very low	219 Å²	219	143.7 Å²	143.7	96%	0.961	82%	0.824	S	S	*	*			trans	-149.7	124	167.6	-97.3	-78.4	0	0	0	111.9
188	Q	28.7	Very low	30.4	Very low	178 Å²	178	142 Å²	142	83%	0.832	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-94.7	138.8	-175.9	-175.3	177.3	0.7	0	0	109.5
189	P	33	Very low	30.1	Very low	85 Å²	85	144 Å²	144	55%	0.552	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-90.2	146.7	171.6	33.2	-29.2	0	0	0	111.4
190	P	30.5	Very low	29.7	Very low	133 Å²	133	144.6 Å²	144.6	86%	0.864	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-79.9	152.7	177.7	31.2	-31.7	0	0	0	112.7
191	T	28.8	Very low	29.5	Very low	137 Å²	137	146.2 Å²	146.2	84%	0.84	80%	0.804	S	S	*	*			trans	-108.4	121.7	-176.6	-45.3	0	0	0	0	109.2
192	E	29.9	Very low	29.5	Very low	178 Å²	178	148.8 Å²	148.8	83%	0.832	80%	0.802	S	S	*	*			trans	-177	125.2	164.7	-109.8	178.4	169.4	0	0	105.5
193	Q	30	Very low	28.9	Very low	178 Å²	178	142.9 Å²	142.9	83%	0.832	79%	0.794	S	S	*	*			cis	-148.3	125.8	14.4	-72	168.6	-31.3	0	0	108.6
194	Q	28	Very low	28.6	Very low	191 Å²	191	143.2 Å²	143.2	89%	0.893	79%	0.789	S	S	*	*			trans	-111.4	115.9	154.9	-110.1	-177.7	-6.9	0	0	105.5
195	Q	30.2	Very low	28.3	Very low	186 Å²	186	145.4 Å²	145.4	87%	0.869	79%	0.79	S	S	*	*			trans	-178	104.2	152.7	-106.4	168.4	4.3	0	0	109.7
196	L	27.9	Very low	28.5	Very low	180 Å²	180	144 Å²	144	94%	0.942	78%	0.783	S	S	*	*				-173.9	149	105.6	-105.4	138.6	0	0	0	110.8
197	Q	26.2	Very low	28.9	Very low	159 Å²	159	148.8 Å²	148.8	74%	0.743	79%	0.793	S	S	*	*			trans	-124.6	160.1	-152	-148.4	178.9	13	0	0	108.7
198	N	29.2	Very low	29	Very low	114 Å²	114	144.9 Å²	144.9	61%	0.61	79%	0.79	S	S	*	*			trans	81.4	144.5	156.8	-61.1	-32.3	0	0	0	117.5
199	Q	27.5	Very low	29	Very low	140 Å²	140	139.7 Å²	139.7	65%	0.654	78%	0.784	S	S	*	*			cis	-178.1	156.8	-2.4	-117.7	177.4	36.3	0	0	110.2
200	L	27.7	Very low	28.8	Very low	144 Å²	144	145 Å²	145	75%	0.754	80%	0.801	S	S	*	*			trans	68.3	152.4	148.5	-61.4	159.1	0	0	0	118.4
201	V	25.9	Very low	28.7	Very low	112 Å²	112	147.6 Å²	147.6	68%	0.679	80%	0.802	S	S	*	*			cis	-169.1	153.1	-0.8	131.5	0	0	0	0	111.2
202	I	27.5	Very low	28.5	Very low	164 Å²	164	149.1 Å²	149.1	84%	0.841	80%	0.8	S	S	*	*			trans	-10	140.3	156.1	-48.9	170.6	0	0	0	119.9
203	G	25.3	Very low	28.6	Very low	76 Å²	76	146.7 Å²	146.7	78%	0.784	79%	0.792	S	S	*	*			trans	166.4	138.5	153.9	0	0	0	0	0	115.6
204	A	22.7	Very low	29.2	Very low	84 Å²	84	144.2 Å²	144.2	69%	0.694	79%	0.792	S	S	*	*			trans	-111.6	156.3	-162.5	0	0	0	0	0	116.3
205	H	26.1	Very low	29.3	Very low	184 Å²	184	140.5 Å²	140.5	85%	0.852	78%	0.782	S	S	*	*			trans	67.7	161.7	154.6	-67.3	-54.8	0	0	0	121.1
206	P	35.1	Very low	29	Very low	119 Å²	119	140.4 Å²	140.4	77%	0.773	78%	0.784	S	S	*	*			cis	-133.3	174.6	-8.2	28.2	-4.5	0	0	0	116.2
207	L	37.7	Very low	29	Very low	164 Å²	164	140.2 Å²	140.2	86%	0.859	78%	0.776	S	S	*	*			trans	-75.8	167.3	170.6	-66.4	163.3	0	0	0	112.9
208	P	32.2	Very low	29.1	Very low	136 Å²	136	141.2 Å²	141.2	88%	0.883	78%	0.781	S	S	*	*				-151.9	156.8	111.5	34.8	-16.1	0	0	0	117.7
209	G	27.9	Very low	28.9	Very low	70 Å²	70	139.5 Å²	139.5	72%	0.722	79%	0.79	S	S	*	*			trans	144.2	73.7	162.9	0	0	0	0	0	112.9
210	Q	28.9	Very low	29	Very low	195 Å²	195	137.9 Å²	137.9	91%	0.911	80%	0.8	S	S	*	*				44.4	122.3	101.7	-82	-173	-48.8	0	0	113.8
211	Q	27.8	Very low	29	Very low	189 Å²	189	136 Å²	136	88%	0.883	81%	0.805	S	S	*	*				-162.4	146.1	59	-160.2	171.1	-29.1	0	0	111.9
212	Q	25.5	Very low	29.3	Very low	168 Å²	168	142 Å²	142	79%	0.785	82%	0.815	S	S	*	*			trans	-108.1	148.7	-179.4	-74	178.8	-26.1	0	0	111.7
213	D	32.5	Very low	29.5	Very low	127 Å²	127	143.3 Å²	143.3	68%	0.679	82%	0.818	S	S	*	*				75.7	152.5	128.5	-74.9	-9.9	0	0	0	121.2
214	P	40.7	Very low	30.2	Very low	127 Å²	127	146.5 Å²	146.5	83%	0.825	82%	0.823	S	S	*	*				-142.5	157.5	56.1	35.8	-12.6	0	0	0	120.9
215	V	31	Very low	30.6	Very low	113 Å²	113	145.9 Å²	145.9	69%	0.685	83%	0.825	S	S	*	*			trans	-85.8	148.7	166.6	179.3	0	0	0	0	110.3
216	M	24.8	Very low	31.3	Very low	183 Å²	183	145.2 Å²	145.2	90%	0.901	83%	0.827	S	S	*	*			trans	-129.8	150.7	155.9	-94	-74.5	-79.9	0	0	110.4
217	F	27.6	Very low	31.2	Very low	176 Å²	176	145.3 Å²	145.3	77%	0.772	83%	0.827	S	S	*	*			trans	-101.3	164.3	-156.3	-141.9	-101.7	0	0	0	113.1
218	E	27.8	Very low	31.2	Very low	181 Å²	181	146.5 Å²	146.5	85%	0.846	83%	0.828	S	S	*	*			trans	91.2	135	144.5	-127.5	166.5	-147.5	0	0	121.6
219	G	25.7	Very low	31.5	Very low	78 Å²	78	148.6 Å²	148.6	80%	0.804	83%	0.826	S	S	*	*			trans	132.3	109.2	150.4	0	0	0	0	0	117.1
220	A	29.7	Very low	31.8	Very low	105 Å²	105	151 Å²	151	87%	0.868	83%	0.829	S	S	*	*			trans	-73.2	150.5	178.4	0	0	0	0	0	114.9
221	A	27.6	Very low	32.1	Very low	104 Å²	104	146.4 Å²	146.4	86%	0.86	83%	0.825	S	S	*	*			trans	170.5	156.5	131.7	0	0	0	0	0	112.1
222	R	31.4	Very low	32.7	Very low	238 Å²	238	148.5 Å²	148.5	90%	0.898	82%	0.824	S	S	*	*			trans	-56.9	145.6	-174.7	-61.2	166.6	168.9	-178.6	-4.7	114.4
223	E	31	Very low	33.1	Very low	192 Å²	192	145.8 Å²	145.8	90%	0.897	82%	0.822	S	S	*	*				179.9	152.2	115.3	-102.1	175.3	175.3	0	0	112.8
224	T	40.4	Very low	33.5	Very low	143 Å²	143	145.2 Å²	145.2	88%	0.877	83%	0.827	S	S	*	*			trans	-59.9	136.8	-178.3	39.5	0	0	0	0	114.9
225	G	31.2	Very low	33.3	Very low	72 Å²	72	149.6 Å²	149.6	74%	0.742	83%	0.829	S	S	*	*			trans	178.4	112.8	163.5	0	0	0	0	0	111.8
226	L	40.1	Very low	34.1	Very low	170 Å²	170	145.9 Å²	145.9	89%	0.89	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-58.5	141.6	168.5	-77.7	148.7	0	0	0	109.6	E228	L226-E228 PolarHBondContact O-N 3.15Å
227	P	34.5	Very low	35.5	Very low	121 Å²	121	140.8 Å²	140.8	79%	0.786	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-73.6	116.2	172.2	28.3	-29.1	0	0	0	109.5	Q229	P227-Q229 PolarHBondContact O-N 3.43Å
228	E	37.9	Very low	37.2	Very low	188 Å²	188	135.2 Å²	135.2	88%	0.879	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-54.2	125.2	161.9	-77.5	-177.7	128.3	0	0	109	L226	L226-E228 PolarHBondContact O-N 3.15Å
229	Q	37.4	Very low	39.3	Very low	180 Å²	180	133 Å²	133	84%	0.841	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-61.5	138.7	165.2	-83.5	-179.6	-29.6	0	0	108.9	P227 A231	P227-Q229 PolarHBondContact O-N 3.43Å; Q229-A231 PolarHBondContact O-N 2.92Å; Q229-A231 VanDerWaalsContact O-N 3.14Å
230	P	35	Very low	41.7	Very low	120 Å²	120	132.7 Å²	132.7	78%	0.779	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-63.8	120.8	177.6	25	-30.8	0	0	0	109.4	R232	P230-R232 PolarHBondContact O-N 3.49Å
231	A	34	Very low	44.1	Very low	99 Å²	99	128.2 Å²	128.2	82%	0.818	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-51.6	121.2	172.3	0	0	0	0	0	109.7	Q229	Q229-A231 PolarHBondContact O-N 2.92Å; Q229-A231 VanDerWaalsContact O-N 3.14Å
232	R	40.8	Very low	46.7	Very low	233 Å²	233	125.9 Å²	125.9	88%	0.879	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-66.9	141.3	167.1	-74.4	-176.3	175.5	-179.2	-1.2	108.6	P230 S234	P230-R232 PolarHBondContact O-N 3.49Å; R232-S234 PolarHBondContact O-N 3.5Å
233	P	34.4	Very low	49.2	Very low	112 Å²	112	118.6 Å²	118.6	73%	0.727	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-62.4	123.8	176.8	23.6	-30.1	0	0	0	110.6	Y235	P233-Y235 HydrophobicContact CB-CD2 4.42Å; P233-Y235 PolarHBondContact O-N 3.26Å
234	S	40.5	Very low	51.8	Low	114 Å²	114	109.5 Å²	109.5	80%	0.797	63%	0.627	S	S	*	*	S	Bend	trans	-73.4	46.3	179.7	-178.1	0	0	0	0	113.1	R232	R232-S234 PolarHBondContact O-N 3.5Å
235	Y	36	Very low	54	Low	219 Å²	219	103.8 Å²	103.8	86%	0.859	59%	0.591	S	S	*	*			trans	-108.4	5.6	-179.2	-84.3	-81.9	0	0	0	114.2	P233	P233-Y235 HydrophobicContact CB-CD2 4.42Å; P233-Y235 PolarHBondContact O-N 3.26Å
236	G	48.8	Very low	56.8	Low	36 Å²	36	105.8 Å²	105.8	37%	0.371	58%	0.581	S	S	.	*	S	Bend	trans	-110.8	-13.8	-175.1	0	0	0	0	0	117.2
237	D	54.4	Low	59.1	Low	76 Å²	76	98.8 Å²	98.8	41%	0.406	55%	0.545	S	S	.	.	H	α-helix	trans	-75.4	-37.9	-166	-155.8	32.1	0	0	0	113.1	A241 S443	D237-A241 PolarHBondContact O-N 2.65Å; D237-S443 WeakPolarHBondContact OD1-CA 3.33Å; D237-S443 VanDerWaalsContact OD1-CB 3.22Å; D237-S443 WeakPolarHBondContact OD1-CB 3.46Å; D237-S443 PolarHBondContact OD1-N 2.91Å; D237-S443 PolarHBondContact OD1-OG 2.75Å
238	G	62.3	Low	61.7	Low	59 Å²	59	93 Å²	93	61%	0.608	51%	0.508	S	S	*	.	H	α-helix	trans	-73.9	-28.3	-179.6	0	0	0	0	0	114.4	A242	G238-A242 PolarHBondContact O-N 3.32Å
239	Q	73.3	Confident	64.1	Low	133 Å²	133	89 Å²	89	62%	0.621	49%	0.492	S	S	*	.	H	α-helix	trans	-73.7	-35	-179.5	-169.8	173.6	-20.9	0	0	111.5	Q243	Q239-Q243 VanDerWaalsContact O-CG 3.27Å; Q239-Q243 WeakPolarHBondContact O-CG 3.41Å; Q239-Q243 PolarHBondContact O-N 2.75Å; Q239-Q243 VanDerWaalsContact O-N 3.13Å
240	Q	76.1	Confident	66.7	Low	72 Å²	72	85.6 Å²	85.6	34%	0.336	48%	0.476	S	S	.	.	H	α-helix	trans	-69.8	-43.3	177.7	-67.9	170.2	-15.8	0	0	111.4	A242 Q243 F244 C439	Q240-A242 PolarHBondContact O-N 3.22Å; Q240-Q243 PolarHBondContact O-N 3.26Å; Q240-F244 PolarHBondContact O-N 3.17Å; Q240-F244 VanDerWaalsContact O-N 3.07Å; Q240-C439 PolarHBondContact O-SG 3.46Å
241	A	78.6	Confident	69.3	Low	11 Å²	11	79.9 Å²	79.9	9%	0.091	44%	0.44	C	S	.	.	H	α-helix	trans	-61.6	-42.1	174.9	0	0	0	0	0	112.3	D237 Q243 F244 L245 L449	D237-A241 PolarHBondContact O-N 2.65Å; A241-Q243 PolarHBondContact O-N 2.8Å; A241-F244 PolarHBondContact O-N 3.38Å; A241-L245 PolarHBondContact O-N 2.91Å; A241-L245 VanDerWaalsContact O-N 3.07Å; A241-L449 HydrophobicContact CB-CD1 3.94Å; A241-L449 HydrophobicContact CB-CD2 4.38Å; A241-L449 HydrophobicContact CB-CG 4.32Å
242	A	82.5	Confident	71.8	Confident	55 Å²	55	78.9 Å²	78.9	46%	0.455	41%	0.414	S	S	.	.	H	α-helix	trans	-62.3	-40.9	176.5	0	0	0	0	0	112.5	G238 Q240 F244 L245 E246	G238-A242 PolarHBondContact O-N 3.32Å; Q240-A242 PolarHBondContact O-N 3.22Å; A242-F244 VanDerWaalsContact C-N 3.32Å; A242-F244 PolarHBondContact O-N 2.92Å; A242-L245 PolarHBondContact O-N 3.21Å; A242-E246 PolarHBondContact O-N 3.41Å
243	Q	84	Confident	74	Confident	86 Å²	86	73.1 Å²	73.1	40%	0.402	40%	0.401	S	S	.	.	H	α-helix	trans	-63.7	-36.8	175.8	-74.3	169.7	-10.3	0	0	112.4	Q239 Q240 A241 E246 T247	Q239-Q243 VanDerWaalsContact O-CG 3.27Å; Q239-Q243 WeakPolarHBondContact O-CG 3.41Å; Q239-Q243 PolarHBondContact O-N 2.75Å; Q239-Q243 VanDerWaalsContact O-N 3.13Å; Q240-Q243 PolarHBondContact O-N 3.26Å; A241-Q243 PolarHBondContact O-N 2.8Å; Q243-E246 PolarHBondContact O-N 3.34Å; Q243-T247 PolarHBondContact O-N 3.43Å; Q243-T247 PolarHBondContact O-OG1 2.55Å
244	F	86.3	Confident	76.4	Confident	1 Å²	1	69.9 Å²	69.9	0%	0.004	39%	0.389	C	S	.	.	H	α-helix	trans	-65.1	-46.4	174.2	-174.1	-86.4	0	0	0	112.1	Q240 A241 A242 E246 T247 V248 F389 L432 A435 A436 L449 L453	Q240-F244 PolarHBondContact O-N 3.17Å; Q240-F244 VanDerWaalsContact O-N 3.07Å; A241-F244 PolarHBondContact O-N 3.38Å; A242-F244 VanDerWaalsContact C-N 3.32Å; A242-F244 PolarHBondContact O-N 2.92Å; F244-E246 VanDerWaalsContact C-N 3.26Å; F244-E246 PolarHBondContact O-N 3.43Å; F244-T247 CarbonylContact O-C 3.56Å; F244-T247 WeakPolarHBondContact O-CA 3.36Å; F244-T247 VanDerWaalsContact O-CB 3.31Å; F244-T247 WeakPolarHBondContact O-CB 3.43Å; F244-T247 PolarHBondContact O-N 3.47Å; F244-V248 HydrophobicContact CD1-CG2 3.71Å; F244-V248 HydrophobicContact CE1-CG2 3.37Å; F244-V248 HydrophobicContact CZ-CG2 4.05Å; F244-V248 WeakPolarHBondContact O-CG2 3.42Å; F244-V248 PolarHBondContact O-N 3.22Å; F244-F389 HydrophobicContact CD2-CZ 4.39Å; F244-F389 HydrophobicContact CE2-CE2 4.36Å; F244-F389 AromaticContact CE2-CZ 3.81Å; F244-F389 HydrophobicContact CE2-CZ 3.81Å; F244-F389 AromaticContact CZ-CE2 3.99Å; F244-F389 HydrophobicContact CZ-CE2 3.99Å; F244-F389 AromaticContact CZ-CZ 3.9Å; F244-F389 HydrophobicContact CZ-CZ 3.9Å; F244-L432 HydrophobicContact CZ-CD2 4.48Å; F244-A435 HydrophobicContact CD2-CB 3.63Å; F244-A435 HydrophobicContact CE2-CB 4.2Å; F244-A436 HydrophobicContact CE2-CB 3.92Å; F244-L449 HydrophobicContact CB-CD2 3.88Å; F244-L449 HydrophobicContact CD1-CD2 3.39Å; F244-L449 HydrophobicContact CE1-CD2 4.25Å; F244-L449 HydrophobicContact CG-CD2 3.94Å; F244-L453 HydrophobicContact CE1-CD2 3.97Å; F244-L453 HydrophobicContact CE1-CG 4.37Å; F244-L453 HydrophobicContact CZ-CD2 3.95Å
245	L	86.3	Confident	78.3	Confident	22 Å²	22	69.7 Å²	69.7	12%	0.115	38%	0.379	C	S	.	.	H	α-helix	trans	-60.4	-39	177	-69.8	169	0	0	0	111.6	A241 A242 T247 V248 N249 E448 L449	A241-L245 PolarHBondContact O-N 2.91Å; A241-L245 VanDerWaalsContact O-N 3.07Å; A242-L245 PolarHBondContact O-N 3.21Å; L245-T247 VanDerWaalsContact C-N 3.31Å; L245-T247 PolarHBondContact O-N 3.27Å; L245-V248 PolarHBondContact O-N 3.23Å; L245-N249 VanDerWaalsContact O-CG 3.3Å; L245-N249 PolarHBondContact O-N 3.21Å; L245-N249 PolarHBondContact O-ND2 3.02Å; L245-E448 HydrophobicContact CD1-CB 4.45Å; L245-E448 HydrophobicContact CD1-CG 3.67Å; L245-E448 HydrophobicContact CD2-CG 4.27Å; L245-L449 HydrophobicContact CD1-CD2 4.4Å; L245-L449 HydrophobicContact CD2-CD2 3.85Å; L245-L449 HydrophobicContact CG-CD2 3.68Å
246	E	88.8	Confident	80.7	Confident	115 Å²	115	62.4 Å²	62.4	54%	0.537	35%	0.352	S	S	.	.	H	α-helix	trans	-60	-44.3	172.7	-167.1	-179.6	172.3	0	0	111.3	A242 Q243 F244 V248 N249 Q250	A242-E246 PolarHBondContact O-N 3.41Å; Q243-E246 PolarHBondContact O-N 3.34Å; F244-E246 VanDerWaalsContact C-N 3.26Å; F244-E246 PolarHBondContact O-N 3.43Å; E246-V248 PolarHBondContact O-N 2.74Å; E246-N249 PolarHBondContact O-N 3.34Å; E246-Q250 VanDerWaalsContact O-CG 3.29Å; E246-Q250 WeakPolarHBondContact O-CG 3.19Å; E246-Q250 PolarHBondContact O-N 2.89Å; E246-Q250 PolarHBondContact OE1-NE2 2.79Å
247	T	90.1	Very high	82.7	Confident	22 Å²	22	60.7 Å²	60.7	14%	0.135	34%	0.335	C	S	.	.	H	α-helix	trans	-61	-45.7	175.9	-53.4	0	0	0	0	111.3	Q243 F244 L245 N249 Q250 T251 L431 L432 A435	Q243-T247 PolarHBondContact O-N 3.43Å; Q243-T247 PolarHBondContact O-OG1 2.55Å; F244-T247 CarbonylContact O-C 3.56Å; F244-T247 WeakPolarHBondContact O-CA 3.36Å; F244-T247 VanDerWaalsContact O-CB 3.31Å; F244-T247 WeakPolarHBondContact O-CB 3.43Å; F244-T247 PolarHBondContact O-N 3.47Å; L245-T247 VanDerWaalsContact C-N 3.31Å; L245-T247 PolarHBondContact O-N 3.27Å; T247-N249 VanDerWaalsContact C-N 3.32Å; T247-N249 PolarHBondContact O-N 3.06Å; T247-Q250 PolarHBondContact O-N 3.2Å; T247-Q250 VanDerWaalsContact O-N 3.14Å; T247-T251 WeakPolarHBondContact O-CG2 3.39Å; T247-T251 PolarHBondContact O-N 2.82Å; T247-T251 VanDerWaalsContact O-N 3.14Å; T247-T251 PolarHBondContact O-OG1 3.16Å; T247-L431 HydrophobicContact CG2-CB 3.95Å; T247-L432 HydrophobicContact CG2-CD2 4Å; T247-L432 HydrophobicContact CG2-CG 4.4Å; T247-A435 HydrophobicContact CG2-CB 4.2Å
248	V	88.6	Confident	84.6	Confident	0 Å²	0	61 Å²	61	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-55.6	-48.7	175.7	172.9	0	0	0	0	111.1	F244 L245 E246 Q250 T251 R252 L432 S452 M456	F244-V248 HydrophobicContact CD1-CG2 3.71Å; F244-V248 HydrophobicContact CE1-CG2 3.37Å; F244-V248 HydrophobicContact CZ-CG2 4.05Å; F244-V248 WeakPolarHBondContact O-CG2 3.42Å; F244-V248 PolarHBondContact O-N 3.22Å; L245-V248 PolarHBondContact O-N 3.23Å; E246-V248 PolarHBondContact O-N 2.74Å; V248-Q250 VanDerWaalsContact C-N 3.3Å; V248-Q250 PolarHBondContact O-N 2.78Å; V248-T251 PolarHBondContact O-N 2.9Å; V248-T251 VanDerWaalsContact O-N 3.11Å; V248-T251 PolarHBondContact O-OG1 3.48Å; V248-R252 PolarHBondContact O-N 3.19Å; V248-L432 HydrophobicContact CB-CD2 4.44Å; V248-L432 HydrophobicContact CG2-CD2 3.74Å; V248-S452 WeakPolarHBondContact CG1-OG 3.21Å; V248-M456 HydrophobicContact CB-CE 4.49Å; V248-M456 HydrophobicContact CG1-CE 3.69Å; V248-M456 HydrophobicContact CG1-CG 4.36Å; V248-M456 HydrophobicContact CG1-SD 3.74Å; V248-M456 HydrophobicContact CG2-CE 4.02Å
249	N	89.1	Confident	86.1	Confident	104 Å²	104	58.2 Å²	58.2	56%	0.556	30%	0.303	S	S	*	.	H	α-helix	trans	-63.6	-33	179	-70.1	-37.2	0	0	0	113	L245 E246 T247 T251	L245-N249 VanDerWaalsContact O-CG 3.3Å; L245-N249 PolarHBondContact O-N 3.21Å; L245-N249 PolarHBondContact O-ND2 3.02Å; E246-N249 PolarHBondContact O-N 3.34Å; T247-N249 VanDerWaalsContact C-N 3.32Å; T247-N249 PolarHBondContact O-N 3.06Å; N249-T251 VanDerWaalsContact C-N 3.3Å; N249-T251 PolarHBondContact O-N 2.88Å
250	Q	90.5	Very high	87.2	Confident	108 Å²	108	55 Å²	55	51%	0.505	29%	0.288	S	S	.	.	H	α-helix	trans	-70.7	-26.5	176	-71.6	172.9	15.4	0	0	113.1	E246 T247 V248	E246-Q250 VanDerWaalsContact O-CG 3.29Å; E246-Q250 WeakPolarHBondContact O-CG 3.19Å; E246-Q250 PolarHBondContact O-N 2.89Å; E246-Q250 PolarHBondContact OE1-NE2 2.79Å; T247-Q250 PolarHBondContact O-N 3.2Å; T247-Q250 VanDerWaalsContact O-N 3.14Å; V248-Q250 VanDerWaalsContact C-N 3.3Å; V248-Q250 PolarHBondContact O-N 2.78Å
251	T	90.1	Very high	88.2	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.006	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	1.1	-178.6	62.1	0	0	0	0	114.4	T247 V248 N249 K258 S428 L432	T247-T251 WeakPolarHBondContact O-CG2 3.39Å; T247-T251 PolarHBondContact O-N 2.82Å; T247-T251 VanDerWaalsContact O-N 3.14Å; T247-T251 PolarHBondContact O-OG1 3.16Å; V248-T251 PolarHBondContact O-N 2.9Å; V248-T251 VanDerWaalsContact O-N 3.11Å; V248-T251 PolarHBondContact O-OG1 3.48Å; N249-T251 VanDerWaalsContact C-N 3.3Å; N249-T251 PolarHBondContact O-N 2.88Å; T251-K258 PolarHBondContact O-N 3.22Å; T251-S428 VanDerWaalsContact CG2-CB 3.45Å; T251-L432 HydrophobicContact CG2-CD1 4.2Å; T251-L432 HydrophobicContact CG2-CD2 4.43Å; T251-L432 HydrophobicContact CG2-CG 4.02Å
252	R	87.4	Confident	89.2	Confident	77 Å²	77	52.9 Å²	52.9	29%	0.291	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	137	-176	176.5	178	155.1	-162.7	-9.2	110.7	V248 G254 E455 L459	V248-R252 PolarHBondContact O-N 3.19Å; R252-G254 WeakPolarHBondContact CG-O 3.29Å; R252-G254 PolarHBondContact NE-O 3.29Å; R252-E455 IonicContact NH1-OE2 3.57Å; R252-E455 PolarHBondContact NH1-OE2 3.31Å; R252-L459 VanDerWaalsContact CZ-CD1 3.48Å
253	D	85.7	Confident	89.9	Confident	112 Å²	112	50.4 Å²	50.4	60%	0.599	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.5	97.6	166.6	-172.1	7.6	0	0	0	108.9	D255 H256	D253-D255 PolarHBondContact O-N 2.85Å; D253-H256 PolarHBondContact N-O 2.97Å; D253-H256 WeakPolarHBondContact O-CB 3.26Å; D253-H256 PolarHBondContact O-N 3.2Å
254	G	84.5	Confident	90.6	Very high	45 Å²	45	46.3 Å²	46.3	46%	0.464	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.7	-116.7	-172.2	0	0	0	0	0	112.2	R252	R252-G254 WeakPolarHBondContact CG-O 3.29Å; R252-G254 PolarHBondContact NE-O 3.29Å
255	D	82	Confident	91.2	Very high	110 Å²	110	46.4 Å²	46.4	59%	0.588	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.3	1.4	174	64	-14.5	0	0	0	112.8	D253 H339 Y460	D253-D255 PolarHBondContact O-N 2.85Å; D255-H339 PolarHBondContact O-CE1 3.03Å; D255-Y460 VanDerWaalsContact O-CE1 3.32Å; D255-Y460 WeakPolarHBondContact O-CE1 3.4Å
256	H	85.9	Confident	91.8	Very high	65 Å²	65	46.2 Å²	46.2	30%	0.301	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	129.6	-177	-178.9	62.9	0	0	0	112	D253 K258 E280	D253-H256 PolarHBondContact N-O 2.97Å; D253-H256 WeakPolarHBondContact O-CB 3.26Å; D253-H256 PolarHBondContact O-N 3.2Å; H256-K258 PolarHBondContact O-N 2.85Å; H256-E280 IonicContact CD2-OE2 2.97Å; H256-E280 PolarHBondContact CD2-OE2 2.86Å; H256-E280 IonicContact CE1-OE2 3.2Å; H256-E280 IonicContact NE2-OE2 2.91Å; H256-E280 PolarHBondContact NE2-OE2 3.25Å
257	F	90.9	Very high	92.2	Very high	1 Å²	1	40.8 Å²	40.8	0%	0.004	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	101	172.8	-175	-101.2	0	0	0	109.3	T259 M336 V378 M429 L432 Y460	F257-T259 HydrophobicContact CD1-CG2 4.14Å; F257-T259 HydrophobicContact CE1-CG2 4.17Å; F257-T259 PolarHBondContact O-N 3.03Å; F257-M336 HydrophobicContact CD1-CE 4.01Å; F257-V378 HydrophobicContact CB-CG1 4.34Å; F257-V378 HydrophobicContact CB-CG2 4.31Å; F257-V378 HydrophobicContact CD1-CG1 4.35Å; F257-V378 HydrophobicContact CD1-CG2 3.88Å; F257-V378 HydrophobicContact CD2-CG1 3.75Å; F257-V378 HydrophobicContact CE1-CG2 4.38Å; F257-V378 HydrophobicContact CE2-CG1 4.09Å; F257-V378 HydrophobicContact CG-CG1 3.88Å; F257-V378 HydrophobicContact CG-CG2 4.04Å; F257-M429 HydrophobicContact CE1-CE 4.4Å; F257-M429 HydrophobicContact CE1-CG 4.11Å; F257-M429 HydrophobicContact CZ-CG 4.01Å; F257-L432 HydrophobicContact CE2-CD1 3.95Å; F257-L432 HydrophobicContact CZ-CD1 4.22Å; F257-Y460 HydrophobicContact CB-CE1 3.95Å; F257-Y460 HydrophobicContact CB-CE2 4.41Å; F257-Y460 AromaticContact CD2-CE2 3.95Å; F257-Y460 HydrophobicContact CD2-CE2 3.95Å; F257-Y460 AromaticContact CD2-CZ 3.99Å
258	K	93.1	Very high	92.5	Very high	81 Å²	81	44.4 Å²	44.4	35%	0.352	22%	0.22	S	C	.	.			trans	-74.6	116.3	-176.7	-169.9	178.8	-175.5	169.9	0	109.8	T251 H256 E280 S428	T251-K258 PolarHBondContact O-N 3.22Å; H256-K258 PolarHBondContact O-N 2.85Å; K258-E280 WeakPolarHBondContact CE-OE1 3.43Å; K258-E280 VanDerWaalsContact CG-OE1 3.23Å; K258-E280 WeakPolarHBondContact CG-OE1 3.38Å; K258-S428 VanDerWaalsContact O-CB 3.23Å; K258-S428 WeakPolarHBondContact O-CB 3.4Å; K258-S428 PolarHBondContact O-OG 3.09Å
259	T	94.8	Very high	92.8	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.006	23%	0.23	C	C	.	.			trans	-148.3	144.8	175.1	-169.1	0	0	0	0	112.1	F257 F261 E280 M336 P426 T427 S428	F257-T259 HydrophobicContact CD1-CG2 4.14Å; F257-T259 HydrophobicContact CE1-CG2 4.17Å; F257-T259 PolarHBondContact O-N 3.03Å; T259-F261 HydrophobicContact CG2-CE2 4.49Å; T259-F261 HydrophobicContact CG2-CZ 4.29Å; T259-E280 VanDerWaalsContact O-CA 3.23Å; T259-E280 WeakPolarHBondContact O-CA 3.41Å; T259-E280 WeakPolarHBondContact O-CG 3.41Å; T259-M336 HydrophobicContact CG2-CE 3.74Å; T259-P426 HydrophobicContact CG2-CB 4.36Å; T259-T427 PolarHBondContact OG1-N 3.27Å; T259-S428 WeakPolarHBondContact CA-OG 3.34Å; T259-S428 PolarHBondContact OG1-N 2.82Å
260	H	96.1	Very high	93.1	Very high	67 Å²	67	45 Å²	45	31%	0.31	23%	0.231	S	C	.	.			trans	-102.4	-175.9	162.7	-60	121.3	0	0	0	109.3	P278 N279 P426 T427	H260-P278 VanDerWaalsContact CD2-C 3.44Å; H260-P278 VanDerWaalsContact CD2-CA 3.5Å; H260-P278 WeakPolarHBondContact CD2-CA 3.23Å; H260-N279 PolarHBondContact CD2-N 2.95Å; H260-P426 WeakPolarHBondContact O-CA 3.24Å; H260-T427 HydrophobicContact CB-CG2 4.38Å; H260-T427 PolarHBondContact N-OG1 3.09Å; H260-T427 PolarHBondContact O-N 3.34Å; H260-T427 PolarHBondContact O-OG1 3.3Å
261	F	97.9	Very high	93.4	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	141.1	179.7	-60.6	-93.6	0	0	0	111	T259 V277 N279 L283 V424 V425 P426	T259-F261 HydrophobicContact CG2-CE2 4.49Å; T259-F261 HydrophobicContact CG2-CZ 4.29Å; F261-V277 HydrophobicContact CB-CB 4.31Å; F261-V277 PolarHBondContact N-O 3.26Å; F261-V277 WeakPolarHBondContact O-CA 3.31Å; F261-V277 WeakPolarHBondContact O-CB 3.19Å; F261-V277 PolarHBondContact O-N 3.43Å; F261-N279 WeakPolarHBondContact CD2-O 3.38Å; F261-N279 WeakPolarHBondContact CE2-O 3.47Å; F261-L283 HydrophobicContact CB-CD2 3.56Å; F261-L283 HydrophobicContact CD1-CD2 4.27Å; F261-L283 HydrophobicContact CG-CD2 3.89Å; F261-V424 HydrophobicContact CD1-CG1 3.83Å; F261-V425 CarbonylContact C-O 3.49Å; F261-V425 WeakPolarHBondContact CA-O 3.14Å; F261-P426 HydrophobicContact CD1-CG 4.48Å; F261-P426 HydrophobicContact CE1-CB 4.41Å; F261-P426 HydrophobicContact CE1-CG 4.26Å
262	R	98.1	Very high	93.7	Very high	38 Å²	38	48 Å²	48	14%	0.143	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	133.6	164.2	-178	171.7	56.3	74.4	5.5	108.7	E274 Q275 V424 V425 T427 E430	R262-E274 HydrophobicContact CG-CG 4.41Å; R262-E274 IonicContact CZ-OE1 2.77Å; R262-E274 IonicContact NH1-OE1 3.28Å; R262-E274 PolarHBondContact NH1-OE1 2.86Å; R262-Q275 WeakPolarHBondContact CA-O 3.18Å; R262-V424 WeakPolarHBondContact O-CA 3.26Å; R262-V425 HydrophobicContact CB-CB 4.34Å; R262-V425 PolarHBondContact N-O 2.94Å; R262-V425 PolarHBondContact O-N 3.42Å; R262-T427 HydrophobicContact CB-CG2 4.35Å; R262-E430 IonicContact CZ-OE2 2.87Å; R262-E430 IonicContact NE-OE2 3.75Å; R262-E430 VanDerWaalsContact NH2-CD 3.26Å; R262-E430 IonicContact NH2-OE1 3.55Å; R262-E430 PolarHBondContact NH2-OE1 3.15Å; R262-E430 IonicContact NH2-OE2 2.67Å; R262-E430 PolarHBondContact NH2-OE2 3.31Å
263	V	98.4	Very high	94.2	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.012	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	126.4	-178.6	-178.6	0	0	0	0	109.1	V265 E274 Q275 V277 L283 L285 V305 V422 E423 V424	V263-V265 HydrophobicContact CG1-CG2 4.38Å; V263-E274 CarbonylContact O-C 3.56Å; V263-E274 VanDerWaalsContact O-CA 3.28Å; V263-E274 WeakPolarHBondContact O-CA 3.42Å; V263-Q275 PolarHBondContact N-O 3.09Å; V263-Q275 PolarHBondContact O-N 3.17Å; V263-V277 HydrophobicContact CG2-CG2 3.99Å; V263-L283 HydrophobicContact CG2-CD1 4.19Å; V263-L283 HydrophobicContact CG2-CD2 3.44Å; V263-L283 VanDerWaalsContact CG2-CD2 3.44Å; V263-L283 HydrophobicContact CG2-CG 4.43Å; V263-L285 HydrophobicContact CG1-CD2 3.98Å; V263-V305 HydrophobicContact CG1-CG1 4.43Å; V263-V422 HydrophobicContact CG1-CG1 3.68Å; V263-E423 CarbonylContact C-O 3.12Å; V263-E423 WeakPolarHBondContact CA-O 3.44Å; V263-V424 HydrophobicContact CG2-CG2 4.49Å
264	A	98.5	Very high	94.7	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.008	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	131.3	171.1	0	0	0	0	0	110.6	F266 K271 S273 E274 V422 E423	A264-F266 HydrophobicContact CB-CE2 3.73Å; A264-F266 HydrophobicContact CB-CZ 3.97Å; A264-K271 HydrophobicContact CB-CD 4.28Å; A264-S273 WeakPolarHBondContact CA-O 3.38Å; A264-E274 HydrophobicContact CB-CB 4.37Å; A264-E274 HydrophobicContact CB-CG 4.32Å; A264-V422 CarbonylContact O-C 3.59Å; A264-V422 WeakPolarHBondContact O-CA 3.42Å; A264-E423 HydrophobicContact CB-CB 4.29Å; A264-E423 PolarHBondContact N-O 3.42Å; A264-E423 PolarHBondContact O-N 3.01Å
265	V	98.4	Very high	95.2	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.012	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	135.5	-177.5	-175.9	0	0	0	0	109.4	V263 Y267 K271 V272 S273 L307 V422	V263-V265 HydrophobicContact CG1-CG2 4.38Å; V265-Y267 HydrophobicContact CG1-CD1 4.42Å; V265-Y267 HydrophobicContact CG1-CE1 3.8Å; V265-K271 WeakPolarHBondContact O-CA 3.32Å; V265-V272 HydrophobicContact CB-CG2 4Å; V265-V272 HydrophobicContact CG1-CG2 3.8Å; V265-V272 VanDerWaalsContact O-CG2 3.31Å; V265-V272 WeakPolarHBondContact O-CG2 3.28Å; V265-V272 PolarHBondContact O-N 2.97Å; V265-S273 PolarHBondContact N-O 3.2Å; V265-S273 PolarHBondContact O-N 3.27Å; V265-L307 HydrophobicContact CB-CD2 4.37Å; V265-L307 HydrophobicContact CG1-CD2 3.88Å; V265-L307 HydrophobicContact CG2-CD2 3.51Å; V265-V422 HydrophobicContact CG1-CG2 4.5Å; V265-V422 HydrophobicContact CG2-CG1 4.45Å; V265-V422 HydrophobicContact CG2-CG2 4.5Å
266	F	98.4	Very high	95.9	Very high	18 Å²	18	45.9 Å²	45.9	8%	0.079	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	130.3	-179.3	-53.3	-101.4	0	0	0	111	A264 V270 K271 W415 I420 M421 E423	A264-F266 HydrophobicContact CB-CE2 3.73Å; A264-F266 HydrophobicContact CB-CZ 3.97Å; F266-V270 CarbonylContact C-O 3.57Å; F266-V270 WeakPolarHBondContact CA-O 3.48Å; F266-K271 HydrophobicContact CD1-CB 3.73Å; F266-K271 HydrophobicContact CD1-CG 4.26Å; F266-K271 HydrophobicContact CE1-CB 3.63Å; F266-K271 HydrophobicContact CE1-CD 4.13Å; F266-K271 HydrophobicContact CE1-CG 3.92Å; F266-K271 HydrophobicContact CZ-CB 4.47Å; F266-K271 HydrophobicContact CZ-CD 4.22Å; F266-K271 HydrophobicContact CZ-CG 4.28Å; F266-W415 HydrophobicContact CB-CZ3 3.89Å; F266-W415 AromaticContact CD1-CH2 3.8Å; F266-W415 HydrophobicContact CD1-CH2 3.8Å; F266-W415 AromaticContact CD1-CZ3 3.8Å; F266-W415 HydrophobicContact CD1-CZ3 3.8Å; F266-W415 HydrophobicContact CD2-CZ3 4.45Å; F266-W415 HydrophobicContact CE1-CH2 4.19Å; F266-W415 HydrophobicContact CE1-CZ3 4.45Å; F266-W415 HydrophobicContact CG-CH2 4.29Å; F266-W415 AromaticContact CG-CZ3 3.8Å; F266-W415 HydrophobicContact CG-CZ3 3.8Å; F266-I420 WeakPolarHBondContact O-CA 3.03Å; F266-M421 HydrophobicContact CB-CB 4.23Å; F266-M421 PolarHBondContact N-O 3.45Å; F266-M421 PolarHBondContact O-N 3.03Å; F266-E423 HydrophobicContact CE2-CB 3.93Å
267	Y	98.3	Very high	96.4	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.008	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	111.9	168.1	-62	-28.1	0	0	0	110.1	V265 G269 V270 V272 P308 P310 I313 T322 L419 I420	V265-Y267 HydrophobicContact CG1-CD1 4.42Å; V265-Y267 HydrophobicContact CG1-CE1 3.8Å; Y267-G269 VanDerWaalsContact C-N 3.26Å; Y267-G269 PolarHBondContact O-N 2.81Å; Y267-V270 PolarHBondContact N-O 2.53Å; Y267-V270 WeakPolarHBondContact O-CB 3.35Å; Y267-V270 PolarHBondContact O-N 3.31Å; Y267-V272 HydrophobicContact CD1-CG2 4.38Å; Y267-V272 HydrophobicContact CD2-CB 4.2Å; Y267-V272 HydrophobicContact CD2-CG1 3.73Å; Y267-V272 HydrophobicContact CD2-CG2 3.72Å; Y267-V272 HydrophobicContact CE1-CG2 4.38Å; Y267-V272 HydrophobicContact CE2-CB 4.39Å; Y267-V272 HydrophobicContact CE2-CG1 4.38Å; Y267-V272 HydrophobicContact CE2-CG2 3.72Å; Y267-V272 HydrophobicContact CG-CG1 4.2Å; Y267-V272 HydrophobicContact CG-CG2 4.03Å; Y267-P308 HydrophobicContact CE2-CG 4.18Å; Y267-P308 PolarHBondContact OH-O 3.21Å; Y267-P310 HydrophobicContact CD2-CB 4.36Å; Y267-P310 HydrophobicContact CE2-CB 4.21Å; Y267-I313 HydrophobicContact CD2-CD1 4Å; Y267-I313 HydrophobicContact CG-CD1 4.37Å; Y267-T322 HydrophobicContact CD1-CG2 3.89Å; Y267-T322 HydrophobicContact CD2-CG2 4.22Å; Y267-T322 HydrophobicContact CE1-CG2 3.9Å; Y267-T322 HydrophobicContact CE2-CG2 4.23Å; Y267-T322 HydrophobicContact CG-CG2 4.08Å; Y267-L419 VanDerWaalsContact CA-O 3.28Å; Y267-L419 WeakPolarHBondContact CA-O 3.36Å; Y267-L419 WeakPolarHBondContact CD1-O 3.15Å; Y267-I420 HydrophobicContact CD1-CB 4.4Å; Y267-I420 HydrophobicContact CD1-CG1 3.96Å; Y267-I420 HydrophobicContact CD1-CG2 4.32Å; Y267-I420 HydrophobicContact CE1-CB 4.38Å; Y267-I420 HydrophobicContact CE1-CD1 4.27Å; Y267-I420 HydrophobicContact CE1-CG1 3.89Å; Y267-I420 HydrophobicContact CE1-CG2 3.95Å
268	R	95.8	Very high	96.6	Very high	97 Å²	97	47.4 Å²	47.4	37%	0.366	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	45.2	177.5	-145.1	-114.5	-167.4	137.2	4.6	112.7	V270 Q318 E416 K418 L419	R268-V270 VanDerWaalsContact C-N 3.33Å; R268-V270 PolarHBondContact O-N 3.15Å; R268-Q318 HydrophobicContact CB-CG 4.47Å; R268-E416 CarbonylContact C-O 3.46Å; R268-E416 WeakPolarHBondContact CA-O 3.14Å; R268-E416 WeakPolarHBondContact CG-O 3.28Å; R268-E416 VanDerWaalsContact O-O 3.1Å; R268-K418 WeakPolarHBondContact CA-O 3.12Å; R268-K418 PolarHBondContact N-O 2.89Å; R268-L419 PolarHBondContact N-O 3.2Å
269	G	94.8	Very high	96.7	Very high	22 Å²	22	44.8 Å²	44.8	23%	0.227	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.6	-9.6	-179.2	0	0	0	0	0	115.9	Y267	Y267-G269 VanDerWaalsContact C-N 3.26Å; Y267-G269 PolarHBondContact O-N 2.81Å
270	V	96.1	Very high	96.7	Very high	94 Å²	94	47.3 Å²	47.3	57%	0.57	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.6	122.1	-179.4	-177.9	0	0	0	0	109.8	F266 Y267 R268 V272	F266-V270 CarbonylContact C-O 3.57Å; F266-V270 WeakPolarHBondContact CA-O 3.48Å; Y267-V270 PolarHBondContact N-O 2.53Å; Y267-V270 WeakPolarHBondContact O-CB 3.35Å; Y267-V270 PolarHBondContact O-N 3.31Å; R268-V270 VanDerWaalsContact C-N 3.33Å; R268-V270 PolarHBondContact O-N 3.15Å; V270-V272 PolarHBondContact O-N 3.48Å
271	K	97.2	Very high	96.6	Very high	112 Å²	112	46 Å²	46	49%	0.487	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	121.7	174	-168.9	169.4	67.4	168.7	0	109.6	A264 V265 F266 E274	A264-K271 HydrophobicContact CB-CD 4.28Å; V265-K271 WeakPolarHBondContact O-CA 3.32Å; F266-K271 HydrophobicContact CD1-CB 3.73Å; F266-K271 HydrophobicContact CD1-CG 4.26Å; F266-K271 HydrophobicContact CE1-CB 3.63Å; F266-K271 HydrophobicContact CE1-CD 4.13Å; F266-K271 HydrophobicContact CE1-CG 3.92Å; F266-K271 HydrophobicContact CZ-CB 4.47Å; F266-K271 HydrophobicContact CZ-CD 4.22Å; F266-K271 HydrophobicContact CZ-CG 4.28Å; K271-E274 HydrophobicContact CD-CB 4.31Å; K271-E274 IonicContact NZ-OE1 2.74Å; K271-E274 IonicContact NZ-OE2 3.42Å; K271-E274 PolarHBondContact NZ-OE2 3.26Å
272	V	96.4	Very high	96.6	Very high	61 Å²	61	46 Å²	46	37%	0.37	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	-20.9	-176.2	-68.1	0	0	0	0	113.4	V265 Y267 V270 P308	V265-V272 HydrophobicContact CB-CG2 4Å; V265-V272 HydrophobicContact CG1-CG2 3.8Å; V265-V272 VanDerWaalsContact O-CG2 3.31Å; V265-V272 WeakPolarHBondContact O-CG2 3.28Å; V265-V272 PolarHBondContact O-N 2.97Å; Y267-V272 HydrophobicContact CD1-CG2 4.38Å; Y267-V272 HydrophobicContact CD2-CB 4.2Å; Y267-V272 HydrophobicContact CD2-CG1 3.73Å; Y267-V272 HydrophobicContact CD2-CG2 3.72Å; Y267-V272 HydrophobicContact CE1-CG2 4.38Å; Y267-V272 HydrophobicContact CE2-CB 4.39Å; Y267-V272 HydrophobicContact CE2-CG1 4.38Å; Y267-V272 HydrophobicContact CE2-CG2 3.72Å; Y267-V272 HydrophobicContact CG-CG1 4.2Å; Y267-V272 HydrophobicContact CG-CG2 4.03Å; V270-V272 PolarHBondContact O-N 3.48Å; V272-P308 HydrophobicContact CB-CG 4.25Å; V272-P308 HydrophobicContact CG2-CG 3.68Å
273	S	96	Very high	96.6	Very high	33 Å²	33	44.2 Å²	44.2	23%	0.231	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	150	173.4	-178.6	0	0	0	0	109.8	A264 V265	A264-S273 WeakPolarHBondContact CA-O 3.38Å; V265-S273 PolarHBondContact N-O 3.2Å; V265-S273 PolarHBondContact O-N 3.27Å
274	E	96.9	Very high	96.5	Very high	88 Å²	88	45.8 Å²	45.8	41%	0.411	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	130.7	168	-180	166.6	-131.3	0	0	108.7	R262 V263 A264 K271	R262-E274 HydrophobicContact CG-CG 4.41Å; R262-E274 IonicContact CZ-OE1 2.77Å; R262-E274 IonicContact NH1-OE1 3.28Å; R262-E274 PolarHBondContact NH1-OE1 2.86Å; V263-E274 CarbonylContact O-C 3.56Å; V263-E274 VanDerWaalsContact O-CA 3.28Å; V263-E274 WeakPolarHBondContact O-CA 3.42Å; A264-E274 HydrophobicContact CB-CB 4.37Å; A264-E274 HydrophobicContact CB-CG 4.32Å; K271-E274 HydrophobicContact CD-CB 4.31Å; K271-E274 IonicContact NZ-OE1 2.74Å; K271-E274 IonicContact NZ-OE2 3.42Å; K271-E274 PolarHBondContact NZ-OE2 3.26Å
275	Q	95.6	Very high	96.5	Very high	35 Å²	35	45.7 Å²	45.7	16%	0.164	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	151.5	179.1	63.8	-178.7	92.4	0	0	111.8	R262 V263 V277 V305	R262-Q275 WeakPolarHBondContact CA-O 3.18Å; V263-Q275 PolarHBondContact N-O 3.09Å; V263-Q275 PolarHBondContact O-N 3.17Å; Q275-V277 HydrophobicContact CG-CG2 4.45Å; Q275-V305 HydrophobicContact CG-CG1 4.48Å
276	E	96.6	Very high	96.5	Very high	143 Å²	143	46.3 Å²	46.3	67%	0.668	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-85	147.3	164.6	-67.7	-168	158.1	0	0	110.6
277	V	96.6	Very high	96.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	93	-179.7	-173	0	0	0	0	106.4	F261 V263 Q275 N279 L283 A294 C303 V305	F261-V277 HydrophobicContact CB-CB 4.31Å; F261-V277 PolarHBondContact N-O 3.26Å; F261-V277 WeakPolarHBondContact O-CA 3.31Å; F261-V277 WeakPolarHBondContact O-CB 3.19Å; F261-V277 PolarHBondContact O-N 3.43Å; V263-V277 HydrophobicContact CG2-CG2 3.99Å; Q275-V277 HydrophobicContact CG-CG2 4.45Å; V277-N279 HydrophobicContact CG1-CB 4.39Å; V277-N279 PolarHBondContact O-N 2.89Å; V277-L283 HydrophobicContact CG1-CB 4.19Å; V277-A294 HydrophobicContact CG1-CB 4.46Å; V277-C303 HydrophobicContact CG1-CB 3.37Å; V277-V305 HydrophobicContact CG1-CG2 4.3Å; V277-V305 HydrophobicContact CG2-CG2 3.62Å
278	P	94.3	Very high	96.2	Very high	98 Å²	98	51.6 Å²	51.6	64%	0.636	27%	0.266	S	S	*	.			trans	-77.7	63.7	-176.4	33.2	-36.1	0	0	0	110.5	H260	H260-P278 VanDerWaalsContact CD2-C 3.44Å; H260-P278 VanDerWaalsContact CD2-CA 3.5Å; H260-P278 WeakPolarHBondContact CD2-CA 3.23Å
279	N	95.3	Very high	95.9	Very high	27 Å²	27	48.9 Å²	48.9	14%	0.144	26%	0.26	C	S	.	.			trans	-140.9	122.1	175.9	-175.8	37	0	0	0	111.1	H260 F261 V277 G282 G301 C303	H260-N279 PolarHBondContact CD2-N 2.95Å; F261-N279 WeakPolarHBondContact CD2-O 3.38Å; F261-N279 WeakPolarHBondContact CE2-O 3.47Å; V277-N279 HydrophobicContact CG1-CB 4.39Å; V277-N279 PolarHBondContact O-N 2.89Å; N279-G282 PolarHBondContact ND2-O 3.32Å; N279-G301 PolarHBondContact ND2-O 3.13Å; N279-C303 HydrophobicContact CB-CB 3.97Å; N279-C303 VanDerWaalsContact CB-SG 3.51Å; N279-C303 PolarHBondContact ND2-N 3.15Å
280	E	94.4	Very high	95.6	Very high	53 Å²	53	53.6 Å²	53.6	25%	0.248	28%	0.28	C	S	.	.	S	Bend	trans	-77.9	-25.6	-174.8	-53.5	-173.3	-172	0	0	113.3	H256 K258 T259 G282	H256-E280 IonicContact CD2-OE2 2.97Å; H256-E280 PolarHBondContact CD2-OE2 2.86Å; H256-E280 IonicContact CE1-OE2 3.2Å; H256-E280 IonicContact NE2-OE2 2.91Å; H256-E280 PolarHBondContact NE2-OE2 3.25Å; K258-E280 WeakPolarHBondContact CE-OE1 3.43Å; K258-E280 VanDerWaalsContact CG-OE1 3.23Å; K258-E280 WeakPolarHBondContact CG-OE1 3.38Å; T259-E280 VanDerWaalsContact O-CA 3.23Å; T259-E280 WeakPolarHBondContact O-CA 3.41Å; T259-E280 WeakPolarHBondContact O-CG 3.41Å; E280-G282 VanDerWaalsContact C-N 3.26Å; E280-G282 PolarHBondContact O-N 2.93Å
281	A	94.9	Very high	95.2	Very high	41 Å²	41	50.2 Å²	50.2	34%	0.339	26%	0.26	S	S	.	.	S	Bend	trans	-67.6	-29.3	176.4	0	0	0	0	0	112.4	G301 L302 G335 M336	A281-G301 WeakPolarHBondContact CB-O 3.37Å; A281-L302 HydrophobicContact CB-CD2 4.48Å; A281-G335 VanDerWaalsContact O-CA 3.26Å; A281-G335 WeakPolarHBondContact O-CA 3.46Å; A281-M336 PolarHBondContact O-N 3.2Å; A281-M336 VanDerWaalsContact O-N 3.09Å
282	G	96.8	Very high	94.4	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	128.4	-161.7	-179.5	0	0	0	0	0	114.6	N279 E280 C303 V334	N279-G282 PolarHBondContact ND2-O 3.32Å; E280-G282 VanDerWaalsContact C-N 3.26Å; E280-G282 PolarHBondContact O-N 2.93Å; G282-C303 PolarHBondContact O-N 3.41Å; G282-C303 VanDerWaalsContact O-N 3.09Å; G282-V334 CarbonylContact C-O 3.6Å; G282-V334 WeakPolarHBondContact CA-O 3.43Å
283	L	97.9	Very high	93.9	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	156.6	-175.4	67.2	98.7	0	0	0	112.2	F261 V263 V277 L285 C303 V305 D333 V334 V424	F261-L283 HydrophobicContact CB-CD2 3.56Å; F261-L283 HydrophobicContact CD1-CD2 4.27Å; F261-L283 HydrophobicContact CG-CD2 3.89Å; V263-L283 HydrophobicContact CG2-CD1 4.19Å; V263-L283 HydrophobicContact CG2-CD2 3.44Å; V263-L283 VanDerWaalsContact CG2-CD2 3.44Å; V263-L283 HydrophobicContact CG2-CG 4.43Å; V277-L283 HydrophobicContact CG1-CB 4.19Å; L283-L285 HydrophobicContact CD1-CD1 4.32Å; L283-L285 HydrophobicContact CD1-CD2 3.62Å; L283-L285 HydrophobicContact CD1-CG 3.55Å; L283-C303 CarbonylContact C-O 3.53Å; L283-C303 WeakPolarHBondContact CA-O 3.16Å; L283-C303 WeakPolarHBondContact CB-O 3.33Å; L283-V305 HydrophobicContact CB-CG2 4.2Å; L283-D333 WeakPolarHBondContact O-CA 3.26Å; L283-V334 HydrophobicContact CG-CB 4.45Å; L283-V334 PolarHBondContact N-O 3.41Å; L283-V334 PolarHBondContact O-N 2.99Å; L283-V334 VanDerWaalsContact O-O 3.11Å; L283-V424 HydrophobicContact CD2-CG1 3.98Å
284	R	97.8	Very high	93.7	Very high	34 Å²	34	54.5 Å²	54.5	13%	0.128	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	109.7	174.2	171.3	173.3	-70.8	151.4	4.6	108.8	V286 D297 T300 L302 C303 I304 V305 D333	R284-V286 HydrophobicContact CG-CG1 3.86Å; R284-D297 IonicContact NH1-OD2 3.9Å; R284-D297 PolarHBondContact NH1-OD2 3.31Å; R284-D297 VanDerWaalsContact NH1-OD2 3.11Å; R284-T300 PolarHBondContact NH1-OG1 3.13Å; R284-L302 HydrophobicContact CB-CB 4.28Å; R284-L302 HydrophobicContact CB-CD1 4.28Å; R284-C303 PolarHBondContact N-O 3.15Å; R284-I304 WeakPolarHBondContact O-CA 3.4Å; R284-V305 PolarHBondContact O-N 2.96Å; R284-D333 VanDerWaalsContact CG-OD1 3.27Å; R284-D333 WeakPolarHBondContact CG-OD1 3.14Å; R284-D333 IonicContact CZ-OD1 3.63Å; R284-D333 IonicContact CZ-OD2 3.11Å; R284-D333 IonicContact NE-OD1 3.43Å; R284-D333 PolarHBondContact NE-OD1 3.41Å; R284-D333 IonicContact NE-OD2 2.91Å; R284-D333 IonicContact NH2-OD1 2.83Å; R284-D333 IonicContact NH2-OD2 3.62Å; R284-D333 PolarHBondContact NH2-OD2 3.04Å
285	L	98.1	Very high	93.5	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	127.2	173.6	-60.2	170.1	0	0	0	109.4	V263 L283 V305 S331 L332 V422	V263-L285 HydrophobicContact CG1-CD2 3.98Å; L283-L285 HydrophobicContact CD1-CD1 4.32Å; L283-L285 HydrophobicContact CD1-CD2 3.62Å; L283-L285 HydrophobicContact CD1-CG 3.55Å; L285-V305 WeakPolarHBondContact CA-O 3.21Å; L285-V305 HydrophobicContact CD2-CB 4.06Å; L285-V305 HydrophobicContact CD2-CG1 4Å; L285-S331 CarbonylContact O-C 3.6Å; L285-S331 WeakPolarHBondContact O-CA 3.37Å; L285-S331 WeakPolarHBondContact O-CB 3.26Å; L285-L332 HydrophobicContact CB-CB 4.25Å; L285-L332 HydrophobicContact CD1-CB 4.45Å; L285-L332 HydrophobicContact CD1-CD2 3.99Å; L285-L332 HydrophobicContact CD1-CG 4.33Å; L285-L332 PolarHBondContact N-O 3.43Å; L285-L332 PolarHBondContact O-N 2.98Å; L285-V422 HydrophobicContact CD1-CB 4.35Å; L285-V422 HydrophobicContact CD1-CG1 3.83Å; L285-V422 HydrophobicContact CD1-CG2 4.44Å; L285-V422 HydrophobicContact CD2-CG1 4.36Å
286	V	97.4	Very high	93.5	Very high	14 Å²	14	55.7 Å²	55.7	9%	0.085	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	172.3	175.7	-63.1	0	0	0	0	109.9	R284 R288 I304 V305 S306 L307	R284-V286 HydrophobicContact CG-CG1 3.86Å; V286-R288 HydrophobicContact CG2-CB 4.24Å; V286-R288 HydrophobicContact CG2-CG 4.08Å; V286-I304 HydrophobicContact CG1-CG2 4.49Å; V286-I304 HydrophobicContact CG2-CG2 3.47Å; V286-I304 VanDerWaalsContact CG2-CG2 3.47Å; V286-V305 PolarHBondContact N-O 2.86Å; V286-S306 CarbonylContact O-C 3.53Å; V286-S306 WeakPolarHBondContact O-CA 3.28Å; V286-L307 PolarHBondContact O-N 3.46Å
287	Y	97.3	Very high	93.3	Very high	37 Å²	37	50.1 Å²	50.1	15%	0.145	28%	0.275	C	S	.	.			trans	-111.3	101.7	162.8	-178.7	-117.2	0	0	0	109.6	P289 L307 R309 Q323 L326 D327	Y287-P289 HydrophobicContact CE1-CG 4.43Å; Y287-P289 HydrophobicContact CE2-CB 4.2Å; Y287-L307 WeakPolarHBondContact CD2-O 3.19Å; Y287-R309 HydrophobicContact CE2-CG 4.43Å; Y287-Q323 VanDerWaalsContact CZ-NE2 3.29Å; Y287-Q323 PolarHBondContact OH-NE2 3.48Å; Y287-Q323 PolarHBondContact OH-OE1 3.12Å; Y287-L326 VanDerWaalsContact CB-O 3.31Å; Y287-L326 WeakPolarHBondContact CB-O 3.4Å; Y287-L326 HydrophobicContact CD1-CB 3.76Å; Y287-L326 HydrophobicContact CD2-CB 3.83Å; Y287-L326 HydrophobicContact CD2-CD1 4.01Å; Y287-L326 HydrophobicContact CD2-CD2 3.97Å; Y287-L326 HydrophobicContact CD2-CG 4.15Å; Y287-L326 HydrophobicContact CE1-CB 4.07Å; Y287-L326 HydrophobicContact CE2-CB 4.15Å; Y287-L326 HydrophobicContact CE2-CD1 3.84Å; Y287-L326 HydrophobicContact CE2-CG 4.43Å; Y287-L326 HydrophobicContact CG-CB 3.62Å; Y287-L326 HydrophobicContact CG-CD2 4.28Å; Y287-L326 HydrophobicContact CG-CG 4.39Å; Y287-D327 WeakPolarHBondContact CE1-OD1 3.42Å
288	R	94.7	Very high	93.1	Very high	95 Å²	95	58 Å²	58	36%	0.358	31%	0.312	S	S	.	.			trans	-136.1	90.5	176.2	-77.1	-159.7	-70.4	170.1	-7.1	109.1	V286 D290 V291 S306	V286-R288 HydrophobicContact CG2-CB 4.24Å; V286-R288 HydrophobicContact CG2-CG 4.08Å; R288-D290 WeakPolarHBondContact CB-OD1 3.34Å; R288-D290 PolarHBondContact O-N 2.81Å; R288-V291 HydrophobicContact CB-CB 4.41Å; R288-V291 HydrophobicContact CB-CG2 4.15Å; R288-V291 PolarHBondContact O-N 3.1Å; R288-S306 WeakPolarHBondContact CA-OG 2.88Å; R288-S306 PolarHBondContact N-OG 3.13Å; R288-S306 WeakPolarHBondContact O-CB 3.49Å; R288-S306 PolarHBondContact O-OG 3.09Å
289	P	88.6	Confident	92.9	Very high	39 Å²	39	62 Å²	62	25%	0.253	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	2.6	-164.1	35.2	-40.4	0	0	0	114	Y287 R309	Y287-P289 HydrophobicContact CE1-CG 4.43Å; Y287-P289 HydrophobicContact CE2-CB 4.2Å; P289-R309 HydrophobicContact CB-CG 3.82Å; P289-R309 PolarHBondContact O-NH2 3.35Å
290	D	88.4	Confident	92.7	Very high	121 Å²	121	63.8 Å²	63.8	65%	0.647	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-19.6	167.7	56.3	-52.8	0	0	0	113	R288	R288-D290 WeakPolarHBondContact CB-OD1 3.34Å; R288-D290 PolarHBondContact O-N 2.81Å
291	V	87.8	Confident	92.7	Very high	23 Å²	23	62.7 Å²	62.7	14%	0.139	34%	0.337	C	S	.	.			trans	-101.9	115.9	-179.7	-178.4	0	0	0	0	109.3	R288 D293 V295 S306	R288-V291 HydrophobicContact CB-CB 4.41Å; R288-V291 HydrophobicContact CB-CG2 4.15Å; R288-V291 PolarHBondContact O-N 3.1Å; V291-D293 VanDerWaalsContact CG1-O 3.23Å; V291-D293 WeakPolarHBondContact CG1-O 3.35Å; V291-V295 HydrophobicContact CG1-CG2 3.88Å; V291-S306 WeakPolarHBondContact O-CB 3.28Å
292	N	80.3	Confident	92.8	Very high	135 Å²	135	61 Å²	61	72%	0.722	32%	0.322	S	S	*	.			trans	-98.2	-36.8	178.9	-66	-35.8	0	0	0	112.9
293	D	86.6	Confident	92.8	Very high	127 Å²	127	61.5 Å²	61.5	68%	0.679	33%	0.326	S	S	*	.	S	Bend	trans	-101.2	160.1	-177.4	-62.6	-47.3	0	0	0	111.4	V291 V295	V291-D293 VanDerWaalsContact CG1-O 3.23Å; V291-D293 WeakPolarHBondContact CG1-O 3.35Å; D293-V295 PolarHBondContact O-N 3.37Å
294	A	90.4	Very high	92.8	Very high	35 Å²	35	62.2 Å²	62.2	29%	0.289	33%	0.329	S	S	.	.			trans	-63.9	127.8	171.7	0	0	0	0	0	110.2	V277 I304 V305	V277-A294 HydrophobicContact CG1-CB 4.46Å; A294-I304 WeakPolarHBondContact CA-O 3.29Å; A294-V305 HydrophobicContact CB-CG2 4.36Å
295	V	93.8	Very high	92.7	Very high	70 Å²	70	60.6 Å²	60.6	42%	0.424	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	128.5	-179.6	-179.6	0	0	0	0	109.8	V291 D293 D297 C303 I304	V291-V295 HydrophobicContact CG1-CG2 3.88Å; D293-V295 PolarHBondContact O-N 3.37Å; V295-D297 PolarHBondContact O-N 3.18Å; V295-C303 CarbonylContact O-C 3.48Å; V295-I304 PolarHBondContact N-O 2.91Å; V295-I304 VanDerWaalsContact N-O 3.09Å; V295-I304 WeakPolarHBondContact O-CB 3.43Å; V295-I304 PolarHBondContact O-N 2.96Å
296	L	95.3	Very high	92.7	Very high	77 Å²	77	61.2 Å²	61.2	40%	0.403	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	125.2	176.4	-176.4	63.3	0	0	0	110.8
297	D	93	Very high	92.7	Very high	26 Å²	26	60.6 Å²	60.6	14%	0.139	32%	0.324	C	S	.	.			trans	-85.8	107	168.2	-174.2	0.8	0	0	0	109.5	R284 V295 E299 T300 G301 L302 I304	R284-D297 IonicContact NH1-OD2 3.9Å; R284-D297 PolarHBondContact NH1-OD2 3.31Å; R284-D297 VanDerWaalsContact NH1-OD2 3.11Å; V295-D297 PolarHBondContact O-N 3.18Å; D297-E299 PolarHBondContact O-N 2.88Å; D297-E299 PolarHBondContact OD1-N 3.27Å; D297-E299 VanDerWaalsContact OD1-N 3.11Å; D297-T300 WeakPolarHBondContact CB-OG1 3.44Å; D297-T300 VanDerWaalsContact CG-OG1 3.26Å; D297-T300 PolarHBondContact O-N 3.3Å; D297-T300 WeakPolarHBondContact OD2-CG2 3.23Å; D297-T300 PolarHBondContact OD2-OG1 3.43Å; D297-G301 VanDerWaalsContact O-CA 3.29Å; D297-G301 WeakPolarHBondContact O-CA 3.48Å; D297-G301 PolarHBondContact O-N 2.99Å; D297-L302 VanDerWaalsContact CB-O 3.22Å; D297-L302 WeakPolarHBondContact CB-O 3.41Å; D297-L302 PolarHBondContact N-O 3.26Å; D297-I304 HydrophobicContact CB-CD1 3.85Å; D297-I304 HydrophobicContact CB-CG1 3.98Å
298	H	91.8	Very high	92.6	Very high	167 Å²	167	60.6 Å²	60.6	77%	0.773	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-19.5	-179.5	-64.8	-68.5	0	0	0	113.7
299	E	90.7	Very high	92.7	Very high	182 Å²	182	62.7 Å²	62.7	85%	0.85	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-36.5	178.3	-64.8	-174.9	173.9	0	0	111.7	D297	D297-E299 PolarHBondContact O-N 2.88Å; D297-E299 PolarHBondContact OD1-N 3.27Å; D297-E299 VanDerWaalsContact OD1-N 3.11Å
300	T	91	Very high	93	Very high	64 Å²	64	61.6 Å²	61.6	39%	0.393	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	-14.1	-174.7	66.5	0	0	0	0	114.2	R284 D297 L302	R284-T300 PolarHBondContact NH1-OG1 3.13Å; D297-T300 WeakPolarHBondContact CB-OG1 3.44Å; D297-T300 VanDerWaalsContact CG-OG1 3.26Å; D297-T300 PolarHBondContact O-N 3.3Å; D297-T300 WeakPolarHBondContact OD2-CG2 3.23Å; D297-T300 PolarHBondContact OD2-OG1 3.43Å; T300-L302 PolarHBondContact O-N 3.3Å
301	G	94.3	Very high	92.8	Very high	29 Å²	29	61.8 Å²	61.8	30%	0.299	33%	0.334	S	S	.	.			trans	74	1.4	-173.9	0	0	0	0	0	114.1	N279 A281 D297	N279-G301 PolarHBondContact ND2-O 3.13Å; A281-G301 WeakPolarHBondContact CB-O 3.37Å; D297-G301 VanDerWaalsContact O-CA 3.29Å; D297-G301 WeakPolarHBondContact O-CA 3.48Å; D297-G301 PolarHBondContact O-N 2.99Å
302	L	96.3	Very high	92.6	Very high	5 Å²	5	64 Å²	64	3%	0.026	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-89.7	146.7	-179.5	-61.1	-179.7	0	0	0	111.5	A281 R284 D297 T300 D333	A281-L302 HydrophobicContact CB-CD2 4.48Å; R284-L302 HydrophobicContact CB-CB 4.28Å; R284-L302 HydrophobicContact CB-CD1 4.28Å; D297-L302 VanDerWaalsContact CB-O 3.22Å; D297-L302 WeakPolarHBondContact CB-O 3.41Å; D297-L302 PolarHBondContact N-O 3.26Å; T300-L302 PolarHBondContact O-N 3.3Å; L302-D333 HydrophobicContact CD1-CB 3.99Å
303	C	97.4	Very high	93.2	Very high	12 Å²	12	58.9 Å²	58.9	8%	0.081	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	121.8	170.1	-91.2	0	0	0	0	110.4	V277 N279 G282 L283 R284 V295 V305	V277-C303 HydrophobicContact CG1-CB 3.37Å; N279-C303 HydrophobicContact CB-CB 3.97Å; N279-C303 VanDerWaalsContact CB-SG 3.51Å; N279-C303 PolarHBondContact ND2-N 3.15Å; G282-C303 PolarHBondContact O-N 3.41Å; G282-C303 VanDerWaalsContact O-N 3.09Å; L283-C303 CarbonylContact C-O 3.53Å; L283-C303 WeakPolarHBondContact CA-O 3.16Å; L283-C303 WeakPolarHBondContact CB-O 3.33Å; R284-C303 PolarHBondContact N-O 3.15Å; V295-C303 CarbonylContact O-C 3.48Å; C303-V305 PolarHBondContact O-N 2.98Å
304	I	96.9	Very high	93.4	Very high	14 Å²	14	60.5 Å²	60.5	7%	0.072	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	123.1	177.9	-54.2	169.1	0	0	0	108.2	R284 V286 A294 V295 D297	R284-I304 WeakPolarHBondContact O-CA 3.4Å; V286-I304 HydrophobicContact CG1-CG2 4.49Å; V286-I304 HydrophobicContact CG2-CG2 3.47Å; V286-I304 VanDerWaalsContact CG2-CG2 3.47Å; A294-I304 WeakPolarHBondContact CA-O 3.29Å; V295-I304 PolarHBondContact N-O 2.91Å; V295-I304 VanDerWaalsContact N-O 3.09Å; V295-I304 WeakPolarHBondContact O-CB 3.43Å; V295-I304 PolarHBondContact O-N 2.96Å; D297-I304 HydrophobicContact CB-CD1 3.85Å; D297-I304 HydrophobicContact CB-CG1 3.98Å
305	V	97.3	Very high	93.5	Very high	1 Å²	1	62 Å²	62	1%	0.006	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	120.3	177.2	176.3	0	0	0	0	108.4	V263 Q275 V277 L283 R284 L285 V286 A294 C303	V263-V305 HydrophobicContact CG1-CG1 4.43Å; Q275-V305 HydrophobicContact CG-CG1 4.48Å; V277-V305 HydrophobicContact CG1-CG2 4.3Å; V277-V305 HydrophobicContact CG2-CG2 3.62Å; L283-V305 HydrophobicContact CB-CG2 4.2Å; R284-V305 PolarHBondContact O-N 2.96Å; L285-V305 WeakPolarHBondContact CA-O 3.21Å; L285-V305 HydrophobicContact CD2-CB 4.06Å; L285-V305 HydrophobicContact CD2-CG1 4Å; V286-V305 PolarHBondContact N-O 2.86Å; A294-V305 HydrophobicContact CB-CG2 4.36Å; C303-V305 PolarHBondContact O-N 2.98Å
306	S	97.4	Very high	93.6	Very high	13 Å²	13	65.2 Å²	65.2	9%	0.091	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	131.2	-179.1	-162.6	0	0	0	0	111.4	V286 R288 V291	V286-S306 CarbonylContact O-C 3.53Å; V286-S306 WeakPolarHBondContact O-CA 3.28Å; R288-S306 WeakPolarHBondContact CA-OG 2.88Å; R288-S306 PolarHBondContact N-OG 3.13Å; R288-S306 WeakPolarHBondContact O-CB 3.49Å; R288-S306 PolarHBondContact O-OG 3.09Å; V291-S306 WeakPolarHBondContact O-CB 3.28Å
307	L	97.4	Very high	93.5	Very high	1 Å²	1	67.4 Å²	67.4	1%	0.005	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-70.4	136.7	170.5	-63	175.8	0	0	0	109.6	V265 V286 Y287 L326 L329 L403 V422	V265-L307 HydrophobicContact CB-CD2 4.37Å; V265-L307 HydrophobicContact CG1-CD2 3.88Å; V265-L307 HydrophobicContact CG2-CD2 3.51Å; V286-L307 PolarHBondContact O-N 3.46Å; Y287-L307 WeakPolarHBondContact CD2-O 3.19Å; L307-L326 HydrophobicContact CB-CD2 3.69Å; L307-L326 HydrophobicContact CD1-CD2 3.55Å; L307-L326 HydrophobicContact CG-CD2 4.3Å; L307-L329 HydrophobicContact CD1-CD2 3.46Å; L307-L329 VanDerWaalsContact CD1-CD2 3.46Å; L307-L329 HydrophobicContact CG-CD2 4.46Å; L307-L403 HydrophobicContact CD1-CD1 3.8Å; L307-V422 HydrophobicContact CD2-CG2 4.03Å
308	P	96.1	Very high	93.7	Very high	37 Å²	37	67.2 Å²	67.2	24%	0.24	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-67.3	159.5	-175.6	27.8	-35.3	0	0	0	112	Y267 V272	Y267-P308 HydrophobicContact CE2-CG 4.18Å; Y267-P308 PolarHBondContact OH-O 3.21Å; V272-P308 HydrophobicContact CB-CG 4.25Å; V272-P308 HydrophobicContact CG2-CG 3.68Å
309	R	95.7	Very high	93.9	Very high	139 Å²	139	60 Å²	60	53%	0.525	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-64.8	146.1	168.7	-62.8	-174.1	171.8	107.7	0.8	109.7	Y287 P289 V311	Y287-R309 HydrophobicContact CE2-CG 4.43Å; P289-R309 HydrophobicContact CB-CG 3.82Å; P289-R309 PolarHBondContact O-NH2 3.35Å; R309-V311 HydrophobicContact CB-CG2 3.68Å; R309-V311 PolarHBondContact O-N 3.06Å
310	P	94.4	Very high	94.2	Very high	15 Å²	15	54.1 Å²	54.1	10%	0.097	31%	0.313	C	S	.	.			trans	-74.4	38.1	174.5	31.5	-33.9	0	0	0	113	Y267 I313 T322 Q323 L326	Y267-P310 HydrophobicContact CD2-CB 4.36Å; Y267-P310 HydrophobicContact CE2-CB 4.21Å; P310-I313 HydrophobicContact CB-CD1 3.57Å; P310-I313 HydrophobicContact CB-CG1 4.33Å; P310-T322 HydrophobicContact CB-CG2 3.89Å; P310-T322 HydrophobicContact CG-CG2 4.35Å; P310-Q323 HydrophobicContact CG-CB 4.17Å; P310-Q323 VanDerWaalsContact CG-OE1 3.23Å; P310-L326 HydrophobicContact CG-CD1 4.32Å
311	V	85.2	Confident	94.6	Very high	126 Å²	126	54.2 Å²	54.2	76%	0.764	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	133.7	178.2	-179.3	0	0	0	0	108.7	R309	R309-V311 HydrophobicContact CB-CG2 3.68Å; R309-V311 PolarHBondContact O-N 3.06Å
312	G	84.5	Confident	94.8	Very high	70 Å²	70	52.9 Å²	52.9	72%	0.722	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	93	-2.9	-179	0	0	0	0	0	115	L314	G312-L314 PolarHBondContact O-N 3.33Å
313	I	91.9	Very high	94.8	Very high	26 Å²	26	54.9 Å²	54.9	13%	0.133	31%	0.306	C	S	.	.			trans	-71.7	115.3	166.9	-57.7	-179	0	0	0	108.6	Y267 P310 D315 Q318 A319	Y267-I313 HydrophobicContact CD2-CD1 4Å; Y267-I313 HydrophobicContact CG-CD1 4.37Å; P310-I313 HydrophobicContact CB-CD1 3.57Å; P310-I313 HydrophobicContact CB-CG1 4.33Å; I313-D315 HydrophobicContact CG2-CB 4.39Å; I313-D315 WeakPolarHBondContact CG2-O 3.44Å; I313-Q318 HydrophobicContact CG2-CB 4.02Å; I313-Q318 HydrophobicContact CG2-CG 3.99Å; I313-A319 HydrophobicContact CB-CB 4.04Å; I313-A319 HydrophobicContact CG2-CB 4.12Å
314	L	90.4	Very high	94.9	Very high	162 Å²	162	61 Å²	61	85%	0.848	33%	0.327	S	S	*	.	S	Bend	trans	-68.1	-38.9	-179.3	-63.5	177.1	0	0	0	112.3	G312 Q316	G312-L314 PolarHBondContact O-N 3.33Å; L314-Q316 PolarHBondContact O-N 2.68Å; L314-Q316 VanDerWaalsContact O-N 3.17Å; L314-Q316 PolarHBondContact O-NE2 3.4Å; L314-Q316 VanDerWaalsContact O-NE2 3.16Å
315	D	93.6	Very high	94.9	Very high	65 Å²	65	61.3 Å²	61.3	35%	0.348	33%	0.329	S	S	.	.			trans	-72.3	104.1	177.6	-177.3	-21.3	0	0	0	109.9	I313 I317 Q318 A319	I313-D315 HydrophobicContact CG2-CB 4.39Å; I313-D315 WeakPolarHBondContact CG2-O 3.44Å; D315-I317 VanDerWaalsContact C-N 3.25Å; D315-I317 PolarHBondContact O-N 3.36Å; D315-I317 WeakPolarHBondContact OD1-CB 3.23Å; D315-I317 PolarHBondContact OD1-N 2.94Å; D315-Q318 HydrophobicContact CB-CB 3.83Å; D315-Q318 WeakPolarHBondContact O-CB 3.39Å; D315-Q318 PolarHBondContact O-N 3.38Å; D315-Q318 PolarHBondContact OD1-N 3.41Å; D315-A319 WeakPolarHBondContact O-CB 3.28Å; D315-A319 PolarHBondContact O-N 2.98Å
316	Q	94.9	Very high	94.9	Very high	139 Å²	139	61.4 Å²	61.4	65%	0.65	33%	0.329	S	S	*	.	H	α-helix	trans	-65	-29.4	-177.1	-61.8	-54.2	-57.7	0	0	112.8	L314 S320	L314-Q316 PolarHBondContact O-N 2.68Å; L314-Q316 VanDerWaalsContact O-N 3.17Å; L314-Q316 PolarHBondContact O-NE2 3.4Å; L314-Q316 VanDerWaalsContact O-NE2 3.16Å; Q316-S320 WeakPolarHBondContact O-CB 3.4Å; Q316-S320 PolarHBondContact O-N 2.88Å; Q316-S320 PolarHBondContact O-OG 2.83Å
317	I	94.4	Very high	94.9	Very high	122 Å²	122	65.7 Å²	65.7	63%	0.626	35%	0.351	S	S	*	.	H	α-helix	trans	-68.7	-49.8	176	-61.3	176	0	0	0	108.4	D315 A319 S320 L321	D315-I317 VanDerWaalsContact C-N 3.25Å; D315-I317 PolarHBondContact O-N 3.36Å; D315-I317 WeakPolarHBondContact OD1-CB 3.23Å; D315-I317 PolarHBondContact OD1-N 2.94Å; I317-A319 VanDerWaalsContact C-N 3.34Å; I317-A319 PolarHBondContact O-N 2.96Å; I317-S320 PolarHBondContact O-N 3.3Å; I317-S320 PolarHBondContact O-OG 3.48Å; I317-L321 HydrophobicContact CG2-CD1 3.99Å; I317-L321 HydrophobicContact CG2-CG 4.45Å; I317-L321 WeakPolarHBondContact O-CG 3.4Å; I317-L321 PolarHBondContact O-N 3.1Å
318	Q	95.4	Very high	94.9	Very high	22 Å²	22	69.1 Å²	69.1	10%	0.103	38%	0.375	C	S	.	.	H	α-helix	trans	-55.3	-49.7	174.5	-178.3	-170.2	-37.3	0	0	111.1	R268 I313 D315 S320 L321 T322 L419	R268-Q318 HydrophobicContact CB-CG 4.47Å; I313-Q318 HydrophobicContact CG2-CB 4.02Å; I313-Q318 HydrophobicContact CG2-CG 3.99Å; D315-Q318 HydrophobicContact CB-CB 3.83Å; D315-Q318 WeakPolarHBondContact O-CB 3.39Å; D315-Q318 PolarHBondContact O-N 3.38Å; D315-Q318 PolarHBondContact OD1-N 3.41Å; Q318-S320 VanDerWaalsContact C-N 3.33Å; Q318-S320 PolarHBondContact O-N 2.89Å; Q318-L321 PolarHBondContact O-N 3.13Å; Q318-T322 WeakPolarHBondContact O-CB 3.28Å; Q318-T322 PolarHBondContact O-N 3.2Å; Q318-T322 PolarHBondContact O-OG1 2.76Å; Q318-L419 HydrophobicContact CG-CD2 3.95Å
319	A	96.9	Very high	94.9	Very high	15 Å²	15	67.6 Å²	67.6	12%	0.124	37%	0.365	C	S	.	.	H	α-helix	trans	-57.2	-45.8	-179.7	0	0	0	0	0	111.8	I313 D315 I317 T322 Q323	I313-A319 HydrophobicContact CB-CB 4.04Å; I313-A319 HydrophobicContact CG2-CB 4.12Å; D315-A319 WeakPolarHBondContact O-CB 3.28Å; D315-A319 PolarHBondContact O-N 2.98Å; I317-A319 VanDerWaalsContact C-N 3.34Å; I317-A319 PolarHBondContact O-N 2.96Å; A319-T322 PolarHBondContact O-N 3.28Å; A319-Q323 WeakPolarHBondContact O-CB 3.48Å; A319-Q323 PolarHBondContact O-N 3.5Å
320	S	97.8	Very high	94.9	Very high	60 Å²	60	63.1 Å²	63.1	42%	0.42	36%	0.362	S	S	.	.	H	α-helix	trans	-64.4	-39.6	178.5	73.7	0	0	0	0	113	Q316 I317 Q318 Q323 R324	Q316-S320 WeakPolarHBondContact O-CB 3.4Å; Q316-S320 PolarHBondContact O-N 2.88Å; Q316-S320 PolarHBondContact O-OG 2.83Å; I317-S320 PolarHBondContact O-N 3.3Å; I317-S320 PolarHBondContact O-OG 3.48Å; Q318-S320 VanDerWaalsContact C-N 3.33Å; Q318-S320 PolarHBondContact O-N 2.89Å; S320-Q323 PolarHBondContact O-N 2.97Å; S320-R324 VanDerWaalsContact O-CG 3.27Å; S320-R324 WeakPolarHBondContact O-CG 3.45Å; S320-R324 PolarHBondContact O-N 2.94Å
321	L	97.9	Very high	95	Very high	66 Å²	66	62.9 Å²	62.9	35%	0.346	36%	0.361	S	S	.	.	H	α-helix	trans	-70.4	-43.3	178.3	-68.2	173.5	0	0	0	111.5	I317 Q318 Q323 R324 I325 L419	I317-L321 HydrophobicContact CG2-CD1 3.99Å; I317-L321 HydrophobicContact CG2-CG 4.45Å; I317-L321 WeakPolarHBondContact O-CG 3.4Å; I317-L321 PolarHBondContact O-N 3.1Å; Q318-L321 PolarHBondContact O-N 3.13Å; L321-Q323 VanDerWaalsContact C-N 3.34Å; L321-R324 PolarHBondContact O-N 3.25Å; L321-I325 PolarHBondContact O-N 2.76Å; L321-L419 HydrophobicContact CB-CD1 3.69Å; L321-L419 HydrophobicContact CB-CD2 4.24Å; L321-L419 HydrophobicContact CD1-CD1 4.49Å
322	T	98.1	Very high	95.6	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-58.9	-46.9	173.3	-64	0	0	0	0	110.5	Y267 P310 Q318 A319 R324 I325 L326 I420	Y267-T322 HydrophobicContact CD1-CG2 3.89Å; Y267-T322 HydrophobicContact CD2-CG2 4.22Å; Y267-T322 HydrophobicContact CE1-CG2 3.9Å; Y267-T322 HydrophobicContact CE2-CG2 4.23Å; Y267-T322 HydrophobicContact CG-CG2 4.08Å; P310-T322 HydrophobicContact CB-CG2 3.89Å; P310-T322 HydrophobicContact CG-CG2 4.35Å; Q318-T322 WeakPolarHBondContact O-CB 3.28Å; Q318-T322 PolarHBondContact O-N 3.2Å; Q318-T322 PolarHBondContact O-OG1 2.76Å; A319-T322 PolarHBondContact O-N 3.28Å; T322-R324 VanDerWaalsContact C-N 3.34Å; T322-R324 PolarHBondContact O-N 2.94Å; T322-I325 PolarHBondContact O-N 3.2Å; T322-L326 HydrophobicContact CG2-CD1 4.07Å; T322-L326 HydrophobicContact CG2-CG 4.47Å; T322-L326 WeakPolarHBondContact O-CG 3.43Å; T322-L326 PolarHBondContact O-N 3.49Å; T322-L326 VanDerWaalsContact O-N 3.07Å; T322-I420 HydrophobicContact CG2-CD1 4Å; T322-I420 HydrophobicContact CG2-CG1 3.97Å
323	Q	97.9	Very high	96.3	Very high	48 Å²	48	53.6 Å²	53.6	22%	0.224	29%	0.29	C	S	.	.	H	α-helix	trans	-58.7	-44.1	178.5	-170.6	60.2	59.6	0	0	112	Y287 P310 A319 S320 L321 I325 L326 D327	Y287-Q323 VanDerWaalsContact CZ-NE2 3.29Å; Y287-Q323 PolarHBondContact OH-NE2 3.48Å; Y287-Q323 PolarHBondContact OH-OE1 3.12Å; P310-Q323 HydrophobicContact CG-CB 4.17Å; P310-Q323 VanDerWaalsContact CG-OE1 3.23Å; A319-Q323 WeakPolarHBondContact O-CB 3.48Å; A319-Q323 PolarHBondContact O-N 3.5Å; S320-Q323 PolarHBondContact O-N 2.97Å; L321-Q323 VanDerWaalsContact C-N 3.34Å; Q323-I325 VanDerWaalsContact C-N 3.31Å; Q323-I325 PolarHBondContact O-N 2.97Å; Q323-L326 WeakPolarHBondContact O-CB 3.24Å; Q323-L326 PolarHBondContact O-N 2.83Å; Q323-L326 VanDerWaalsContact O-N 3.13Å; Q323-D327 PolarHBondContact NE2-OD1 3.27Å; Q323-D327 PolarHBondContact O-N 3.14Å
324	R	97.7	Very high	96.6	Very high	139 Å²	139	52.4 Å²	52.4	53%	0.525	28%	0.284	S	S	.	.	H	α-helix	trans	-59.4	-38.9	177.8	-75.4	171.8	63.9	178	2.3	113.4	S320 L321 T322 S328	S320-R324 VanDerWaalsContact O-CG 3.27Å; S320-R324 WeakPolarHBondContact O-CG 3.45Å; S320-R324 PolarHBondContact O-N 2.94Å; L321-R324 PolarHBondContact O-N 3.25Å; T322-R324 VanDerWaalsContact C-N 3.34Å; T322-R324 PolarHBondContact O-N 2.94Å; R324-S328 PolarHBondContact O-N 3.36Å; R324-S328 PolarHBondContact O-OG 3.39Å
325	I	98.3	Very high	96.8	Very high	22 Å²	22	44.7 Å²	44.7	11%	0.113	24%	0.244	C	C	.	.	H	α-helix	trans	-67.5	-43.9	176.2	-64	170.4	0	0	0	109.9	L321 T322 Q323 S328 L329 V349 L403 L419 I420	L321-I325 PolarHBondContact O-N 2.76Å; T322-I325 PolarHBondContact O-N 3.2Å; Q323-I325 VanDerWaalsContact C-N 3.31Å; Q323-I325 PolarHBondContact O-N 2.97Å; I325-S328 CarbonylContact O-C 3.53Å; I325-S328 PolarHBondContact O-N 3.14Å; I325-L329 PolarHBondContact O-N 2.99Å; I325-L329 VanDerWaalsContact O-N 3.1Å; I325-V349 HydrophobicContact CG2-CG1 3.92Å; I325-V349 HydrophobicContact CG2-CG2 4.24Å; I325-L403 HydrophobicContact CG2-CB 4.33Å; I325-L419 HydrophobicContact CD1-CB 4.1Å; I325-L419 HydrophobicContact CD1-CD1 3.7Å; I325-I420 HydrophobicContact CB-CD1 3.87Å; I325-I420 HydrophobicContact CG2-CD1 3.68Å
326	L	97.8	Very high	96.8	Very high	3 Å²	3	42.5 Å²	42.5	2%	0.016	23%	0.232	C	C	.	.	H	α-helix	trans	-60.1	-47	178.4	-69.1	174	0	0	0	111.9	Y287 L307 P310 T322 Q323 S328 L329 I420	Y287-L326 VanDerWaalsContact CB-O 3.31Å; Y287-L326 WeakPolarHBondContact CB-O 3.4Å; Y287-L326 HydrophobicContact CD1-CB 3.76Å; Y287-L326 HydrophobicContact CD2-CB 3.83Å; Y287-L326 HydrophobicContact CD2-CD1 4.01Å; Y287-L326 HydrophobicContact CD2-CD2 3.97Å; Y287-L326 HydrophobicContact CD2-CG 4.15Å; Y287-L326 HydrophobicContact CE1-CB 4.07Å; Y287-L326 HydrophobicContact CE2-CB 4.15Å; Y287-L326 HydrophobicContact CE2-CD1 3.84Å; Y287-L326 HydrophobicContact CE2-CG 4.43Å; Y287-L326 HydrophobicContact CG-CB 3.62Å; Y287-L326 HydrophobicContact CG-CD2 4.28Å; Y287-L326 HydrophobicContact CG-CG 4.39Å; L307-L326 HydrophobicContact CB-CD2 3.69Å; L307-L326 HydrophobicContact CD1-CD2 3.55Å; L307-L326 HydrophobicContact CG-CD2 4.3Å; P310-L326 HydrophobicContact CG-CD1 4.32Å; T322-L326 HydrophobicContact CG2-CD1 4.07Å; T322-L326 HydrophobicContact CG2-CG 4.47Å; T322-L326 WeakPolarHBondContact O-CG 3.43Å; T322-L326 PolarHBondContact O-N 3.49Å; T322-L326 VanDerWaalsContact O-N 3.07Å; Q323-L326 WeakPolarHBondContact O-CB 3.24Å; Q323-L326 PolarHBondContact O-N 2.83Å; Q323-L326 VanDerWaalsContact O-N 3.13Å; L326-S328 PolarHBondContact O-N 3.41Å; L326-L329 WeakPolarHBondContact O-CB 3.29Å; L326-L329 PolarHBondContact O-N 3.11Å; L326-I420 HydrophobicContact CD2-CD1 3.81Å; L326-I420 HydrophobicContact CG-CD1 3.92Å
327	D	96.9	Very high	96.7	Very high	103 Å²	103	39 Å²	39	55%	0.551	22%	0.223	S	C	*	.	H	α-helix	trans	-62.7	-26.1	-179.7	-64.2	-22.3	0	0	0	112.9	Y287 Q323	Y287-D327 WeakPolarHBondContact CE1-OD1 3.42Å; Q323-D327 PolarHBondContact NE2-OD1 3.27Å; Q323-D327 PolarHBondContact O-N 3.14Å
328	S	96.5	Very high	96.3	Very high	73 Å²	73	40.7 Å²	40.7	51%	0.51	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	6.4	-177.6	-51.6	0	0	0	0	113.7	R324 I325 L326 G330 V349	R324-S328 PolarHBondContact O-N 3.36Å; R324-S328 PolarHBondContact O-OG 3.39Å; I325-S328 CarbonylContact O-C 3.53Å; I325-S328 PolarHBondContact O-N 3.14Å; L326-S328 PolarHBondContact O-N 3.41Å; S328-G330 PolarHBondContact O-N 3.45Å; S328-V349 VanDerWaalsContact O-CG2 3.24Å; S328-V349 WeakPolarHBondContact O-CG2 3.31Å
329	L	96.1	Very high	96.1	Very high	5 Å²	5	41.2 Å²	41.2	3%	0.026	23%	0.23	C	C	.	.			trans	-62.8	-39.8	-167.5	-178.8	61.4	0	0	0	113.2	L307 I325 L326 S331 V349 L403	L307-L329 HydrophobicContact CD1-CD2 3.46Å; L307-L329 VanDerWaalsContact CD1-CD2 3.46Å; L307-L329 HydrophobicContact CG-CD2 4.46Å; I325-L329 PolarHBondContact O-N 2.99Å; I325-L329 VanDerWaalsContact O-N 3.1Å; L326-L329 WeakPolarHBondContact O-CB 3.29Å; L326-L329 PolarHBondContact O-N 3.11Å; L329-S331 PolarHBondContact O-N 3.32Å; L329-V349 HydrophobicContact CD1-CB 4.27Å; L329-V349 HydrophobicContact CD1-CG1 3.98Å; L329-L403 HydrophobicContact CD1-CB 4.48Å; L329-L403 HydrophobicContact CD1-CD1 3.91Å; L329-L403 HydrophobicContact CD1-CD2 4.49Å; L329-L403 HydrophobicContact CD2-CD1 4.41Å
330	G	95.8	Very high	96.1	Very high	45 Å²	45	42.1 Å²	42.1	46%	0.464	23%	0.234	S	C	.	.			trans	66	-110.8	-163.4	0	0	0	0	0	109.8	S328 R346	S328-G330 PolarHBondContact O-N 3.45Å; G330-R346 CarbonylContact C-O 3.46Å; G330-R346 VanDerWaalsContact CA-O 3.28Å; G330-R346 WeakPolarHBondContact CA-O 3.23Å
331	S	96.7	Very high	96.1	Very high	9 Å²	9	39.3 Å²	39.3	6%	0.063	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	161.5	169.6	84	0	0	0	0	114.6	L285 L329 D333 R345 R346	L285-S331 CarbonylContact O-C 3.6Å; L285-S331 WeakPolarHBondContact O-CA 3.37Å; L285-S331 WeakPolarHBondContact O-CB 3.26Å; L329-S331 PolarHBondContact O-N 3.32Å; S331-D333 PolarHBondContact OG-OD1 3.01Å; S331-R345 CarbonylContact O-C 3.59Å; S331-R345 WeakPolarHBondContact O-CA 3.46Å; S331-R346 PolarHBondContact N-O 2.86Å; S331-R346 PolarHBondContact O-N 3.26Å; S331-R346 WeakPolarHBondContact OG-CB 3.44Å
332	L	98.4	Very high	96.1	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	113.7	165.1	171.6	62.8	0	0	0	109.2	L285 V334 R345 A351 I367 F401 L403	L285-L332 HydrophobicContact CB-CB 4.25Å; L285-L332 HydrophobicContact CD1-CB 4.45Å; L285-L332 HydrophobicContact CD1-CD2 3.99Å; L285-L332 HydrophobicContact CD1-CG 4.33Å; L285-L332 PolarHBondContact N-O 3.43Å; L285-L332 PolarHBondContact O-N 2.98Å; L332-V334 HydrophobicContact CG-CG2 4.22Å; L332-R345 HydrophobicContact CD1-CB 4.37Å; L332-A351 HydrophobicContact CD1-CB 4.38Å; L332-A351 HydrophobicContact CD2-CB 4.18Å; L332-I367 HydrophobicContact CD1-CG1 4.41Å; L332-I367 HydrophobicContact CD1-CG2 3.95Å; L332-F401 HydrophobicContact CD2-CB 4.03Å; L332-F401 HydrophobicContact CD2-CD1 3.76Å; L332-F401 HydrophobicContact CD2-CE1 4.43Å; L332-F401 HydrophobicContact CD2-CG 3.96Å; L332-L403 HydrophobicContact CD2-CD2 3.77Å
333	D	98	Very high	96.1	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	130.7	177.8	-59	-1.7	0	0	0	108.3	L283 R284 L302 S331 Y342 G343 Q344 R346	L283-D333 WeakPolarHBondContact O-CA 3.26Å; R284-D333 VanDerWaalsContact CG-OD1 3.27Å; R284-D333 WeakPolarHBondContact CG-OD1 3.14Å; R284-D333 IonicContact CZ-OD1 3.63Å; R284-D333 IonicContact CZ-OD2 3.11Å; R284-D333 IonicContact NE-OD1 3.43Å; R284-D333 PolarHBondContact NE-OD1 3.41Å; R284-D333 IonicContact NE-OD2 2.91Å; R284-D333 IonicContact NH2-OD1 2.83Å; R284-D333 IonicContact NH2-OD2 3.62Å; R284-D333 PolarHBondContact NH2-OD2 3.04Å; L302-D333 HydrophobicContact CD1-CB 3.99Å; S331-D333 PolarHBondContact OG-OD1 3.01Å; D333-Y342 HydrophobicContact CB-CE2 4.48Å; D333-G343 CarbonylContact O-C 3.56Å; D333-G343 WeakPolarHBondContact O-CA 3.45Å; D333-Q344 PolarHBondContact N-O 2.91Å; D333-Q344 PolarHBondContact O-N 3.41Å; D333-R346 IonicContact OD2-CZ 3.69Å; D333-R346 IonicContact OD2-NE 3.53Å; D333-R346 PolarHBondContact OD2-NE 3.1Å; D333-R346 IonicContact OD2-NH2 2.8Å; D333-R346 PolarHBondContact OD2-NH2 3.05Å
334	V	98.3	Very high	96.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	120.6	172.4	-176.5	0	0	0	0	107.4	G282 L283 L332 I341 Y342 F401 V424	G282-V334 CarbonylContact C-O 3.6Å; G282-V334 WeakPolarHBondContact CA-O 3.43Å; L283-V334 HydrophobicContact CG-CB 4.45Å; L283-V334 PolarHBondContact N-O 3.41Å; L283-V334 PolarHBondContact O-N 2.99Å; L283-V334 VanDerWaalsContact O-O 3.11Å; L332-V334 HydrophobicContact CG-CG2 4.22Å; V334-I341 HydrophobicContact CG1-CG2 4.22Å; V334-Y342 WeakPolarHBondContact CA-O 3.21Å; V334-F401 HydrophobicContact CG1-CZ 4.17Å; V334-F401 HydrophobicContact CG2-CE1 4.07Å; V334-F401 HydrophobicContact CG2-CE2 4.04Å; V334-F401 HydrophobicContact CG2-CZ 3.65Å; V334-V424 HydrophobicContact CG1-CG1 4.09Å
335	G	95.9	Very high	96.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	-179.7	-175	0	0	0	0	0	113.7	A281 I341 Y342	A281-G335 VanDerWaalsContact O-CA 3.26Å; A281-G335 WeakPolarHBondContact O-CA 3.46Å; G335-I341 CarbonylContact O-C 3.51Å; G335-I341 VanDerWaalsContact O-CA 3.29Å; G335-I341 WeakPolarHBondContact O-CA 3.32Å; G335-Y342 VanDerWaalsContact C-CE1 3.4Å; G335-Y342 PolarHBondContact N-O 3.05Å; G335-Y342 WeakPolarHBondContact O-CD1 3.29Å; G335-Y342 PolarHBondContact O-N 2.86Å
336	M	93.8	Very high	95.9	Very high	20 Å²	20	35.8 Å²	35.8	10%	0.099	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	130.2	175.6	-167.9	66.9	71.9	0	0	109	F257 T259 A281 V340 I341 V378	F257-M336 HydrophobicContact CD1-CE 4.01Å; T259-M336 HydrophobicContact CG2-CE 3.74Å; A281-M336 PolarHBondContact O-N 3.2Å; A281-M336 VanDerWaalsContact O-N 3.09Å; M336-V340 VanDerWaalsContact SD-C 3.54Å; M336-I341 HydrophobicContact CE-CD1 4.24Å; M336-I341 HydrophobicContact CE-CG1 3.57Å; M336-I341 HydrophobicContact SD-CG1 3.94Å; M336-V378 HydrophobicContact CE-CG2 4.06Å; M336-V378 HydrophobicContact SD-CG2 4.16Å
337	S	91.5	Very high	95.6	Very high	66 Å²	66	36.2 Å²	36.2	46%	0.462	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	114.5	168.9	176.6	0	0	0	0	107.8	H339 V340	S337-H339 PolarHBondContact O-N 3.28Å; S337-V340 PolarHBondContact N-O 3.26Å; S337-V340 PolarHBondContact O-N 3.38Å
338	Q	87.3	Confident	95.4	Very high	156 Å²	156	37.4 Å²	37.4	73%	0.729	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.5	-108.1	-169.1	-58.2	176.3	-29.7	0	0	110
339	H	90.8	Very high	95.5	Very high	34 Å²	34	34.8 Å²	34.8	16%	0.157	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.1	25	-179.8	-44.4	-53.4	0	0	0	111.8	D255 S337 V378 Y460	D255-H339 PolarHBondContact O-CE1 3.03Å; S337-H339 PolarHBondContact O-N 3.28Å; H339-V378 HydrophobicContact CB-CB 4.23Å; H339-V378 HydrophobicContact CB-CG2 4.36Å; H339-V378 WeakPolarHBondContact O-CB 3.39Å; H339-V378 VanDerWaalsContact O-CG2 3.31Å; H339-V378 WeakPolarHBondContact O-CG2 3.26Å; H339-V378 PolarHBondContact O-N 2.72Å; H339-Y460 HydrophobicContact CB-CD1 4.32Å; H339-Y460 HydrophobicContact CB-CG 4.39Å; H339-Y460 WeakPolarHBondContact CB-OXT 2.87Å; H339-Y460 PolarHBondContact CD2-OXT 3.25Å; H339-Y460 AromaticContact CE1-CD1 3.65Å; H339-Y460 AromaticContact CG-CD1 3.59Å; H339-Y460 AromaticContact ND1-CD1 3.28Å; H339-Y460 VanDerWaalsContact ND1-CD1 3.28Å; H339-Y460 WeakPolarHBondContact ND1-CD1 3.38Å; H339-Y460 AromaticContact ND1-CE1 3.84Å
340	V	96.1	Very high	95.6	Very high	34 Å²	34	39 Å²	39	21%	0.206	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	125.2	-177.1	-173.9	0	0	0	0	110.2	M336 S337 P374 Q377	M336-V340 VanDerWaalsContact SD-C 3.54Å; S337-V340 PolarHBondContact N-O 3.26Å; S337-V340 PolarHBondContact O-N 3.38Å; V340-P374 HydrophobicContact CG1-CB 3.63Å; V340-Q377 HydrophobicContact CG1-CG 4.45Å; V340-Q377 HydrophobicContact CG2-CG 4.16Å
341	I	97.6	Very high	95.7	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	126	167.6	-59.2	172.8	0	0	0	107.8	V334 G335 M336 L375 Y376 M399 P426 M429	V334-I341 HydrophobicContact CG1-CG2 4.22Å; G335-I341 CarbonylContact O-C 3.51Å; G335-I341 VanDerWaalsContact O-CA 3.29Å; G335-I341 WeakPolarHBondContact O-CA 3.32Å; M336-I341 HydrophobicContact CE-CD1 4.24Å; M336-I341 HydrophobicContact CE-CG1 3.57Å; M336-I341 HydrophobicContact SD-CG1 3.94Å; I341-L375 HydrophobicContact CG2-CD1 4.45Å; I341-L375 WeakPolarHBondContact O-CA 3.46Å; I341-L375 WeakPolarHBondContact O-CB 3.29Å; I341-L375 PolarHBondContact O-N 2.88Å; I341-Y376 HydrophobicContact CD1-CD1 4.44Å; I341-Y376 PolarHBondContact N-O 2.88Å; I341-Y376 PolarHBondContact O-N 3.41Å; I341-M399 HydrophobicContact CD1-CE 3.87Å; I341-M399 HydrophobicContact CD1-SD 4.39Å; I341-M399 HydrophobicContact CG2-CE 4.02Å; I341-M399 HydrophobicContact CG2-SD 3.77Å; I341-P426 HydrophobicContact CD1-CB 4.31Å; I341-P426 HydrophobicContact CD1-CG 3.42Å; I341-P426 VanDerWaalsContact CD1-CG 3.42Å; I341-M429 HydrophobicContact CD1-CE 3.63Å; I341-M429 HydrophobicContact CD1-SD 3.84Å; I341-M429 HydrophobicContact CG1-CE 4.43Å
342	Y	97.9	Very high	95.8	Very high	41 Å²	41	37.2 Å²	37.2	16%	0.161	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	161.4	179	74	-91.7	0	0	0	112.1	D333 V334 G335 P372 E373	D333-Y342 HydrophobicContact CB-CE2 4.48Å; V334-Y342 WeakPolarHBondContact CA-O 3.21Å; G335-Y342 VanDerWaalsContact C-CE1 3.4Å; G335-Y342 PolarHBondContact N-O 3.05Å; G335-Y342 WeakPolarHBondContact O-CD1 3.29Å; G335-Y342 PolarHBondContact O-N 2.86Å; Y342-P372 HydrophobicContact CD2-CB 3.89Å; Y342-P372 HydrophobicContact CG-CB 4.34Å; Y342-E373 CarbonylContact C-O 3.59Å; Y342-E373 WeakPolarHBondContact CA-O 3.41Å; Y342-E373 WeakPolarHBondContact CB-O 3.45Å
343	G	98.1	Very high	95.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	141.8	171.8	0	0	0	0	0	111.6	D333 E373	D333-G343 CarbonylContact O-C 3.56Å; D333-G343 WeakPolarHBondContact O-CA 3.45Å; G343-E373 PolarHBondContact N-O 2.96Å; G343-E373 PolarHBondContact O-N 3.45Å
344	Q	98.1	Very high	95.8	Very high	11 Å²	11	37.3 Å²	37.3	5%	0.051	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	132.4	170.8	-170.3	177.7	5.6	0	0	110.9	D333 K369 L370	D333-Q344 PolarHBondContact N-O 2.91Å; D333-Q344 PolarHBondContact O-N 3.41Å; Q344-K369 PolarHBondContact NE2-O 2.93Å; Q344-L370 PolarHBondContact NE2-O 3.47Å
345	R	97.6	Very high	95.8	Very high	25 Å²	25	40.2 Å²	40.2	9%	0.094	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	139.8	171.3	68.4	-178.1	179.2	88.3	-5.5	111.5	S331 L332 G347 E366 I367 S368 K369	S331-R345 CarbonylContact O-C 3.59Å; S331-R345 WeakPolarHBondContact O-CA 3.46Å; L332-R345 HydrophobicContact CD1-CB 4.37Å; R345-G347 PolarHBondContact NH1-O 2.95Å; R345-E366 IonicContact CZ-OE1 3.59Å; R345-E366 IonicContact NE-OE1 3.59Å; R345-E366 IonicContact NH2-OE1 3.52Å; R345-E366 PolarHBondContact NH2-OE1 3.21Å; R345-I367 HydrophobicContact CB-CG2 4.25Å; R345-I367 WeakPolarHBondContact CD-O 3.32Å; R345-I367 HydrophobicContact CG-CG2 4.4Å; R345-I367 PolarHBondContact NE-O 3.48Å; R345-S368 PolarHBondContact N-O 3.08Å; R345-K369 HydrophobicContact CG-CB 4.14Å; R345-K369 WeakPolarHBondContact O-CA 3.47Å
346	R	94	Very high	95.7	Very high	124 Å²	124	42.3 Å²	42.3	47%	0.468	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	71.3	173.6	-52	179.3	-173.6	-86.2	-5.7	108.9	G330 S331 D333	G330-R346 CarbonylContact C-O 3.46Å; G330-R346 VanDerWaalsContact CA-O 3.28Å; G330-R346 WeakPolarHBondContact CA-O 3.23Å; S331-R346 PolarHBondContact N-O 2.86Å; S331-R346 PolarHBondContact O-N 3.26Å; S331-R346 WeakPolarHBondContact OG-CB 3.44Å; D333-R346 IonicContact OD2-CZ 3.69Å; D333-R346 IonicContact OD2-NE 3.53Å; D333-R346 PolarHBondContact OD2-NE 3.1Å; D333-R346 IonicContact OD2-NH2 2.8Å; D333-R346 PolarHBondContact OD2-NH2 3.05Å
347	G	92.7	Very high	95.7	Very high	12 Å²	12	43.8 Å²	43.8	12%	0.124	22%	0.217	C	C	.	.	S	Bend	trans	-177.1	177.8	-177.4	0	0	0	0	0	111.3	R345 K369	R345-G347 PolarHBondContact NH1-O 2.95Å; G347-K369 WeakPolarHBondContact O-CE 3.28Å
348	D	92.9	Very high	95.9	Very high	129 Å²	129	47.2 Å²	47.2	69%	0.69	22%	0.224	S	C	*	.	S	Bend	trans	-91.9	-21.8	179.1	-65.1	-32.4	0	0	0	112.5	K350 K369	D348-K350 PolarHBondContact O-N 3.1Å; D348-K369 IonicContact OD1-NZ 2.72Å; D348-K369 PolarHBondContact OD1-NZ 3.46Å
349	V	97.3	Very high	96.2	Very high	18 Å²	18	41.7 Å²	41.7	11%	0.109	20%	0.199	C	C	.	.	S	Bend	trans	-62.4	120.1	167.5	169.9	0	0	0	0	109.2	I325 S328 L329 L403	I325-V349 HydrophobicContact CG2-CG1 3.92Å; I325-V349 HydrophobicContact CG2-CG2 4.24Å; S328-V349 VanDerWaalsContact O-CG2 3.24Å; S328-V349 WeakPolarHBondContact O-CG2 3.31Å; L329-V349 HydrophobicContact CD1-CB 4.27Å; L329-V349 HydrophobicContact CD1-CG1 3.98Å; V349-L403 HydrophobicContact CG1-CB 4.4Å
350	K	98.2	Very high	96.3	Very high	93 Å²	93	43.7 Å²	43.7	40%	0.404	22%	0.217	S	C	.	.			trans	-69.9	139.2	171.2	-64.5	-173.6	167.2	-143	0	109.5	D348 Y352 E366 G404	D348-K350 PolarHBondContact O-N 3.1Å; K350-Y352 HydrophobicContact CB-CD2 4.45Å; K350-Y352 HydrophobicContact CB-CE2 3.7Å; K350-Y352 HydrophobicContact CD-CE2 4.4Å; K350-Y352 WeakPolarHBondContact CD-OH 3.48Å; K350-E366 WeakPolarHBondContact CD-OE2 3.41Å; K350-E366 IonicContact NZ-OE1 3.9Å; K350-E366 PolarHBondContact NZ-OE1 3.03Å; K350-E366 IonicContact NZ-OE2 2.94Å; K350-E366 PolarHBondContact NZ-OE2 3Å; K350-G404 PolarHBondContact O-N 2.88Å
351	A	98.4	Very high	96.2	Very high	2 Å²	2	44.7 Å²	44.7	2%	0.017	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	141.8	171.2	0	0	0	0	0	108.4	L332 E366 I367 C402 L403	L332-A351 HydrophobicContact CD1-CB 4.38Å; L332-A351 HydrophobicContact CD2-CB 4.18Å; A351-E366 CarbonylContact O-C 3.49Å; A351-E366 WeakPolarHBondContact O-CA 3.49Å; A351-I367 HydrophobicContact CB-CB 4.16Å; A351-I367 HydrophobicContact CB-CG1 4.07Å; A351-I367 PolarHBondContact O-N 2.78Å; A351-C402 WeakPolarHBondContact CA-O 3.35Å; A351-L403 HydrophobicContact CB-CD2 3.74Å
352	Y	98.7	Very high	96.1	Very high	14 Å²	14	49 Å²	49	6%	0.055	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	152.6	177.8	-66.2	-94.1	0	0	0	110.1	K350 P364 R365 E366 F401 C402 E405 K406 W407	K350-Y352 HydrophobicContact CB-CD2 4.45Å; K350-Y352 HydrophobicContact CB-CE2 3.7Å; K350-Y352 HydrophobicContact CD-CE2 4.4Å; K350-Y352 WeakPolarHBondContact CD-OH 3.48Å; Y352-P364 HydrophobicContact CD1-CB 3.67Å; Y352-P364 HydrophobicContact CE1-CB 3.77Å; Y352-R365 CarbonylContact C-O 3.59Å; Y352-R365 WeakPolarHBondContact CA-O 3.43Å; Y352-E366 HydrophobicContact CD1-CB 3.91Å; Y352-E366 HydrophobicContact CD1-CG 4.48Å; Y352-E366 HydrophobicContact CE1-CB 3.59Å; Y352-E366 HydrophobicContact CE1-CG 4.03Å; Y352-E366 PolarHBondContact OH-OE2 2.99Å; Y352-F401 CarbonylContact O-C 3.53Å; Y352-F401 VanDerWaalsContact O-CA 3.24Å; Y352-F401 WeakPolarHBondContact O-CA 3.47Å; Y352-C402 PolarHBondContact N-O 3.35Å; Y352-C402 PolarHBondContact O-N 3.05Å; Y352-E405 WeakPolarHBondContact CD2-O 3.36Å; Y352-K406 HydrophobicContact CE1-CG 4.07Å; Y352-K406 HydrophobicContact CE2-CB 4.48Å; Y352-K406 HydrophobicContact CE2-CG 4.05Å; Y352-W407 WeakPolarHBondContact CB-O 3.48Å
353	W	98.5	Very high	96	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	158.7	-173.8	78.2	-81.3	0	0	0	115.5	F355 R365 I367 E373 L375 M399 F400 F401	W353-F355 HydrophobicContact CH2-CE1 4.26Å; W353-F355 AromaticContact CH2-CE2 3.97Å; W353-F355 HydrophobicContact CH2-CE2 3.97Å; W353-F355 AromaticContact CH2-CZ 3.73Å; W353-F355 HydrophobicContact CH2-CZ 3.73Å; W353-F355 HydrophobicContact CZ3-CD1 4.08Å; W353-F355 HydrophobicContact CZ3-CD2 4.21Å; W353-F355 AromaticContact CZ3-CE1 3.73Å; W353-F355 HydrophobicContact CZ3-CE1 3.73Å; W353-F355 AromaticContact CZ3-CE2 3.88Å; W353-F355 HydrophobicContact CZ3-CE2 3.88Å; W353-F355 HydrophobicContact CZ3-CG 4.31Å; W353-F355 AromaticContact CZ3-CZ 3.62Å; W353-F355 HydrophobicContact CZ3-CZ 3.62Å; W353-R365 VanDerWaalsContact CH2-NH2 3.29Å; W353-R365 PolarHBondContact N-O 3.48Å; W353-I367 HydrophobicContact CB-CD1 4.14Å; W353-I367 HydrophobicContact CG-CD1 3.75Å; W353-I367 HydrophobicContact CG-CG1 4.48Å; W353-E373 PolarHBondContact NE1-OE1 3.23Å; W353-L375 HydrophobicContact CD2-CD2 3.98Å; W353-L375 HydrophobicContact CG-CD2 4.37Å; W353-L375 HydrophobicContact CH2-CB 3.75Å; W353-L375 HydrophobicContact CH2-CD2 4.23Å; W353-L375 VanDerWaalsContact CH2-O 3.23Å; W353-L375 WeakPolarHBondContact CH2-O 3.36Å; W353-L375 HydrophobicContact CZ2-CB 3.8Å; W353-L375 HydrophobicContact CZ2-CD2 3.44Å; W353-L375 VanDerWaalsContact CZ2-CD2 3.44Å; W353-L375 HydrophobicContact CZ2-CG 4.2Å; W353-L375 HydrophobicContact CZ3-CB 4.26Å; W353-M399 HydrophobicContact CZ3-CG 4.41Å; W353-F400 CarbonylContact C-O 3.59Å; W353-F400 WeakPolarHBondContact CA-O 3.35Å; W353-F401 HydrophobicContact CB-CD1 3.67Å; W353-F401 HydrophobicContact CB-CE1 3.85Å; W353-F401 HydrophobicContact CB-CG 4.36Å; W353-F401 HydrophobicContact CG-CE1 4.41Å
354	S	98.3	Very high	96	Very high	4 Å²	4	55.6 Å²	55.6	3%	0.028	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	163.1	169.6	176.4	0	0	0	0	110.5	S356 D359 F400	S354-S356 PolarHBondContact O-N 2.77Å; S354-S356 PolarHBondContact OG-N 3.33Å; S354-D359 WeakPolarHBondContact CB-OD2 3.49Å; S354-D359 VanDerWaalsContact OG-CB 3.28Å; S354-D359 WeakPolarHBondContact OG-CB 3.45Å; S354-D359 PolarHBondContact OG-OD2 3.02Å; S354-F400 PolarHBondContact N-O 3.45Å; S354-F400 PolarHBondContact O-N 3.03Å
355	F	97.6	Very high	96	Very high	62 Å²	62	59.9 Å²	59.9	27%	0.272	30%	0.299	S	S	.	.	S	Bend	trans	-72.9	-11.3	170.2	-67.7	-60.5	0	0	0	113.8	W353 Y376 A396 M399	W353-F355 HydrophobicContact CH2-CE1 4.26Å; W353-F355 AromaticContact CH2-CE2 3.97Å; W353-F355 HydrophobicContact CH2-CE2 3.97Å; W353-F355 AromaticContact CH2-CZ 3.73Å; W353-F355 HydrophobicContact CH2-CZ 3.73Å; W353-F355 HydrophobicContact CZ3-CD1 4.08Å; W353-F355 HydrophobicContact CZ3-CD2 4.21Å; W353-F355 AromaticContact CZ3-CE1 3.73Å; W353-F355 HydrophobicContact CZ3-CE1 3.73Å; W353-F355 AromaticContact CZ3-CE2 3.88Å; W353-F355 HydrophobicContact CZ3-CE2 3.88Å; W353-F355 HydrophobicContact CZ3-CG 4.31Å; W353-F355 AromaticContact CZ3-CZ 3.62Å; W353-F355 HydrophobicContact CZ3-CZ 3.62Å; F355-Y376 AromaticContact CE1-CD1 3.61Å; F355-Y376 HydrophobicContact CE1-CD1 3.61Å; F355-Y376 HydrophobicContact CE1-CD2 4.02Å; F355-Y376 HydrophobicContact CE1-CE1 4.08Å; F355-Y376 HydrophobicContact CE1-CE2 4.47Å; F355-Y376 AromaticContact CE1-CG 3.56Å; F355-Y376 HydrophobicContact CE1-CG 3.56Å; F355-Y376 HydrophobicContact CZ-CD1 4.16Å; F355-Y376 AromaticContact CZ-CD2 3.7Å; F355-Y376 HydrophobicContact CZ-CD2 3.7Å; F355-Y376 HydrophobicContact CZ-CE2 4.25Å; F355-Y376 AromaticContact CZ-CG 3.65Å; F355-Y376 HydrophobicContact CZ-CG 3.65Å; F355-A396 HydrophobicContact CB-CB 3.65Å; F355-A396 HydrophobicContact CD1-CB 3.82Å; F355-A396 HydrophobicContact CG-CB 3.89Å; F355-M399 HydrophobicContact CD1-CG 3.95Å; F355-M399 HydrophobicContact CE1-CG 3.95Å
356	S	95.2	Very high	96	Very high	43 Å²	43	61.9 Å²	61.9	30%	0.301	31%	0.309	S	S	.	.			trans	-137.5	135	-179	-177.4	0	0	0	0	112.2	S354 F358 D359 W407	S354-S356 PolarHBondContact O-N 2.77Å; S354-S356 PolarHBondContact OG-N 3.33Å; S356-F358 PolarHBondContact O-N 3.44Å; S356-F358 PolarHBondContact OG-N 3.34Å; S356-D359 WeakPolarHBondContact O-CB 3.14Å; S356-D359 PolarHBondContact O-N 3.31Å; S356-W407 PolarHBondContact O-NE1 3.49Å
357	K	94	Very high	96.2	Very high	52 Å²	52	56 Å²	56	23%	0.226	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-7.4	165.1	65.8	-174.2	173	-161.8	0	113.6	F400 W407 W415	K357-F400 HydrophobicContact CB-CD1 3.77Å; K357-F400 HydrophobicContact CB-CD2 4.26Å; K357-F400 HydrophobicContact CB-CE1 3.82Å; K357-F400 HydrophobicContact CB-CE2 4.31Å; K357-F400 HydrophobicContact CB-CG 3.99Å; K357-F400 HydrophobicContact CB-CZ 4.1Å; K357-F400 HydrophobicContact CD-CD1 4.49Å; K357-F400 HydrophobicContact CD-CE1 3.77Å; K357-F400 HydrophobicContact CD-CZ 3.95Å; K357-F400 HydrophobicContact CG-CE1 4.1Å; K357-F400 HydrophobicContact CG-CE2 4.45Å; K357-F400 HydrophobicContact CG-CZ 4.05Å; K357-F400 VanDerWaalsContact N-CD2 3.3Å; K357-W407 VanDerWaalsContact C-CZ2 3.48Å; K357-W407 VanDerWaalsContact O-CH2 3.26Å; K357-W407 WeakPolarHBondContact O-CH2 3.5Å; K357-W407 WeakPolarHBondContact O-CZ2 3.29Å; K357-W415 HydrophobicContact CB-CB 4.4Å; K357-W415 HydrophobicContact CB-CD2 4.17Å; K357-W415 HydrophobicContact CB-CG 3.97Å; K357-W415 HydrophobicContact CD-CD2 4.28Å; K357-W415 HydrophobicContact CD-CZ2 4.17Å; K357-W415 WeakPolarHBondContact O-CB 3.46Å; K357-W415 VanDerWaalsContact O-CD1 3.26Å
358	F	95	Very high	96.4	Very high	138 Å²	138	57.1 Å²	57.1	61%	0.605	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	14.3	175	-53	-66.7	0	0	0	112.7	S356 S360 W415	S356-F358 PolarHBondContact O-N 3.44Å; S356-F358 PolarHBondContact OG-N 3.34Å; F358-S360 PolarHBondContact O-N 3.29Å; F358-S360 VanDerWaalsContact O-N 3.13Å; F358-W415 AromaticContact CE1-NE1 3.83Å
359	D	93.4	Very high	96.6	Very high	39 Å²	39	55.3 Å²	55.3	21%	0.209	28%	0.279	C	S	.	.			trans	-60.8	116.4	178.5	-173.4	-22.7	0	0	0	110.9	S354 S356 S361 W407 P408	S354-D359 WeakPolarHBondContact CB-OD2 3.49Å; S354-D359 VanDerWaalsContact OG-CB 3.28Å; S354-D359 WeakPolarHBondContact OG-CB 3.45Å; S354-D359 PolarHBondContact OG-OD2 3.02Å; S356-D359 WeakPolarHBondContact O-CB 3.14Å; S356-D359 PolarHBondContact O-N 3.31Å; D359-S361 WeakPolarHBondContact OD1-CB 3.29Å; D359-S361 PolarHBondContact OD1-N 3.16Å; D359-S361 PolarHBondContact OD1-OG 3.44Å; D359-W407 HydrophobicContact CB-CZ2 4.41Å; D359-P408 HydrophobicContact CB-CB 4.35Å; D359-P408 HydrophobicContact CB-CG 3.69Å; D359-P408 WeakPolarHBondContact OD1-CG 3.34Å; D359-P408 WeakPolarHBondContact OD2-CG 3.37Å
360	S	91.9	Very high	96.4	Very high	76 Å²	76	61.3 Å²	61.3	53%	0.531	31%	0.309	S	S	.	.			trans	-109.2	19.9	-179.4	69.1	0	0	0	0	112.6	F358 M362	F358-S360 PolarHBondContact O-N 3.29Å; F358-S360 VanDerWaalsContact O-N 3.13Å; S360-M362 PolarHBondContact O-N 3.14Å
361	S	94.4	Very high	96.1	Very high	56 Å²	56	62.1 Å²	62.1	39%	0.392	32%	0.318	S	S	.	.			trans	-64.9	-21.2	177.8	61.9	0	0	0	0	112.7	D359 Q363 P408	D359-S361 WeakPolarHBondContact OD1-CB 3.29Å; D359-S361 PolarHBondContact OD1-N 3.16Å; D359-S361 PolarHBondContact OD1-OG 3.44Å; S361-Q363 PolarHBondContact O-N 3.5Å; S361-Q363 VanDerWaalsContact O-N 3.16Å; S361-Q363 PolarHBondContact OG-N 3.12Å; S361-P408 WeakPolarHBondContact OG-CG 3.41Å
362	M	95	Very high	96	Very high	90 Å²	90	65.6 Å²	65.6	44%	0.443	34%	0.34	S	S	.	.			trans	58.7	19.5	-175.4	-54.9	170.4	-71.5	0	0	113.1	S360 P364 N412	S360-M362 PolarHBondContact O-N 3.14Å; M362-P364 WeakPolarHBondContact O-CD 3.31Å; M362-N412 HydrophobicContact CG-CB 4.05Å; M362-N412 HydrophobicContact SD-CB 4.1Å
363	Q	96.9	Very high	95.9	Very high	136 Å²	136	66.7 Å²	66.7	64%	0.636	35%	0.346	S	S	*	.			trans	-111.7	95.5	-179.9	-67.5	-59.4	-25.4	0	0	110	S361 R365 P408	S361-Q363 PolarHBondContact O-N 3.5Å; S361-Q363 VanDerWaalsContact O-N 3.16Å; S361-Q363 PolarHBondContact OG-N 3.12Å; Q363-R365 PolarHBondContact O-N 3.26Å; Q363-P408 WeakPolarHBondContact O-CD 3.48Å
364	P	97.7	Very high	95.8	Very high	44 Å²	44	71.3 Å²	71.3	29%	0.286	38%	0.376	S	S	.	.			trans	-62.2	134.8	-178.1	-19.5	29.7	0	0	0	112.3	Y352 M362 K406 W407 P408 P410	Y352-P364 HydrophobicContact CD1-CB 3.67Å; Y352-P364 HydrophobicContact CE1-CB 3.77Å; M362-P364 WeakPolarHBondContact O-CD 3.31Å; P364-K406 HydrophobicContact CB-CB 4.13Å; P364-K406 HydrophobicContact CB-CG 4.38Å; P364-K406 HydrophobicContact CG-CB 4.02Å; P364-K406 HydrophobicContact CG-CD 4.12Å; P364-K406 HydrophobicContact CG-CG 4.31Å; P364-W407 VanDerWaalsContact CA-O 3.28Å; P364-W407 WeakPolarHBondContact CA-O 3.27Å; P364-P408 WeakPolarHBondContact CG-O 3.4Å; P364-P410 HydrophobicContact CG-CG 3.69Å
365	R	97.7	Very high	95.8	Very high	101 Å²	101	71.7 Å²	71.7	38%	0.381	38%	0.378	S	S	.	.			trans	-113.1	98.4	177.1	-58.2	175.8	67.8	-167.5	1.9	109.2	Y352 W353 Q363 W407	Y352-R365 CarbonylContact C-O 3.59Å; Y352-R365 WeakPolarHBondContact CA-O 3.43Å; W353-R365 VanDerWaalsContact CH2-NH2 3.29Å; W353-R365 PolarHBondContact N-O 3.48Å; Q363-R365 PolarHBondContact O-N 3.26Å; R365-W407 PolarHBondContact N-O 2.77Å; R365-W407 VanDerWaalsContact N-O 3.16Å
366	E	98.1	Very high	95.8	Very high	67 Å²	67	69.9 Å²	69.9	31%	0.313	37%	0.369	S	S	.	.	B	Isolated β-bridge	trans	-78.5	134.8	-177.8	-169.8	174.7	149.7	0	0	110.8	R345 K350 A351 Y352	R345-E366 IonicContact CZ-OE1 3.59Å; R345-E366 IonicContact NE-OE1 3.59Å; R345-E366 IonicContact NH2-OE1 3.52Å; R345-E366 PolarHBondContact NH2-OE1 3.21Å; K350-E366 WeakPolarHBondContact CD-OE2 3.41Å; K350-E366 IonicContact NZ-OE1 3.9Å; K350-E366 PolarHBondContact NZ-OE1 3.03Å; K350-E366 IonicContact NZ-OE2 2.94Å; K350-E366 PolarHBondContact NZ-OE2 3Å; A351-E366 CarbonylContact O-C 3.49Å; A351-E366 WeakPolarHBondContact O-CA 3.49Å; Y352-E366 HydrophobicContact CD1-CB 3.91Å; Y352-E366 HydrophobicContact CD1-CG 4.48Å; Y352-E366 HydrophobicContact CE1-CB 3.59Å; Y352-E366 HydrophobicContact CE1-CG 4.03Å; Y352-E366 PolarHBondContact OH-OE2 2.99Å
367	I	98.4	Very high	95.8	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-72.6	129.5	171.4	-61	-71	0	0	0	110	L332 R345 A351 W353 E373 L375 F401	L332-I367 HydrophobicContact CD1-CG1 4.41Å; L332-I367 HydrophobicContact CD1-CG2 3.95Å; R345-I367 HydrophobicContact CB-CG2 4.25Å; R345-I367 WeakPolarHBondContact CD-O 3.32Å; R345-I367 HydrophobicContact CG-CG2 4.4Å; R345-I367 PolarHBondContact NE-O 3.48Å; A351-I367 HydrophobicContact CB-CB 4.16Å; A351-I367 HydrophobicContact CB-CG1 4.07Å; A351-I367 PolarHBondContact O-N 2.78Å; W353-I367 HydrophobicContact CB-CD1 4.14Å; W353-I367 HydrophobicContact CG-CD1 3.75Å; W353-I367 HydrophobicContact CG-CG1 4.48Å; I367-E373 WeakPolarHBondContact CA-OE2 3.38Å; I367-L375 HydrophobicContact CD1-CD1 4.49Å; I367-L375 HydrophobicContact CD1-CD2 3.69Å; I367-F401 HydrophobicContact CD1-CD1 4.23Å; I367-F401 HydrophobicContact CD1-CE1 3.83Å; I367-F401 HydrophobicContact CG1-CD1 4.26Å; I367-F401 HydrophobicContact CG1-CE1 4.34Å
368	S	97.3	Very high	95.9	Very high	35 Å²	35	68.4 Å²	68.4	25%	0.245	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-57.4	135.5	175.9	168.4	0	0	0	0	113.2	R345 L370 N371 E373	R345-S368 PolarHBondContact N-O 3.08Å; S368-L370 PolarHBondContact OG-N 3.33Å; S368-N371 VanDerWaalsContact CB-O 3.24Å; S368-N371 WeakPolarHBondContact CB-O 3.37Å; S368-N371 PolarHBondContact OG-N 3.25Å; S368-N371 PolarHBondContact OG-O 3.07Å; S368-E373 PolarHBondContact N-OE2 3.37Å
369	K	96.6	Very high	95.9	Very high	92 Å²	92	65.7 Å²	65.7	40%	0.4	35%	0.346	S	S	.	.	S	Bend	trans	-83.5	-34.3	169.6	-168.7	177.8	-177.8	173.2	0	112.1	Q344 R345 G347 D348	Q344-K369 PolarHBondContact NE2-O 2.93Å; R345-K369 HydrophobicContact CG-CB 4.14Å; R345-K369 WeakPolarHBondContact O-CA 3.47Å; G347-K369 WeakPolarHBondContact O-CE 3.28Å; D348-K369 IonicContact OD1-NZ 2.72Å; D348-K369 PolarHBondContact OD1-NZ 3.46Å
370	L	92.4	Very high	96	Very high	143 Å²	143	67.4 Å²	67.4	75%	0.749	36%	0.355	S	S	*	.	S	Bend	trans	-81.2	-53.3	-164.6	-62.8	174.9	0	0	0	111.7	Q344 S368	Q344-L370 PolarHBondContact NE2-O 3.47Å; S368-L370 PolarHBondContact OG-N 3.33Å
371	N	93	Very high	96.2	Very high	111 Å²	111	63.8 Å²	63.8	59%	0.594	33%	0.33	S	S	*	.	S	Bend	trans	-129.1	152	-176.1	-58.9	-53.3	0	0	0	110.4	S368 E373	S368-N371 VanDerWaalsContact CB-O 3.24Å; S368-N371 WeakPolarHBondContact CB-O 3.37Å; S368-N371 PolarHBondContact OG-N 3.25Å; S368-N371 PolarHBondContact OG-O 3.07Å; N371-E373 PolarHBondContact O-N 3.29Å
372	P	95.7	Very high	96.2	Very high	74 Å²	74	61.1 Å²	61.1	48%	0.481	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-51.8	125.3	165.8	-23.4	32.9	0	0	0	111.1	Y342	Y342-P372 HydrophobicContact CD2-CB 3.89Å; Y342-P372 HydrophobicContact CG-CB 4.34Å
373	E	95.9	Very high	96.2	Very high	38 Å²	38	62.9 Å²	62.9	18%	0.178	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	136	174.6	90	-176.7	-146.8	0	0	110.2	Y342 G343 W353 I367 S368 N371 L375	Y342-E373 CarbonylContact C-O 3.59Å; Y342-E373 WeakPolarHBondContact CA-O 3.41Å; Y342-E373 WeakPolarHBondContact CB-O 3.45Å; G343-E373 PolarHBondContact N-O 2.96Å; G343-E373 PolarHBondContact O-N 3.45Å; W353-E373 PolarHBondContact NE1-OE1 3.23Å; I367-E373 WeakPolarHBondContact CA-OE2 3.38Å; S368-E373 PolarHBondContact N-OE2 3.37Å; N371-E373 PolarHBondContact O-N 3.29Å; E373-L375 HydrophobicContact CG-CD2 3.4Å; E373-L375 VanDerWaalsContact CG-CD2 3.4Å; E373-L375 HydrophobicContact CG-CG 4.34Å; E373-L375 PolarHBondContact O-N 3.41Å; E373-L375 WeakPolarHBondContact OE1-CD2 3.16Å
374	P	97.5	Very high	96.1	Very high	96 Å²	96	57 Å²	57	62%	0.623	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	122.2	171.6	29.9	-33.5	0	0	0	109.7	V340	V340-P374 HydrophobicContact CG1-CB 3.63Å
375	L	97.7	Very high	95.8	Very high	13 Å²	13	55 Å²	55	7%	0.068	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-49.6	179.4	-53.7	179.2	0	0	0	111	I341 W353 I367 E373 M399 F401	I341-L375 HydrophobicContact CG2-CD1 4.45Å; I341-L375 WeakPolarHBondContact O-CA 3.46Å; I341-L375 WeakPolarHBondContact O-CB 3.29Å; I341-L375 PolarHBondContact O-N 2.88Å; W353-L375 HydrophobicContact CD2-CD2 3.98Å; W353-L375 HydrophobicContact CG-CD2 4.37Å; W353-L375 HydrophobicContact CH2-CB 3.75Å; W353-L375 HydrophobicContact CH2-CD2 4.23Å; W353-L375 VanDerWaalsContact CH2-O 3.23Å; W353-L375 WeakPolarHBondContact CH2-O 3.36Å; W353-L375 HydrophobicContact CZ2-CB 3.8Å; W353-L375 HydrophobicContact CZ2-CD2 3.44Å; W353-L375 VanDerWaalsContact CZ2-CD2 3.44Å; W353-L375 HydrophobicContact CZ2-CG 4.2Å; W353-L375 HydrophobicContact CZ3-CB 4.26Å; I367-L375 HydrophobicContact CD1-CD1 4.49Å; I367-L375 HydrophobicContact CD1-CD2 3.69Å; E373-L375 HydrophobicContact CG-CD2 3.4Å; E373-L375 VanDerWaalsContact CG-CD2 3.4Å; E373-L375 HydrophobicContact CG-CG 4.34Å; E373-L375 PolarHBondContact O-N 3.41Å; E373-L375 WeakPolarHBondContact OE1-CD2 3.16Å; L375-M399 HydrophobicContact CD1-SD 4.39Å; L375-F401 HydrophobicContact CD1-CE1 4Å; L375-F401 HydrophobicContact CD1-CZ 3.83Å
376	Y	97.5	Very high	95.4	Very high	24 Å²	24	51.5 Å²	51.5	9%	0.094	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	126.6	-172.3	-163.5	-160.6	0	0	0	112	I341 F355 D380 F381 A396 M429	I341-Y376 HydrophobicContact CD1-CD1 4.44Å; I341-Y376 PolarHBondContact N-O 2.88Å; I341-Y376 PolarHBondContact O-N 3.41Å; F355-Y376 AromaticContact CE1-CD1 3.61Å; F355-Y376 HydrophobicContact CE1-CD1 3.61Å; F355-Y376 HydrophobicContact CE1-CD2 4.02Å; F355-Y376 HydrophobicContact CE1-CE1 4.08Å; F355-Y376 HydrophobicContact CE1-CE2 4.47Å; F355-Y376 AromaticContact CE1-CG 3.56Å; F355-Y376 HydrophobicContact CE1-CG 3.56Å; F355-Y376 HydrophobicContact CZ-CD1 4.16Å; F355-Y376 AromaticContact CZ-CD2 3.7Å; F355-Y376 HydrophobicContact CZ-CD2 3.7Å; F355-Y376 HydrophobicContact CZ-CE2 4.25Å; F355-Y376 AromaticContact CZ-CG 3.65Å; F355-Y376 HydrophobicContact CZ-CG 3.65Å; Y376-D380 HydrophobicContact CD2-CB 4.45Å; Y376-D380 HydrophobicContact CE2-CB 4.04Å; Y376-F381 HydrophobicContact CE1-CB 3.99Å; Y376-F381 HydrophobicContact CE1-CD2 4.14Å; Y376-F381 HydrophobicContact CE1-CG 4.47Å; Y376-F381 HydrophobicContact CE2-CB 4.29Å; Y376-F381 WeakPolarHBondContact OH-CA 3.5Å; Y376-F381 WeakPolarHBondContact OH-CB 3.04Å; Y376-A396 VanDerWaalsContact CE1-O 3.29Å; Y376-A396 WeakPolarHBondContact CE1-O 3.45Å; Y376-A396 PolarHBondContact OH-O 3.25Å; Y376-M429 HydrophobicContact CD1-CE 4.3Å; Y376-M429 HydrophobicContact CD1-SD 4.09Å; Y376-M429 HydrophobicContact CE1-CE 4.49Å; Y376-M429 HydrophobicContact CE1-SD 4.04Å
377	Q	96.4	Very high	95	Very high	64 Å²	64	50.5 Å²	50.5	30%	0.299	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	136.7	177.4	-53.8	177.4	97.1	0	0	109.8	V340 K379 D380 F381	V340-Q377 HydrophobicContact CG1-CG 4.45Å; V340-Q377 HydrophobicContact CG2-CG 4.16Å; Q377-K379 HydrophobicContact CB-CG 3.98Å; Q377-K379 PolarHBondContact O-N 3.15Å; Q377-D380 HydrophobicContact CB-CB 4.35Å; Q377-D380 WeakPolarHBondContact CB-OD2 3.25Å; Q377-D380 PolarHBondContact NE2-OD2 2.99Å; Q377-D380 WeakPolarHBondContact O-CB 3.24Å; Q377-D380 PolarHBondContact O-N 2.93Å; Q377-F381 PolarHBondContact O-N 2.89Å
378	V	95.3	Very high	94.6	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-57.9	-41.1	176	174.2	0	0	0	0	110.2	F257 M336 H339 D380 F381 I382 M429 Y460	F257-V378 HydrophobicContact CB-CG1 4.34Å; F257-V378 HydrophobicContact CB-CG2 4.31Å; F257-V378 HydrophobicContact CD1-CG1 4.35Å; F257-V378 HydrophobicContact CD1-CG2 3.88Å; F257-V378 HydrophobicContact CD2-CG1 3.75Å; F257-V378 HydrophobicContact CE1-CG2 4.38Å; F257-V378 HydrophobicContact CE2-CG1 4.09Å; F257-V378 HydrophobicContact CG-CG1 3.88Å; F257-V378 HydrophobicContact CG-CG2 4.04Å; M336-V378 HydrophobicContact CE-CG2 4.06Å; M336-V378 HydrophobicContact SD-CG2 4.16Å; H339-V378 HydrophobicContact CB-CB 4.23Å; H339-V378 HydrophobicContact CB-CG2 4.36Å; H339-V378 WeakPolarHBondContact O-CB 3.39Å; H339-V378 VanDerWaalsContact O-CG2 3.31Å; H339-V378 WeakPolarHBondContact O-CG2 3.26Å; H339-V378 PolarHBondContact O-N 2.72Å; V378-D380 VanDerWaalsContact C-N 3.27Å; V378-D380 PolarHBondContact O-N 3.18Å; V378-F381 WeakPolarHBondContact O-CA 3.38Å; V378-F381 VanDerWaalsContact O-CB 3.32Å; V378-F381 WeakPolarHBondContact O-CB 3.49Å; V378-F381 PolarHBondContact O-N 3.06Å; V378-I382 HydrophobicContact CG1-CG1 4.15Å; V378-I382 WeakPolarHBondContact O-CG1 3.41Å; V378-I382 PolarHBondContact O-N 2.91Å; V378-M429 HydrophobicContact CB-CE 4.48Å; V378-M429 HydrophobicContact CG2-CE 3.85Å; V378-Y460 HydrophobicContact CG1-CD2 3.6Å; V378-Y460 HydrophobicContact CG1-CE2 4Å; V378-Y460 HydrophobicContact CG1-CG 4.14Å
379	K	94.6	Very high	93.9	Very high	81 Å²	81	52.3 Å²	52.3	35%	0.352	27%	0.265	S	S	.	.	H	α-helix	trans	-58.1	-35.6	175.8	76.9	-171.4	-179	-158.7	0	113.9	Q377 F381 I382 R383	Q377-K379 HydrophobicContact CB-CG 3.98Å; Q377-K379 PolarHBondContact O-N 3.15Å; K379-F381 VanDerWaalsContact C-N 3.33Å; K379-I382 PolarHBondContact O-N 3.42Å; K379-R383 VanDerWaalsContact O-CB 3.28Å; K379-R383 WeakPolarHBondContact O-CB 3.39Å; K379-R383 PolarHBondContact O-N 3.15Å
380	D	96.6	Very high	93.4	Very high	75 Å²	75	53.5 Å²	53.5	40%	0.401	28%	0.276	S	S	.	.	H	α-helix	trans	-71.7	-34.7	178.5	-62.5	-23	0	0	0	110.2	Y376 Q377 V378 G384	Y376-D380 HydrophobicContact CD2-CB 4.45Å; Y376-D380 HydrophobicContact CE2-CB 4.04Å; Q377-D380 HydrophobicContact CB-CB 4.35Å; Q377-D380 WeakPolarHBondContact CB-OD2 3.25Å; Q377-D380 PolarHBondContact NE2-OD2 2.99Å; Q377-D380 WeakPolarHBondContact O-CB 3.24Å; Q377-D380 PolarHBondContact O-N 2.93Å; V378-D380 VanDerWaalsContact C-N 3.27Å; V378-D380 PolarHBondContact O-N 3.18Å; D380-G384 PolarHBondContact O-N 3.28Å
381	F	96.6	Very high	93	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-65	-49.2	171.4	173.7	-98.9	0	0	0	111.9	Y376 Q377 V378 K379 R383 G384 L385 P395 A396 M429 L432 K433	Y376-F381 HydrophobicContact CE1-CB 3.99Å; Y376-F381 HydrophobicContact CE1-CD2 4.14Å; Y376-F381 HydrophobicContact CE1-CG 4.47Å; Y376-F381 HydrophobicContact CE2-CB 4.29Å; Y376-F381 WeakPolarHBondContact OH-CA 3.5Å; Y376-F381 WeakPolarHBondContact OH-CB 3.04Å; Q377-F381 PolarHBondContact O-N 2.89Å; V378-F381 WeakPolarHBondContact O-CA 3.38Å; V378-F381 VanDerWaalsContact O-CB 3.32Å; V378-F381 WeakPolarHBondContact O-CB 3.49Å; V378-F381 PolarHBondContact O-N 3.06Å; K379-F381 VanDerWaalsContact C-N 3.33Å; F381-R383 PolarHBondContact O-N 3.45Å; F381-G384 CarbonylContact O-C 3.59Å; F381-G384 WeakPolarHBondContact O-CA 3.26Å; F381-G384 PolarHBondContact O-N 2.88Å; F381-G384 VanDerWaalsContact O-N 3.08Å; F381-L385 HydrophobicContact CD1-CD1 4.23Å; F381-L385 HydrophobicContact CE1-CD1 3.49Å; F381-L385 VanDerWaalsContact CE1-CD1 3.49Å; F381-L385 HydrophobicContact CE1-CG 4.05Å; F381-L385 HydrophobicContact CE2-CG 4.48Å; F381-L385 HydrophobicContact CZ-CD1 3.74Å; F381-L385 HydrophobicContact CZ-CD2 4.08Å; F381-L385 HydrophobicContact CZ-CG 3.96Å; F381-L385 PolarHBondContact O-N 2.88Å; F381-P395 HydrophobicContact CD2-CB 3.82Å; F381-P395 HydrophobicContact CD2-CG 3.87Å; F381-P395 HydrophobicContact CE2-CB 4.1Å; F381-P395 HydrophobicContact CE2-CG 3.73Å; F381-P395 HydrophobicContact CZ-CG 4.49Å; F381-A396 WeakPolarHBondContact CD2-O 3.4Å; F381-M429 HydrophobicContact CB-CE 4.11Å; F381-M429 HydrophobicContact CB-SD 4.47Å; F381-M429 HydrophobicContact CD1-CB 4.4Å; F381-M429 HydrophobicContact CD1-CG 3.9Å; F381-M429 HydrophobicContact CD2-CB 4.26Å; F381-M429 HydrophobicContact CD2-CG 4.23Å; F381-M429 HydrophobicContact CD2-SD 4.25Å; F381-M429 HydrophobicContact CE1-CB 4Å; F381-M429 HydrophobicContact CE1-CG 3.94Å; F381-M429 HydrophobicContact CE2-CB 3.86Å; F381-M429 HydrophobicContact CE2-CG 4.28Å; F381-M429 HydrophobicContact CG-CE 4.27Å; F381-M429 HydrophobicContact CG-CG 4.07Å; F381-M429 HydrophobicContact CG-SD 4.16Å; F381-M429 HydrophobicContact CZ-CB 3.74Å; F381-M429 HydrophobicContact CZ-CG 4.16Å; F381-M429 WeakPolarHBondContact CZ-O 3.47Å; F381-L432 HydrophobicContact CE1-CB 4.04Å; F381-L432 HydrophobicContact CE1-CD1 3.95Å; F381-L432 HydrophobicContact CZ-CB 4.17Å; F381-K433 HydrophobicContact CZ-CB 4.4Å
382	I	94.3	Very high	92.8	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.1	-45.3	177.8	-61	-53.7	0	0	0	110.8	V378 K379 G384 L385 M386 L432 L453 M456 M457	V378-I382 HydrophobicContact CG1-CG1 4.15Å; V378-I382 WeakPolarHBondContact O-CG1 3.41Å; V378-I382 PolarHBondContact O-N 2.91Å; K379-I382 PolarHBondContact O-N 3.42Å; I382-G384 VanDerWaalsContact C-N 3.26Å; I382-G384 PolarHBondContact O-N 3.28Å; I382-L385 HydrophobicContact CD1-CD1 4.35Å; I382-L385 WeakPolarHBondContact O-CB 3.4Å; I382-L385 PolarHBondContact O-N 2.85Å; I382-M386 WeakPolarHBondContact O-CG 2.98Å; I382-M386 PolarHBondContact O-N 2.86Å; I382-L432 HydrophobicContact CD1-CD1 4.29Å; I382-L453 HydrophobicContact CG2-CB 4.33Å; I382-L453 HydrophobicContact CG2-CD2 4.34Å; I382-M456 HydrophobicContact CD1-CE 3.75Å; I382-M456 HydrophobicContact CD1-SD 4.04Å; I382-M456 HydrophobicContact CG1-CB 4.43Å; I382-M456 HydrophobicContact CG2-CB 4.29Å; I382-M456 HydrophobicContact CG2-CE 4.45Å; I382-M457 HydrophobicContact CB-CG 4.31Å; I382-M457 HydrophobicContact CG2-CG 3.66Å
383	R	94.6	Very high	92.6	Very high	126 Å²	126	55.2 Å²	55.2	48%	0.475	29%	0.286	S	S	.	.	H	α-helix	trans	-57.1	-42.2	172.8	-179.3	60.5	62.4	159.1	6.5	111.6	K379 F381 L385 M386 D387 M457	K379-R383 VanDerWaalsContact O-CB 3.28Å; K379-R383 WeakPolarHBondContact O-CB 3.39Å; K379-R383 PolarHBondContact O-N 3.15Å; F381-R383 PolarHBondContact O-N 3.45Å; R383-L385 VanDerWaalsContact C-N 3.31Å; R383-L385 PolarHBondContact O-N 2.95Å; R383-M386 WeakPolarHBondContact O-CB 3.32Å; R383-M386 PolarHBondContact O-N 3.17Å; R383-D387 WeakPolarHBondContact O-CB 3.45Å; R383-D387 PolarHBondContact O-N 2.77Å; R383-M457 HydrophobicContact CB-SD 4.4Å; R383-M457 PolarHBondContact NE-SD 3.2Å; R383-M457 PolarHBondContact NH2-SD 3.33Å
384	G	94.1	Very high	92.3	Very high	14 Å²	14	55.1 Å²	55.1	14%	0.144	29%	0.289	C	S	.	.	H	α-helix	trans	-61	-36.8	175.1	0	0	0	0	0	113.2	D380 F381 I382 D387 F388 P395	D380-G384 PolarHBondContact O-N 3.28Å; F381-G384 CarbonylContact O-C 3.59Å; F381-G384 WeakPolarHBondContact O-CA 3.26Å; F381-G384 PolarHBondContact O-N 2.88Å; F381-G384 VanDerWaalsContact O-N 3.08Å; I382-G384 VanDerWaalsContact C-N 3.26Å; I382-G384 PolarHBondContact O-N 3.28Å; G384-D387 PolarHBondContact O-N 2.89Å; G384-F388 WeakPolarHBondContact O-CB 3.4Å; G384-F388 PolarHBondContact O-N 3.35Å; G384-P395 WeakPolarHBondContact O-CD 3.45Å
385	L	91.7	Very high	92.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-66.5	-43	173.7	-70	177.1	0	0	0	111.7	F381 I382 R383 D387 F388 F389 P395 L432 A436	F381-L385 HydrophobicContact CD1-CD1 4.23Å; F381-L385 HydrophobicContact CE1-CD1 3.49Å; F381-L385 VanDerWaalsContact CE1-CD1 3.49Å; F381-L385 HydrophobicContact CE1-CG 4.05Å; F381-L385 HydrophobicContact CE2-CG 4.48Å; F381-L385 HydrophobicContact CZ-CD1 3.74Å; F381-L385 HydrophobicContact CZ-CD2 4.08Å; F381-L385 HydrophobicContact CZ-CG 3.96Å; F381-L385 PolarHBondContact O-N 2.88Å; I382-L385 HydrophobicContact CD1-CD1 4.35Å; I382-L385 WeakPolarHBondContact O-CB 3.4Å; I382-L385 PolarHBondContact O-N 2.85Å; R383-L385 VanDerWaalsContact C-N 3.31Å; R383-L385 PolarHBondContact O-N 2.95Å; L385-D387 VanDerWaalsContact C-N 3.31Å; L385-D387 PolarHBondContact O-N 3.2Å; L385-F388 WeakPolarHBondContact O-CB 3.25Å; L385-F388 PolarHBondContact O-N 2.88Å; L385-F389 WeakPolarHBondContact O-CD2 3.37Å; L385-F389 WeakPolarHBondContact O-CG 3.49Å; L385-F389 PolarHBondContact O-N 3.27Å; L385-P395 HydrophobicContact CD2-CG 3.68Å; L385-P395 HydrophobicContact CG-CG 3.91Å; L385-L432 HydrophobicContact CD1-CB 3.88Å; L385-A436 HydrophobicContact CD2-CB 4.01Å
386	M	89.2	Confident	92.2	Very high	28 Å²	28	51.8 Å²	51.8	14%	0.138	27%	0.271	C	S	.	.	H	α-helix	trans	-60.4	-43.9	174.1	-61.1	172.5	76.7	0	0	111.2	I382 R383 F388 F389 D390 L453 E454 M457	I382-M386 WeakPolarHBondContact O-CG 2.98Å; I382-M386 PolarHBondContact O-N 2.86Å; R383-M386 WeakPolarHBondContact O-CB 3.32Å; R383-M386 PolarHBondContact O-N 3.17Å; M386-F388 VanDerWaalsContact C-N 3.33Å; M386-F388 PolarHBondContact O-N 3.26Å; M386-F389 CarbonylContact O-C 3.55Å; M386-F389 WeakPolarHBondContact O-CA 3.27Å; M386-F389 WeakPolarHBondContact O-CB 3.17Å; M386-F389 PolarHBondContact O-N 3.49Å; M386-F389 VanDerWaalsContact O-N 3.15Å; M386-D390 PolarHBondContact O-N 3.04Å; M386-L453 HydrophobicContact CG-CB 4Å; M386-L453 HydrophobicContact CG-CD1 3.89Å; M386-L453 HydrophobicContact SD-CB 4.32Å; M386-E454 HydrophobicContact CE-CG 3.71Å; M386-M457 HydrophobicContact CE-CE 3.99Å; M386-M457 HydrophobicContact SD-CE 3.69Å; M386-M457 HydrophobicContact SD-CG 4.11Å; M386-M457 HydrophobicContact SD-SD 3.5Å
387	D	90.1	Very high	92.1	Very high	47 Å²	47	51.1 Å²	51.1	25%	0.251	27%	0.27	S	S	.	.	H	α-helix	trans	-62	-39.5	175.9	-94.6	4.1	0	0	0	112.5	R383 G384 L385 F389 D390 G391 K392	R383-D387 WeakPolarHBondContact O-CB 3.45Å; R383-D387 PolarHBondContact O-N 2.77Å; G384-D387 PolarHBondContact O-N 2.89Å; L385-D387 VanDerWaalsContact C-N 3.31Å; L385-D387 PolarHBondContact O-N 3.2Å; D387-F389 VanDerWaalsContact C-N 3.3Å; D387-D390 CarbonylContact O-C 3.57Å; D387-D390 WeakPolarHBondContact O-CA 3.48Å; D387-D390 PolarHBondContact O-N 2.98Å; D387-G391 PolarHBondContact O-N 3.25Å; D387-K392 HydrophobicContact CB-CB 4.33Å; D387-K392 HydrophobicContact CB-CD 3.67Å; D387-K392 VanDerWaalsContact O-CB 3.22Å; D387-K392 WeakPolarHBondContact O-CB 3.4Å; D387-K392 WeakPolarHBondContact O-CG 3.37Å; D387-K392 PolarHBondContact O-N 3.27Å; D387-K392 IonicContact OD1-NZ 2.66Å; D387-K392 PolarHBondContact OD1-NZ 3.15Å; D387-K392 WeakPolarHBondContact OD2-CD 3.4Å; D387-K392 IonicContact OD2-NZ 3.94Å; D387-K392 PolarHBondContact OD2-NZ 2.88Å
388	F	88.9	Confident	92.2	Very high	52 Å²	52	48.8 Å²	48.8	23%	0.228	26%	0.261	C	S	.	.	H	α-helix	trans	-62.9	-39.1	174.1	176.5	-112.9	0	0	0	111.6	G384 L385 M386 D390 G391 K392 A436 V437	G384-F388 WeakPolarHBondContact O-CB 3.4Å; G384-F388 PolarHBondContact O-N 3.35Å; L385-F388 WeakPolarHBondContact O-CB 3.25Å; L385-F388 PolarHBondContact O-N 2.88Å; M386-F388 VanDerWaalsContact C-N 3.33Å; M386-F388 PolarHBondContact O-N 3.26Å; F388-D390 PolarHBondContact O-N 3.34Å; F388-G391 WeakPolarHBondContact O-CA 3.28Å; F388-G391 PolarHBondContact O-N 3.29Å; F388-K392 WeakPolarHBondContact CD2-O 3.49Å; F388-A436 HydrophobicContact CD1-CB 4.15Å; F388-A436 HydrophobicContact CE1-CB 4.21Å; F388-V437 HydrophobicContact CE1-CG2 4.1Å; F388-V437 HydrophobicContact CZ-CG2 3.97Å
389	F	83.4	Confident	92.3	Very high	21 Å²	21	48.9 Å²	48.9	9%	0.092	26%	0.261	C	S	.	.	H	α-helix	trans	-64.3	-25.7	171	-66.6	-35.3	0	0	0	112.5	F244 L385 M386 D387 G391 A436 L444 L453	F244-F389 HydrophobicContact CD2-CZ 4.39Å; F244-F389 HydrophobicContact CE2-CE2 4.36Å; F244-F389 AromaticContact CE2-CZ 3.81Å; F244-F389 HydrophobicContact CE2-CZ 3.81Å; F244-F389 AromaticContact CZ-CE2 3.99Å; F244-F389 HydrophobicContact CZ-CE2 3.99Å; F244-F389 AromaticContact CZ-CZ 3.9Å; F244-F389 HydrophobicContact CZ-CZ 3.9Å; L385-F389 WeakPolarHBondContact O-CD2 3.37Å; L385-F389 WeakPolarHBondContact O-CG 3.49Å; L385-F389 PolarHBondContact O-N 3.27Å; M386-F389 CarbonylContact O-C 3.55Å; M386-F389 WeakPolarHBondContact O-CA 3.27Å; M386-F389 WeakPolarHBondContact O-CB 3.17Å; M386-F389 PolarHBondContact O-N 3.49Å; M386-F389 VanDerWaalsContact O-N 3.15Å; D387-F389 VanDerWaalsContact C-N 3.3Å; F389-G391 PolarHBondContact O-N 3.31Å; F389-A436 HydrophobicContact CE1-CB 3.59Å; F389-A436 HydrophobicContact CE2-CB 4.47Å; F389-A436 HydrophobicContact CZ-CB 3.49Å; F389-A436 VanDerWaalsContact CZ-CB 3.49Å; F389-L444 HydrophobicContact CB-CD2 3.68Å; F389-L444 HydrophobicContact CD1-CD2 3.06Å; F389-L444 HydrophobicContact CE1-CD2 3.8Å; F389-L444 HydrophobicContact CG-CD2 3.62Å; F389-L444 WeakPolarHBondContact O-CD1 3.49Å; F389-L453 HydrophobicContact CD2-CD1 3.7Å; F389-L453 HydrophobicContact CE2-CD1 3.52Å
390	D	85	Confident	92.5	Very high	117 Å²	117	45.7 Å²	45.7	63%	0.626	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	9.6	170.3	-67.3	-32.3	0	0	0	113.8	M386 D387 F388	M386-D390 PolarHBondContact O-N 3.04Å; D387-D390 CarbonylContact O-C 3.57Å; D387-D390 WeakPolarHBondContact O-CA 3.48Å; D387-D390 PolarHBondContact O-N 2.98Å; F388-D390 PolarHBondContact O-N 3.34Å
391	G	85.3	Confident	92.6	Very high	66 Å²	66	42.1 Å²	42.1	68%	0.68	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.2	13.5	178	0	0	0	0	0	114.6	D387 F388 F389	D387-G391 PolarHBondContact O-N 3.25Å; F388-G391 WeakPolarHBondContact O-CA 3.28Å; F388-G391 PolarHBondContact O-N 3.29Å; F389-G391 PolarHBondContact O-N 3.31Å
392	K	89.4	Confident	92.7	Very high	117 Å²	117	42.1 Å²	42.1	51%	0.509	23%	0.228	S	C	.	.	S	Bend	trans	-82	-176.5	170.9	-57.8	173.2	-179.8	165.3	0	111.2	D387 F388	D387-K392 HydrophobicContact CB-CB 4.33Å; D387-K392 HydrophobicContact CB-CD 3.67Å; D387-K392 VanDerWaalsContact O-CB 3.22Å; D387-K392 WeakPolarHBondContact O-CB 3.4Å; D387-K392 WeakPolarHBondContact O-CG 3.37Å; D387-K392 PolarHBondContact O-N 3.27Å; D387-K392 IonicContact OD1-NZ 2.66Å; D387-K392 PolarHBondContact OD1-NZ 3.15Å; D387-K392 WeakPolarHBondContact OD2-CD 3.4Å; D387-K392 IonicContact OD2-NZ 3.94Å; D387-K392 PolarHBondContact OD2-NZ 2.88Å; F388-K392 WeakPolarHBondContact CD2-O 3.49Å
393	E	90.1	Very high	92.9	Very high	180 Å²	180	42.1 Å²	42.1	84%	0.841	23%	0.228	S	C	*	.	P	Polyproline II helix	trans	-69.6	145.4	176.7	-65.9	-170.3	165.2	0	0	112.1
394	S	91.1	Very high	93.1	Very high	36 Å²	36	38 Å²	38	25%	0.252	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-69.2	141	177.7	-177.5	0	0	0	0	111.5	K433	S394-K433 VanDerWaalsContact OG-CE 3.24Å; S394-K433 WeakPolarHBondContact OG-CE 3.18Å
395	P	95.3	Very high	93.3	Very high	13 Å²	13	39.6 Å²	39.6	8%	0.084	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-64.2	159.3	178.1	27	-34	0	0	0	112	F381 G384 L385 K433	F381-P395 HydrophobicContact CD2-CB 3.82Å; F381-P395 HydrophobicContact CD2-CG 3.87Å; F381-P395 HydrophobicContact CE2-CB 4.1Å; F381-P395 HydrophobicContact CE2-CG 3.73Å; F381-P395 HydrophobicContact CZ-CG 4.49Å; G384-P395 WeakPolarHBondContact O-CD 3.45Å; L385-P395 HydrophobicContact CD2-CG 3.68Å; L385-P395 HydrophobicContact CG-CG 3.91Å; P395-K433 PolarHBondContact O-NZ 3Å
396	A	96.2	Very high	93.6	Very high	27 Å²	27	45 Å²	45	22%	0.223	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-70.9	139.6	170.8	0	0	0	0	0	110	F355 Y376 F381	F355-A396 HydrophobicContact CB-CB 3.65Å; F355-A396 HydrophobicContact CD1-CB 3.82Å; F355-A396 HydrophobicContact CG-CB 3.89Å; Y376-A396 VanDerWaalsContact CE1-O 3.29Å; Y376-A396 WeakPolarHBondContact CE1-O 3.45Å; Y376-A396 PolarHBondContact OH-O 3.25Å; F381-A396 WeakPolarHBondContact CD2-O 3.4Å
397	S	96.5	Very high	94	Very high	10 Å²	10	43.9 Å²	43.9	7%	0.07	25%	0.246	C	C	.	.			trans	-115.3	4.3	173.7	53.4	0	0	0	0	111.9	V425 P426 K433	S397-V425 WeakPolarHBondContact O-CG1 3.29Å; S397-P426 WeakPolarHBondContact O-CD 3.47Å; S397-K433 WeakPolarHBondContact OG-CD 3.48Å
398	S	97.2	Very high	94.4	Very high	15 Å²	15	41.7 Å²	41.7	11%	0.105	23%	0.234	C	C	.	.			trans	-141.5	148	-171.4	-48.8	0	0	0	0	109.8	V425	S398-V425 WeakPolarHBondContact OG-CG2 3.49Å
399	M	98.3	Very high	94.8	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	138.9	173	-65.8	149.8	-73.6	0	0	109.3	I341 W353 F355 L375 F401 E423 V424 P426	I341-M399 HydrophobicContact CD1-CE 3.87Å; I341-M399 HydrophobicContact CD1-SD 4.39Å; I341-M399 HydrophobicContact CG2-CE 4.02Å; I341-M399 HydrophobicContact CG2-SD 3.77Å; W353-M399 HydrophobicContact CZ3-CG 4.41Å; F355-M399 HydrophobicContact CD1-CG 3.95Å; F355-M399 HydrophobicContact CE1-CG 3.95Å; L375-M399 HydrophobicContact CD1-SD 4.39Å; M399-F401 HydrophobicContact CB-CE2 3.71Å; M399-F401 HydrophobicContact CB-CZ 4.08Å; M399-E423 CarbonylContact O-C 3.59Å; M399-E423 WeakPolarHBondContact O-CA 3.33Å; M399-V424 PolarHBondContact N-O 3.16Å; M399-V424 PolarHBondContact O-N 3.2Å; M399-P426 HydrophobicContact CE-CG 3.68Å
400	F	98.7	Very high	95.4	Very high	13 Å²	13	41.5 Å²	41.5	6%	0.057	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	127.1	179.6	-66.3	-87.6	0	0	0	109.5	W353 S354 K357 M421 V422 E423	W353-F400 CarbonylContact C-O 3.59Å; W353-F400 WeakPolarHBondContact CA-O 3.35Å; S354-F400 PolarHBondContact N-O 3.45Å; S354-F400 PolarHBondContact O-N 3.03Å; K357-F400 HydrophobicContact CB-CD1 3.77Å; K357-F400 HydrophobicContact CB-CD2 4.26Å; K357-F400 HydrophobicContact CB-CE1 3.82Å; K357-F400 HydrophobicContact CB-CE2 4.31Å; K357-F400 HydrophobicContact CB-CG 3.99Å; K357-F400 HydrophobicContact CB-CZ 4.1Å; K357-F400 HydrophobicContact CD-CD1 4.49Å; K357-F400 HydrophobicContact CD-CE1 3.77Å; K357-F400 HydrophobicContact CD-CZ 3.95Å; K357-F400 HydrophobicContact CG-CE1 4.1Å; K357-F400 HydrophobicContact CG-CE2 4.45Å; K357-F400 HydrophobicContact CG-CZ 4.05Å; K357-F400 VanDerWaalsContact N-CD2 3.3Å; F400-M421 HydrophobicContact CB-CE 3.96Å; F400-V422 CarbonylContact C-O 3.45Å; F400-V422 WeakPolarHBondContact CA-O 3.5Å; F400-E423 HydrophobicContact CD1-CB 3.88Å; F400-E423 HydrophobicContact CD1-CG 4.12Å; F400-E423 HydrophobicContact CE1-CB 3.65Å; F400-E423 HydrophobicContact CE1-CG 3.55Å; F400-E423 HydrophobicContact CZ-CB 4.43Å; F400-E423 HydrophobicContact CZ-CG 3.83Å; F400-E423 WeakPolarHBondContact CZ-OE1 3.38Å
401	F	98.8	Very high	95.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	126.9	179.3	-59.9	-94	0	0	0	109.9	L332 V334 Y352 W353 I367 L375 M399 M421 V422 V424	L332-F401 HydrophobicContact CD2-CB 4.03Å; L332-F401 HydrophobicContact CD2-CD1 3.76Å; L332-F401 HydrophobicContact CD2-CE1 4.43Å; L332-F401 HydrophobicContact CD2-CG 3.96Å; V334-F401 HydrophobicContact CG1-CZ 4.17Å; V334-F401 HydrophobicContact CG2-CE1 4.07Å; V334-F401 HydrophobicContact CG2-CE2 4.04Å; V334-F401 HydrophobicContact CG2-CZ 3.65Å; Y352-F401 CarbonylContact O-C 3.53Å; Y352-F401 VanDerWaalsContact O-CA 3.24Å; Y352-F401 WeakPolarHBondContact O-CA 3.47Å; W353-F401 HydrophobicContact CB-CD1 3.67Å; W353-F401 HydrophobicContact CB-CE1 3.85Å; W353-F401 HydrophobicContact CB-CG 4.36Å; W353-F401 HydrophobicContact CG-CE1 4.41Å; I367-F401 HydrophobicContact CD1-CD1 4.23Å; I367-F401 HydrophobicContact CD1-CE1 3.83Å; I367-F401 HydrophobicContact CG1-CD1 4.26Å; I367-F401 HydrophobicContact CG1-CE1 4.34Å; L375-F401 HydrophobicContact CD1-CE1 4Å; L375-F401 HydrophobicContact CD1-CZ 3.83Å; M399-F401 HydrophobicContact CB-CE2 3.71Å; M399-F401 HydrophobicContact CB-CZ 4.08Å; F401-M421 CarbonylContact O-C 3.58Å; F401-M421 WeakPolarHBondContact O-CA 3.47Å; F401-V422 HydrophobicContact CB-CB 4.46Å; F401-V422 PolarHBondContact N-O 3.2Å; F401-V422 PolarHBondContact O-N 3.31Å; F401-V424 HydrophobicContact CD2-CB 4.47Å; F401-V424 HydrophobicContact CD2-CG2 3.92Å; F401-V424 HydrophobicContact CE2-CB 3.96Å; F401-V424 HydrophobicContact CE2-CG2 3.76Å
402	C	98.8	Very high	96.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	119.4	174.2	-172.1	0	0	0	0	109.1	A351 Y352 E405 W407 M421	A351-C402 WeakPolarHBondContact CA-O 3.35Å; Y352-C402 PolarHBondContact N-O 3.35Å; Y352-C402 PolarHBondContact O-N 3.05Å; C402-E405 PolarHBondContact SG-O 2.87Å; C402-W407 HydrophobicContact CB-CB 3.28Å; C402-W407 HydrophobicContact CB-CG 3.94Å; C402-M421 HydrophobicContact CB-CE 4.46Å; C402-M421 HydrophobicContact CB-SD 3.43Å; C402-M421 WeakPolarHBondContact CB-SD 3.32Å; C402-M421 VanDerWaalsContact SG-SD 3.68Å
403	L	98.7	Very high	96.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	124.2	-174.9	-51.2	-179.3	0	0	0	110.1	L307 I325 L329 L332 V349 A351 E405 I420 V422	L307-L403 HydrophobicContact CD1-CD1 3.8Å; I325-L403 HydrophobicContact CG2-CB 4.33Å; L329-L403 HydrophobicContact CD1-CB 4.48Å; L329-L403 HydrophobicContact CD1-CD1 3.91Å; L329-L403 HydrophobicContact CD1-CD2 4.49Å; L329-L403 HydrophobicContact CD2-CD1 4.41Å; L332-L403 HydrophobicContact CD2-CD2 3.77Å; V349-L403 HydrophobicContact CG1-CB 4.4Å; A351-L403 HydrophobicContact CB-CD2 3.74Å; L403-E405 VanDerWaalsContact C-N 3.25Å; L403-E405 PolarHBondContact O-N 2.86Å; L403-I420 HydrophobicContact CB-CB 4.17Å; L403-I420 HydrophobicContact CB-CG2 4.19Å; L403-I420 HydrophobicContact CD1-CG2 3.84Å; L403-I420 HydrophobicContact CG-CG2 4.17Å; L403-I420 PolarHBondContact N-O 3Å; L403-I420 VanDerWaalsContact N-O 3.08Å; L403-V422 HydrophobicContact CD1-CG2 4.02Å
404	G	98	Very high	96.8	Very high	39 Å²	39	37 Å²	37	40%	0.402	21%	0.207	S	C	.	.	S	Bend	trans	81.9	-9.2	178	0	0	0	0	0	115.4	K350	K350-G404 PolarHBondContact O-N 2.88Å
405	E	98.3	Very high	97	Very high	49 Å²	49	36.2 Å²	36.2	23%	0.229	20%	0.199	C	C	.	.	S	Bend	trans	-133.3	147	179.6	-65.9	-179.2	72.1	0	0	111.7	Y352 C402 L403 W407 K418 L419	Y352-E405 WeakPolarHBondContact CD2-O 3.36Å; C402-E405 PolarHBondContact SG-O 2.87Å; L403-E405 VanDerWaalsContact C-N 3.25Å; L403-E405 PolarHBondContact O-N 2.86Å; E405-W407 PolarHBondContact O-N 3.43Å; E405-K418 HydrophobicContact CB-CD 4.07Å; E405-K418 WeakPolarHBondContact OE1-CD 3.26Å; E405-K418 IonicContact OE1-NZ 2.74Å; E405-K418 WeakPolarHBondContact OE2-CA 3.28Å; E405-L419 WeakPolarHBondContact OE2-CB 3.49Å; E405-L419 WeakPolarHBondContact OE2-CG 3.38Å; E405-L419 PolarHBondContact OE2-N 3.45Å
406	K	98.5	Very high	97.1	Very high	113 Å²	113	39.4 Å²	39.4	49%	0.491	21%	0.212	S	C	.	.			trans	-60	135.7	177	-69.8	179.4	177.1	-179	0	111.7	Y352 P364 P410 K418	Y352-K406 HydrophobicContact CE1-CG 4.07Å; Y352-K406 HydrophobicContact CE2-CB 4.48Å; Y352-K406 HydrophobicContact CE2-CG 4.05Å; P364-K406 HydrophobicContact CB-CB 4.13Å; P364-K406 HydrophobicContact CB-CG 4.38Å; P364-K406 HydrophobicContact CG-CB 4.02Å; P364-K406 HydrophobicContact CG-CD 4.12Å; P364-K406 HydrophobicContact CG-CG 4.31Å; K406-P410 HydrophobicContact CB-CG 4.18Å; K406-P410 HydrophobicContact CD-CG 3.67Å; K406-K418 VanDerWaalsContact O-CE 3.26Å; K406-K418 WeakPolarHBondContact O-CE 3.49Å; K406-K418 PolarHBondContact O-NZ 3.19Å
407	W	98	Very high	97.1	Very high	5 Å²	5	43.7 Å²	43.7	2%	0.019	23%	0.226	C	C	.	.	S	Bend	trans	-146.5	140.2	172.6	-174.7	-105.5	0	0	0	111.3	Y352 S356 K357 D359 P364 R365 C402 E405 D409 W415 K418 M421	Y352-W407 WeakPolarHBondContact CB-O 3.48Å; S356-W407 PolarHBondContact O-NE1 3.49Å; K357-W407 VanDerWaalsContact C-CZ2 3.48Å; K357-W407 VanDerWaalsContact O-CH2 3.26Å; K357-W407 WeakPolarHBondContact O-CH2 3.5Å; K357-W407 WeakPolarHBondContact O-CZ2 3.29Å; D359-W407 HydrophobicContact CB-CZ2 4.41Å; P364-W407 VanDerWaalsContact CA-O 3.28Å; P364-W407 WeakPolarHBondContact CA-O 3.27Å; R365-W407 PolarHBondContact N-O 2.77Å; R365-W407 VanDerWaalsContact N-O 3.16Å; C402-W407 HydrophobicContact CB-CB 3.28Å; C402-W407 HydrophobicContact CB-CG 3.94Å; E405-W407 PolarHBondContact O-N 3.43Å; W407-D409 HydrophobicContact CE3-CB 4.41Å; W407-D409 HydrophobicContact CZ3-CB 4.45Å; W407-W415 HydrophobicContact CH2-CB 3.66Å; W407-W415 HydrophobicContact CZ2-CB 4.22Å; W407-W415 HydrophobicContact CZ3-CB 3.98Å; W407-K418 HydrophobicContact CE3-CG 4.3Å; W407-M421 HydrophobicContact CD2-CE 4.31Å; W407-M421 HydrophobicContact CG-CE 4.47Å
408	P	97.8	Very high	97.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.223	C	C	.	.	S	Bend	cis	-45.8	145.1	-19.4	-30.6	38.5	0	0	0	113	D359 S361 Q363 P364	D359-P408 HydrophobicContact CB-CB 4.35Å; D359-P408 HydrophobicContact CB-CG 3.69Å; D359-P408 WeakPolarHBondContact OD1-CG 3.34Å; D359-P408 WeakPolarHBondContact OD2-CG 3.37Å; S361-P408 WeakPolarHBondContact OG-CG 3.41Å; Q363-P408 WeakPolarHBondContact O-CD 3.48Å; P364-P408 WeakPolarHBondContact CG-O 3.4Å
409	D	97.3	Very high	97.2	Very high	10 Å²	10	43.9 Å²	43.9	5%	0.053	23%	0.225	C	C	.	.			trans	-71.4	128.7	-172.5	-172.5	-80.5	0	0	0	111.1	W407 E411 N412 K413 K418	W407-D409 HydrophobicContact CE3-CB 4.41Å; W407-D409 HydrophobicContact CZ3-CB 4.45Å; D409-E411 PolarHBondContact O-N 2.75Å; D409-E411 VanDerWaalsContact OD1-CA 3.28Å; D409-E411 WeakPolarHBondContact OD1-CA 3.35Å; D409-E411 WeakPolarHBondContact OD1-CB 3.37Å; D409-E411 PolarHBondContact OD1-N 3.18Å; D409-N412 WeakPolarHBondContact O-CA 3.41Å; D409-N412 PolarHBondContact O-N 2.91Å; D409-N412 PolarHBondContact OD1-N 2.67Å; D409-K413 HydrophobicContact CB-CB 4.09Å; D409-K413 PolarHBondContact OD1-N 3.28Å; D409-K418 WeakPolarHBondContact OD2-CE 3.45Å; D409-K418 IonicContact OD2-NZ 3.68Å; D409-K418 PolarHBondContact OD2-NZ 3.07Å
410	P	96.8	Very high	97.2	Very high	59 Å²	59	43.8 Å²	43.8	38%	0.383	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-24.6	-179.8	-23.3	32.4	0	0	0	114.7	P364 K406 N412	P364-P410 HydrophobicContact CG-CG 3.69Å; K406-P410 HydrophobicContact CB-CG 4.18Å; K406-P410 HydrophobicContact CD-CG 3.67Å; P410-N412 VanDerWaalsContact C-N 3.33Å
411	E	95.6	Very high	97.2	Very high	142 Å²	142	43.3 Å²	43.3	66%	0.664	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.9	10.3	175.5	-60.4	170.4	-130	0	0	111.4	D409 K413	D409-E411 PolarHBondContact O-N 2.75Å; D409-E411 VanDerWaalsContact OD1-CA 3.28Å; D409-E411 WeakPolarHBondContact OD1-CA 3.35Å; D409-E411 WeakPolarHBondContact OD1-CB 3.37Å; D409-E411 PolarHBondContact OD1-N 3.18Å; E411-K413 HydrophobicContact CB-CG 4.33Å; E411-K413 PolarHBondContact O-N 3.13Å; E411-K413 IonicContact OE1-NZ 2.84Å; E411-K413 PolarHBondContact OE1-NZ 3.24Å; E411-K413 WeakPolarHBondContact OE2-CE 3.07Å; E411-K413 IonicContact OE2-NZ 3.42Å; E411-K413 PolarHBondContact OE2-NZ 2.77Å
412	N	92.4	Very high	97.2	Very high	90 Å²	90	43.3 Å²	43.3	48%	0.481	22%	0.222	S	C	.	.			trans	55.6	33	-177.9	-161.4	26.6	0	0	0	113	M362 D409 P410	M362-N412 HydrophobicContact CG-CB 4.05Å; M362-N412 HydrophobicContact SD-CB 4.1Å; D409-N412 WeakPolarHBondContact O-CA 3.41Å; D409-N412 PolarHBondContact O-N 2.91Å; D409-N412 PolarHBondContact OD1-N 2.67Å; P410-N412 VanDerWaalsContact C-N 3.33Å
413	K	93.9	Very high	97.2	Very high	83 Å²	83	44.5 Å²	44.5	36%	0.361	23%	0.228	S	C	.	.			trans	-63.9	136.1	171.3	-66.5	170	-177	145.4	0	109.2	D409 E411	D409-K413 HydrophobicContact CB-CB 4.09Å; D409-K413 PolarHBondContact OD1-N 3.28Å; E411-K413 HydrophobicContact CB-CG 4.33Å; E411-K413 PolarHBondContact O-N 3.13Å; E411-K413 IonicContact OE1-NZ 2.84Å; E411-K413 PolarHBondContact OE1-NZ 3.24Å; E411-K413 WeakPolarHBondContact OE2-CE 3.07Å; E411-K413 IonicContact OE2-NZ 3.42Å; E411-K413 PolarHBondContact OE2-NZ 2.77Å
414	P	95.8	Very high	97.2	Very high	71 Å²	71	44.5 Å²	44.5	46%	0.461	23%	0.228	S	C	.	.			trans	-70.6	151.6	-179.4	33.7	-38.1	0	0	0	110.6	E416 K417	P414-E416 WeakPolarHBondContact CB-OE2 3.29Å; P414-E416 PolarHBondContact O-N 3.46Å; P414-E416 VanDerWaalsContact O-N 3.09Å; P414-K417 HydrophobicContact CG-CG 4.03Å; P414-K417 WeakPolarHBondContact O-CB 3.39Å; P414-K417 PolarHBondContact O-N 3.31Å
415	W	96.6	Very high	97.2	Very high	20 Å²	20	42.6 Å²	42.6	8%	0.076	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-58.7	-26.4	-173.4	76.2	-78.5	0	0	0	113.4	F266 K357 F358 W407 K417 K418 M421	F266-W415 HydrophobicContact CB-CZ3 3.89Å; F266-W415 AromaticContact CD1-CH2 3.8Å; F266-W415 HydrophobicContact CD1-CH2 3.8Å; F266-W415 AromaticContact CD1-CZ3 3.8Å; F266-W415 HydrophobicContact CD1-CZ3 3.8Å; F266-W415 HydrophobicContact CD2-CZ3 4.45Å; F266-W415 HydrophobicContact CE1-CH2 4.19Å; F266-W415 HydrophobicContact CE1-CZ3 4.45Å; F266-W415 HydrophobicContact CG-CH2 4.29Å; F266-W415 AromaticContact CG-CZ3 3.8Å; F266-W415 HydrophobicContact CG-CZ3 3.8Å; K357-W415 HydrophobicContact CB-CB 4.4Å; K357-W415 HydrophobicContact CB-CD2 4.17Å; K357-W415 HydrophobicContact CB-CG 3.97Å; K357-W415 HydrophobicContact CD-CD2 4.28Å; K357-W415 HydrophobicContact CD-CZ2 4.17Å; K357-W415 WeakPolarHBondContact O-CB 3.46Å; K357-W415 VanDerWaalsContact O-CD1 3.26Å; F358-W415 AromaticContact CE1-NE1 3.83Å; W407-W415 HydrophobicContact CH2-CB 3.66Å; W407-W415 HydrophobicContact CZ2-CB 4.22Å; W407-W415 HydrophobicContact CZ3-CB 3.98Å; W415-K417 PolarHBondContact O-N 2.89Å; W415-K418 VanDerWaalsContact O-CB 3.29Å; W415-K418 WeakPolarHBondContact O-CB 3.09Å; W415-K418 PolarHBondContact O-N 3.48Å; W415-M421 HydrophobicContact CB-CE 4.45Å; W415-M421 HydrophobicContact CE3-CB 4.29Å; W415-M421 HydrophobicContact CE3-CG 4.13Å
416	E	96.6	Very high	97.2	Very high	79 Å²	79	40.3 Å²	40.3	37%	0.369	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-65.1	-10.5	176.1	-58.1	86.3	169.1	0	0	113.1	R268 P414	R268-E416 CarbonylContact C-O 3.46Å; R268-E416 WeakPolarHBondContact CA-O 3.14Å; R268-E416 WeakPolarHBondContact CG-O 3.28Å; R268-E416 VanDerWaalsContact O-O 3.1Å; P414-E416 WeakPolarHBondContact CB-OE2 3.29Å; P414-E416 PolarHBondContact O-N 3.46Å; P414-E416 VanDerWaalsContact O-N 3.09Å
417	K	95.9	Very high	97.1	Very high	118 Å²	118	35.9 Å²	35.9	51%	0.513	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-89.8	-12.9	172.6	-64.4	-64.5	-177.3	-178.9	0	113.4	P414 W415	P414-K417 HydrophobicContact CG-CG 4.03Å; P414-K417 WeakPolarHBondContact O-CB 3.39Å; P414-K417 PolarHBondContact O-N 3.31Å; W415-K417 PolarHBondContact O-N 2.89Å
418	K	97.9	Very high	97	Very high	2 Å²	2	36 Å²	36	1%	0.009	18%	0.182	C	C	.	.			trans	-75.4	132	179.1	-59.5	-56.4	-172.3	174.6	0	111.3	R268 E405 K406 W407 D409 W415 I420 M421	R268-K418 WeakPolarHBondContact CA-O 3.12Å; R268-K418 PolarHBondContact N-O 2.89Å; E405-K418 HydrophobicContact CB-CD 4.07Å; E405-K418 WeakPolarHBondContact OE1-CD 3.26Å; E405-K418 IonicContact OE1-NZ 2.74Å; E405-K418 WeakPolarHBondContact OE2-CA 3.28Å; K406-K418 VanDerWaalsContact O-CE 3.26Å; K406-K418 WeakPolarHBondContact O-CE 3.49Å; K406-K418 PolarHBondContact O-NZ 3.19Å; W407-K418 HydrophobicContact CE3-CG 4.3Å; D409-K418 WeakPolarHBondContact OD2-CE 3.45Å; D409-K418 IonicContact OD2-NZ 3.68Å; D409-K418 PolarHBondContact OD2-NZ 3.07Å; W415-K418 VanDerWaalsContact O-CB 3.29Å; W415-K418 WeakPolarHBondContact O-CB 3.09Å; W415-K418 PolarHBondContact O-N 3.48Å; K418-I420 PolarHBondContact O-N 3.25Å; K418-M421 HydrophobicContact CB-CG 3.65Å; K418-M421 HydrophobicContact CB-SD 3.9Å; K418-M421 HydrophobicContact CG-CG 4.31Å; K418-M421 HydrophobicContact CG-SD 4.01Å
419	L	98.3	Very high	97	Very high	27 Å²	27	36 Å²	36	14%	0.141	18%	0.182	C	C	.	.	S	Bend	trans	-62.9	-42.4	-176.5	-71.1	172	0	0	0	111.8	Y267 R268 Q318 L321 I325 E405	Y267-L419 VanDerWaalsContact CA-O 3.28Å; Y267-L419 WeakPolarHBondContact CA-O 3.36Å; Y267-L419 WeakPolarHBondContact CD1-O 3.15Å; R268-L419 PolarHBondContact N-O 3.2Å; Q318-L419 HydrophobicContact CG-CD2 3.95Å; L321-L419 HydrophobicContact CB-CD1 3.69Å; L321-L419 HydrophobicContact CB-CD2 4.24Å; L321-L419 HydrophobicContact CD1-CD1 4.49Å; I325-L419 HydrophobicContact CD1-CB 4.1Å; I325-L419 HydrophobicContact CD1-CD1 3.7Å; E405-L419 WeakPolarHBondContact OE2-CB 3.49Å; E405-L419 WeakPolarHBondContact OE2-CG 3.38Å; E405-L419 PolarHBondContact OE2-N 3.45Å
420	I	98.7	Very high	96.9	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.191	C	C	.	.			trans	-137.9	114.3	180	-50.7	-178.3	0	0	0	109.9	F266 Y267 T322 I325 L326 L403 K418 V422	F266-I420 WeakPolarHBondContact O-CA 3.03Å; Y267-I420 HydrophobicContact CD1-CB 4.4Å; Y267-I420 HydrophobicContact CD1-CG1 3.96Å; Y267-I420 HydrophobicContact CD1-CG2 4.32Å; Y267-I420 HydrophobicContact CE1-CB 4.38Å; Y267-I420 HydrophobicContact CE1-CD1 4.27Å; Y267-I420 HydrophobicContact CE1-CG1 3.89Å; Y267-I420 HydrophobicContact CE1-CG2 3.95Å; T322-I420 HydrophobicContact CG2-CD1 4Å; T322-I420 HydrophobicContact CG2-CG1 3.97Å; I325-I420 HydrophobicContact CB-CD1 3.87Å; I325-I420 HydrophobicContact CG2-CD1 3.68Å; L326-I420 HydrophobicContact CD2-CD1 3.81Å; L326-I420 HydrophobicContact CG-CD1 3.92Å; L403-I420 HydrophobicContact CB-CB 4.17Å; L403-I420 HydrophobicContact CB-CG2 4.19Å; L403-I420 HydrophobicContact CD1-CG2 3.84Å; L403-I420 HydrophobicContact CG-CG2 4.17Å; L403-I420 PolarHBondContact N-O 3Å; L403-I420 VanDerWaalsContact N-O 3.08Å; K418-I420 PolarHBondContact O-N 3.25Å; I420-V422 HydrophobicContact CG2-CG2 4.26Å
421	M	98.8	Very high	96.9	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.01	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	137.5	169.6	-69	-70.4	-63.3	0	0	108.7	F266 F400 F401 C402 W407 W415 K418	F266-M421 HydrophobicContact CB-CB 4.23Å; F266-M421 PolarHBondContact N-O 3.45Å; F266-M421 PolarHBondContact O-N 3.03Å; F400-M421 HydrophobicContact CB-CE 3.96Å; F401-M421 CarbonylContact O-C 3.58Å; F401-M421 WeakPolarHBondContact O-CA 3.47Å; C402-M421 HydrophobicContact CB-CE 4.46Å; C402-M421 HydrophobicContact CB-SD 3.43Å; C402-M421 WeakPolarHBondContact CB-SD 3.32Å; C402-M421 VanDerWaalsContact SG-SD 3.68Å; W407-M421 HydrophobicContact CD2-CE 4.31Å; W407-M421 HydrophobicContact CG-CE 4.47Å; W415-M421 HydrophobicContact CB-CE 4.45Å; W415-M421 HydrophobicContact CE3-CB 4.29Å; W415-M421 HydrophobicContact CE3-CG 4.13Å; K418-M421 HydrophobicContact CB-CG 3.65Å; K418-M421 HydrophobicContact CB-SD 3.9Å; K418-M421 HydrophobicContact CG-CG 4.31Å; K418-M421 HydrophobicContact CG-SD 4.01Å
422	V	98.8	Very high	96.8	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	125.1	176.3	-173.8	0	0	0	0	108.5	V263 A264 V265 L285 L307 F400 F401 L403 I420 V424	V263-V422 HydrophobicContact CG1-CG1 3.68Å; A264-V422 CarbonylContact O-C 3.59Å; A264-V422 WeakPolarHBondContact O-CA 3.42Å; V265-V422 HydrophobicContact CG1-CG2 4.5Å; V265-V422 HydrophobicContact CG2-CG1 4.45Å; V265-V422 HydrophobicContact CG2-CG2 4.5Å; L285-V422 HydrophobicContact CD1-CB 4.35Å; L285-V422 HydrophobicContact CD1-CG1 3.83Å; L285-V422 HydrophobicContact CD1-CG2 4.44Å; L285-V422 HydrophobicContact CD2-CG1 4.36Å; L307-V422 HydrophobicContact CD2-CG2 4.03Å; F400-V422 CarbonylContact C-O 3.45Å; F400-V422 WeakPolarHBondContact CA-O 3.5Å; F401-V422 HydrophobicContact CB-CB 4.46Å; F401-V422 PolarHBondContact N-O 3.2Å; F401-V422 PolarHBondContact O-N 3.31Å; L403-V422 HydrophobicContact CD1-CG2 4.02Å; I420-V422 HydrophobicContact CG2-CG2 4.26Å; V422-V424 HydrophobicContact CG1-CG2 4.24Å
423	E	98.8	Very high	96.8	Very high	25 Å²	25	30.5 Å²	30.5	12%	0.117	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	129	170.8	-178.6	175.9	-163.7	0	0	108.6	V263 A264 F266 M399 F400 V425	V263-E423 CarbonylContact C-O 3.12Å; V263-E423 WeakPolarHBondContact CA-O 3.44Å; A264-E423 HydrophobicContact CB-CB 4.29Å; A264-E423 PolarHBondContact N-O 3.42Å; A264-E423 PolarHBondContact O-N 3.01Å; F266-E423 HydrophobicContact CE2-CB 3.93Å; M399-E423 CarbonylContact O-C 3.59Å; M399-E423 WeakPolarHBondContact O-CA 3.33Å; F400-E423 HydrophobicContact CD1-CB 3.88Å; F400-E423 HydrophobicContact CD1-CG 4.12Å; F400-E423 HydrophobicContact CE1-CB 3.65Å; F400-E423 HydrophobicContact CE1-CG 3.55Å; F400-E423 HydrophobicContact CZ-CB 4.43Å; F400-E423 HydrophobicContact CZ-CG 3.83Å; F400-E423 WeakPolarHBondContact CZ-OE1 3.38Å; E423-V425 HydrophobicContact CG-CG2 3.8Å
424	V	98.7	Very high	96.8	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	125.3	173.6	-178.9	0	0	0	0	108.2	F261 R262 V263 L283 V334 M399 F401 V422	F261-V424 HydrophobicContact CD1-CG1 3.83Å; R262-V424 WeakPolarHBondContact O-CA 3.26Å; V263-V424 HydrophobicContact CG2-CG2 4.49Å; L283-V424 HydrophobicContact CD2-CG1 3.98Å; V334-V424 HydrophobicContact CG1-CG1 4.09Å; M399-V424 PolarHBondContact N-O 3.16Å; M399-V424 PolarHBondContact O-N 3.2Å; F401-V424 HydrophobicContact CD2-CB 4.47Å; F401-V424 HydrophobicContact CD2-CG2 3.92Å; F401-V424 HydrophobicContact CE2-CB 3.96Å; F401-V424 HydrophobicContact CE2-CG2 3.76Å; V422-V424 HydrophobicContact CG1-CG2 4.24Å
425	V	98.4	Very high	96.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	112.4	-175.1	-174.4	0	0	0	0	109.2	F261 R262 S397 S398 E423 T427 E430	F261-V425 CarbonylContact C-O 3.49Å; F261-V425 WeakPolarHBondContact CA-O 3.14Å; R262-V425 HydrophobicContact CB-CB 4.34Å; R262-V425 PolarHBondContact N-O 2.94Å; R262-V425 PolarHBondContact O-N 3.42Å; S397-V425 WeakPolarHBondContact O-CG1 3.29Å; S398-V425 WeakPolarHBondContact OG-CG2 3.49Å; E423-V425 HydrophobicContact CG-CG2 3.8Å; V425-T427 PolarHBondContact O-N 3.05Å; V425-E430 HydrophobicContact CG1-CB 3.73Å; V425-E430 HydrophobicContact CG1-CG 4.31Å
426	P	97.9	Very high	96.1	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	112.6	164.9	-15.5	30.1	0	0	0	108.6	T259 H260 F261 I341 S397 M399 S428 M429 E430	T259-P426 HydrophobicContact CG2-CB 4.36Å; H260-P426 WeakPolarHBondContact O-CA 3.24Å; F261-P426 HydrophobicContact CD1-CG 4.48Å; F261-P426 HydrophobicContact CE1-CB 4.41Å; F261-P426 HydrophobicContact CE1-CG 4.26Å; I341-P426 HydrophobicContact CD1-CB 4.31Å; I341-P426 HydrophobicContact CD1-CG 3.42Å; I341-P426 VanDerWaalsContact CD1-CG 3.42Å; S397-P426 WeakPolarHBondContact O-CD 3.47Å; M399-P426 HydrophobicContact CE-CG 3.68Å; P426-S428 PolarHBondContact O-N 3.09Å; P426-M429 HydrophobicContact CB-CB 4.28Å; P426-M429 HydrophobicContact CB-CG 4.07Å; P426-M429 HydrophobicContact CB-SD 4.04Å; P426-M429 HydrophobicContact CG-SD 3.88Å; P426-M429 PolarHBondContact O-N 3.1Å; P426-M429 VanDerWaalsContact O-N 3.09Å; P426-E430 PolarHBondContact O-N 3.02Å
427	T	97.1	Very high	95.6	Very high	20 Å²	20	26.3 Å²	26.3	12%	0.123	14%	0.135	C	C	.	.	H	α-helix	trans	-60.3	-34.9	-169.1	55.8	0	0	0	0	112.2	T259 H260 R262 V425 E430 L431	T259-T427 PolarHBondContact OG1-N 3.27Å; H260-T427 HydrophobicContact CB-CG2 4.38Å; H260-T427 PolarHBondContact N-OG1 3.09Å; H260-T427 PolarHBondContact O-N 3.34Å; H260-T427 PolarHBondContact O-OG1 3.3Å; R262-T427 HydrophobicContact CB-CG2 4.35Å; V425-T427 PolarHBondContact O-N 3.05Å; T427-E430 PolarHBondContact O-N 3.47Å; T427-L431 VanDerWaalsContact O-CG 3.28Å; T427-L431 WeakPolarHBondContact O-CG 3.33Å; T427-L431 PolarHBondContact O-N 3.48Å
428	S	96	Very high	95.1	Very high	8 Å²	8	27 Å²	27	6%	0.056	14%	0.14	C	C	.	.	H	α-helix	trans	-69.3	-34.4	179.2	-64.6	0	0	0	0	113.1	T251 K258 T259 P426 L431 L432	T251-S428 VanDerWaalsContact CG2-CB 3.45Å; K258-S428 VanDerWaalsContact O-CB 3.23Å; K258-S428 WeakPolarHBondContact O-CB 3.4Å; K258-S428 PolarHBondContact O-OG 3.09Å; T259-S428 WeakPolarHBondContact CA-OG 3.34Å; T259-S428 PolarHBondContact OG1-N 2.82Å; P426-S428 PolarHBondContact O-N 3.09Å; S428-L431 PolarHBondContact O-N 3.46Å; S428-L432 WeakPolarHBondContact O-CB 3.19Å; S428-L432 VanDerWaalsContact O-CG 3.29Å; S428-L432 WeakPolarHBondContact O-CG 3.33Å; S428-L432 PolarHBondContact O-N 3.34Å
429	M	96.8	Very high	94.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-67.3	-40.1	172.2	-67.4	-177	172.2	0	0	111.1	F257 I341 Y376 V378 F381 P426 K433	F257-M429 HydrophobicContact CE1-CE 4.4Å; F257-M429 HydrophobicContact CE1-CG 4.11Å; F257-M429 HydrophobicContact CZ-CG 4.01Å; I341-M429 HydrophobicContact CD1-CE 3.63Å; I341-M429 HydrophobicContact CD1-SD 3.84Å; I341-M429 HydrophobicContact CG1-CE 4.43Å; Y376-M429 HydrophobicContact CD1-CE 4.3Å; Y376-M429 HydrophobicContact CD1-SD 4.09Å; Y376-M429 HydrophobicContact CE1-CE 4.49Å; Y376-M429 HydrophobicContact CE1-SD 4.04Å; V378-M429 HydrophobicContact CB-CE 4.48Å; V378-M429 HydrophobicContact CG2-CE 3.85Å; F381-M429 HydrophobicContact CB-CE 4.11Å; F381-M429 HydrophobicContact CB-SD 4.47Å; F381-M429 HydrophobicContact CD1-CB 4.4Å; F381-M429 HydrophobicContact CD1-CG 3.9Å; F381-M429 HydrophobicContact CD2-CB 4.26Å; F381-M429 HydrophobicContact CD2-CG 4.23Å; F381-M429 HydrophobicContact CD2-SD 4.25Å; F381-M429 HydrophobicContact CE1-CB 4Å; F381-M429 HydrophobicContact CE1-CG 3.94Å; F381-M429 HydrophobicContact CE2-CB 3.86Å; F381-M429 HydrophobicContact CE2-CG 4.28Å; F381-M429 HydrophobicContact CG-CE 4.27Å; F381-M429 HydrophobicContact CG-CG 4.07Å; F381-M429 HydrophobicContact CG-SD 4.16Å; F381-M429 HydrophobicContact CZ-CB 3.74Å; F381-M429 HydrophobicContact CZ-CG 4.16Å; F381-M429 WeakPolarHBondContact CZ-O 3.47Å; P426-M429 HydrophobicContact CB-CB 4.28Å; P426-M429 HydrophobicContact CB-CG 4.07Å; P426-M429 HydrophobicContact CB-SD 4.04Å; P426-M429 HydrophobicContact CG-SD 3.88Å; P426-M429 PolarHBondContact O-N 3.1Å; P426-M429 VanDerWaalsContact O-N 3.09Å; M429-K433 VanDerWaalsContact O-CB 3.25Å; M429-K433 WeakPolarHBondContact O-CB 3.49Å; M429-K433 PolarHBondContact O-N 2.94Å
430	E	96.3	Very high	92.7	Very high	51 Å²	51	27.2 Å²	27.2	24%	0.238	15%	0.149	C	C	.	.	H	α-helix	trans	-63.7	-44.4	174.5	178.2	166.8	-115.9	0	0	111.9	R262 V425 P426 T427 K433 N434	R262-E430 IonicContact CZ-OE2 2.87Å; R262-E430 IonicContact NE-OE2 3.75Å; R262-E430 VanDerWaalsContact NH2-CD 3.26Å; R262-E430 IonicContact NH2-OE1 3.55Å; R262-E430 PolarHBondContact NH2-OE1 3.15Å; R262-E430 IonicContact NH2-OE2 2.67Å; R262-E430 PolarHBondContact NH2-OE2 3.31Å; V425-E430 HydrophobicContact CG1-CB 3.73Å; V425-E430 HydrophobicContact CG1-CG 4.31Å; P426-E430 PolarHBondContact O-N 3.02Å; T427-E430 PolarHBondContact O-N 3.47Å; E430-K433 PolarHBondContact O-N 3.45Å; E430-N434 WeakPolarHBondContact O-CB 3.23Å; E430-N434 PolarHBondContact O-N 3.29Å; E430-N434 PolarHBondContact O-ND2 3.38Å
431	L	94.9	Very high	90.6	Very high	85 Å²	85	31 Å²	31	45%	0.445	18%	0.18	S	C	.	.	H	α-helix	trans	-60.3	-50.8	176.6	-72.2	170.3	0	0	0	111.9	T247 T427 S428 K433 N434 A435	T247-L431 HydrophobicContact CG2-CB 3.95Å; T427-L431 VanDerWaalsContact O-CG 3.28Å; T427-L431 WeakPolarHBondContact O-CG 3.33Å; T427-L431 PolarHBondContact O-N 3.48Å; S428-L431 PolarHBondContact O-N 3.46Å; L431-K433 VanDerWaalsContact C-N 3.33Å; L431-K433 PolarHBondContact O-N 3.11Å; L431-N434 PolarHBondContact O-N 3.45Å; L431-A435 WeakPolarHBondContact O-CB 3.41Å; L431-A435 PolarHBondContact O-N 3.03Å
432	L	94.1	Very high	88.6	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.2	-41.5	178.9	-73.3	168.7	0	0	0	112.2	F244 T247 V248 T251 F257 F381 I382 L385 S428 A436	F244-L432 HydrophobicContact CZ-CD2 4.48Å; T247-L432 HydrophobicContact CG2-CD2 4Å; T247-L432 HydrophobicContact CG2-CG 4.4Å; V248-L432 HydrophobicContact CB-CD2 4.44Å; V248-L432 HydrophobicContact CG2-CD2 3.74Å; T251-L432 HydrophobicContact CG2-CD1 4.2Å; T251-L432 HydrophobicContact CG2-CD2 4.43Å; T251-L432 HydrophobicContact CG2-CG 4.02Å; F257-L432 HydrophobicContact CE2-CD1 3.95Å; F257-L432 HydrophobicContact CZ-CD1 4.22Å; F381-L432 HydrophobicContact CE1-CB 4.04Å; F381-L432 HydrophobicContact CE1-CD1 3.95Å; F381-L432 HydrophobicContact CZ-CB 4.17Å; I382-L432 HydrophobicContact CD1-CD1 4.29Å; L385-L432 HydrophobicContact CD1-CB 3.88Å; S428-L432 WeakPolarHBondContact O-CB 3.19Å; S428-L432 VanDerWaalsContact O-CG 3.29Å; S428-L432 WeakPolarHBondContact O-CG 3.33Å; S428-L432 PolarHBondContact O-N 3.34Å; L432-A436 WeakPolarHBondContact O-CB 3.27Å; L432-A436 PolarHBondContact O-N 3.37Å
433	K	93.5	Very high	86.5	Confident	49 Å²	49	35.9 Å²	35.9	21%	0.213	21%	0.214	C	C	.	.	H	α-helix	trans	-63.2	-46.2	175.9	175.6	176.8	177.5	159	0	111.8	F381 S394 P395 S397 M429 E430 L431 A436 V437	F381-K433 HydrophobicContact CZ-CB 4.4Å; S394-K433 VanDerWaalsContact OG-CE 3.24Å; S394-K433 WeakPolarHBondContact OG-CE 3.18Å; P395-K433 PolarHBondContact O-NZ 3Å; S397-K433 WeakPolarHBondContact OG-CD 3.48Å; M429-K433 VanDerWaalsContact O-CB 3.25Å; M429-K433 WeakPolarHBondContact O-CB 3.49Å; M429-K433 PolarHBondContact O-N 2.94Å; E430-K433 PolarHBondContact O-N 3.45Å; L431-K433 VanDerWaalsContact C-N 3.33Å; L431-K433 PolarHBondContact O-N 3.11Å; K433-A436 WeakPolarHBondContact O-CB 3.37Å; K433-A436 PolarHBondContact O-N 2.95Å; K433-V437 WeakPolarHBondContact O-CG2 3.1Å; K433-V437 PolarHBondContact O-N 2.99Å
434	N	92.4	Very high	84.3	Confident	74 Å²	74	36.3 Å²	36.3	40%	0.396	22%	0.217	S	C	.	.	H	α-helix	trans	-64.6	-44	-179.9	-69.7	-17.9	0	0	0	110.8	E430 L431 A436 V437 E438	E430-N434 WeakPolarHBondContact O-CB 3.23Å; E430-N434 PolarHBondContact O-N 3.29Å; E430-N434 PolarHBondContact O-ND2 3.38Å; L431-N434 PolarHBondContact O-N 3.45Å; N434-A436 VanDerWaalsContact C-N 3.32Å; N434-A436 PolarHBondContact O-N 3.47Å; N434-V437 PolarHBondContact O-N 3.25Å; N434-V437 VanDerWaalsContact O-N 3.15Å; N434-E438 WeakPolarHBondContact O-CG 3.48Å; N434-E438 PolarHBondContact O-N 2.98Å
435	A	90.1	Very high	82.2	Confident	11 Å²	11	47.3 Å²	47.3	9%	0.091	26%	0.259	C	S	.	.	H	α-helix	trans	-59	-43.2	174	0	0	0	0	0	111.5	F244 T247 L431 V437 E438 C439	F244-A435 HydrophobicContact CD2-CB 3.63Å; F244-A435 HydrophobicContact CE2-CB 4.2Å; T247-A435 HydrophobicContact CG2-CB 4.2Å; L431-A435 WeakPolarHBondContact O-CB 3.41Å; L431-A435 PolarHBondContact O-N 3.03Å; A435-V437 VanDerWaalsContact C-N 3.33Å; A435-V437 PolarHBondContact O-N 3.06Å; A435-E438 PolarHBondContact O-N 3.15Å; A435-C439 PolarHBondContact O-N 2.97Å; A435-C439 PolarHBondContact O-SG 3.23Å
436	A	87.7	Confident	80.6	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.8	-40.3	175.7	0	0	0	0	0	112.7	F244 L385 F388 F389 L432 K433 N434 G440	F244-A436 HydrophobicContact CE2-CB 3.92Å; L385-A436 HydrophobicContact CD2-CB 4.01Å; F388-A436 HydrophobicContact CD1-CB 4.15Å; F388-A436 HydrophobicContact CE1-CB 4.21Å; F389-A436 HydrophobicContact CE1-CB 3.59Å; F389-A436 HydrophobicContact CE2-CB 4.47Å; F389-A436 HydrophobicContact CZ-CB 3.49Å; F389-A436 VanDerWaalsContact CZ-CB 3.49Å; L432-A436 WeakPolarHBondContact O-CB 3.27Å; L432-A436 PolarHBondContact O-N 3.37Å; K433-A436 WeakPolarHBondContact O-CB 3.37Å; K433-A436 PolarHBondContact O-N 2.95Å; N434-A436 VanDerWaalsContact C-N 3.32Å; N434-A436 PolarHBondContact O-N 3.47Å; A436-G440 PolarHBondContact O-N 2.93Å
437	V	87.4	Confident	79.4	Confident	80 Å²	80	53.7 Å²	53.7	49%	0.485	30%	0.299	S	S	.	.	H	α-helix	trans	-66.8	-39.7	176.6	171.4	0	0	0	0	111.3	F388 K433 N434 A435 G440	F388-V437 HydrophobicContact CE1-CG2 4.1Å; F388-V437 HydrophobicContact CZ-CG2 3.97Å; K433-V437 WeakPolarHBondContact O-CG2 3.1Å; K433-V437 PolarHBondContact O-N 2.99Å; N434-V437 PolarHBondContact O-N 3.25Å; N434-V437 VanDerWaalsContact O-N 3.15Å; A435-V437 VanDerWaalsContact C-N 3.33Å; A435-V437 PolarHBondContact O-N 3.06Å; V437-G440 PolarHBondContact O-N 3.44Å
438	E	84.6	Confident	78.4	Confident	132 Å²	132	58.9 Å²	58.9	62%	0.617	32%	0.322	S	S	*	.	H	α-helix	trans	-69.8	-36.2	179.4	-73.5	178.3	-174.9	0	0	113.3	N434 A435 G440	N434-E438 WeakPolarHBondContact O-CG 3.48Å; N434-E438 PolarHBondContact O-N 2.98Å; A435-E438 PolarHBondContact O-N 3.15Å; E438-G440 PolarHBondContact O-N 3.04Å
439	C	77.6	Confident	77.6	Confident	6 Å²	6	58.8 Å²	58.8	4%	0.041	32%	0.321	C	S	.	.	H	α-helix	trans	-62.2	-26.6	170.7	-68.4	0	0	0	0	112.6	Q240 A435 S443	Q240-C439 PolarHBondContact O-SG 3.46Å; A435-C439 PolarHBondContact O-N 2.97Å; A435-C439 PolarHBondContact O-SG 3.23Å; C439-S443 PolarHBondContact O-OG 3.3Å
440	G	67.8	Low	76.8	Confident	28 Å²	28	62.7 Å²	62.7	29%	0.289	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	175	179	0	0	0	0	0	113.8	A436 V437 E438 S442 L444	A436-G440 PolarHBondContact O-N 2.93Å; V437-G440 PolarHBondContact O-N 3.44Å; E438-G440 PolarHBondContact O-N 3.04Å; G440-S442 PolarHBondContact O-N 2.9Å; G440-L444 VanDerWaalsContact O-CD2 3.29Å; G440-L444 WeakPolarHBondContact O-CD2 3.35Å; G440-L444 WeakPolarHBondContact O-CG 3.45Å
441	A	55.7	Low	76.1	Confident	79 Å²	79	64.4 Å²	64.4	65%	0.653	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	14.4	-176.9	0	0	0	0	0	114.5	L444	A441-L444 VanDerWaalsContact CA-CG 3.46Å; A441-L444 HydrophobicContact CB-CD1 3.69Å; A441-L444 HydrophobicContact CB-CG 4.46Å; A441-L444 WeakPolarHBondContact O-CD1 3.47Å
442	S	55.2	Low	75.6	Confident	101 Å²	101	60.9 Å²	60.9	71%	0.706	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114	-33.2	-174	-55.3	0	0	0	0	112.9	G440 L444	G440-S442 PolarHBondContact O-N 2.9Å; S442-L444 PolarHBondContact O-N 3.21Å
443	S	55.9	Low	75.1	Confident	5 Å²	5	61 Å²	61	4%	0.035	33%	0.331	C	S	.	.	S	Bend	trans	-74	-1.7	172.7	-46	0	0	0	0	113.8	D237 C439 R445 S446	D237-S443 WeakPolarHBondContact OD1-CA 3.33Å; D237-S443 VanDerWaalsContact OD1-CB 3.22Å; D237-S443 WeakPolarHBondContact OD1-CB 3.46Å; D237-S443 PolarHBondContact OD1-N 2.91Å; D237-S443 PolarHBondContact OD1-OG 2.75Å; C439-S443 PolarHBondContact O-OG 3.3Å; S443-R445 PolarHBondContact O-N 3.04Å; S443-S446 PolarHBondContact O-N 2.71Å
444	L	51.2	Low	74.8	Confident	34 Å²	34	62.4 Å²	62.4	18%	0.178	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-4.7	-168.7	-59.2	-177.8	0	0	0	117.2	F389 G440 A441 S442	F389-L444 HydrophobicContact CB-CD2 3.68Å; F389-L444 HydrophobicContact CD1-CD2 3.06Å; F389-L444 HydrophobicContact CE1-CD2 3.8Å; F389-L444 HydrophobicContact CG-CD2 3.62Å; F389-L444 WeakPolarHBondContact O-CD1 3.49Å; G440-L444 VanDerWaalsContact O-CD2 3.29Å; G440-L444 WeakPolarHBondContact O-CD2 3.35Å; G440-L444 WeakPolarHBondContact O-CG 3.45Å; A441-L444 VanDerWaalsContact CA-CG 3.46Å; A441-L444 HydrophobicContact CB-CD1 3.69Å; A441-L444 HydrophobicContact CB-CG 4.46Å; A441-L444 WeakPolarHBondContact O-CD1 3.47Å; S442-L444 PolarHBondContact O-N 3.21Å
445	R	54.6	Low	74.5	Confident	230 Å²	230	63.6 Å²	63.6	87%	0.868	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	7.9	177.4	-64.9	-172.8	-179.8	-177.3	0.9	113	S443 V447	S443-R445 PolarHBondContact O-N 3.04Å; R445-V447 PolarHBondContact O-N 2.52Å
446	S	66.3	Low	74.3	Confident	32 Å²	32	63.1 Å²	63.1	22%	0.224	34%	0.337	C	S	.	.			trans	-67.8	107.1	172.5	-174.8	0	0	0	0	109.2	S443 E448 L449 Q450	S443-S446 PolarHBondContact O-N 2.71Å; S446-E448 PolarHBondContact O-N 3.42Å; S446-L449 PolarHBondContact O-N 3.05Å; S446-L449 VanDerWaalsContact O-N 3.11Å; S446-Q450 PolarHBondContact O-N 2.72Å
447	V	71.8	Confident	74.3	Confident	103 Å²	103	64.8 Å²	64.8	62%	0.624	35%	0.346	S	S	*	.	H	α-helix	trans	-53.4	-33.9	174.1	177.4	0	0	0	0	110.7	R445 Q450 M451	R445-V447 PolarHBondContact O-N 2.52Å; V447-Q450 PolarHBondContact O-N 3.47Å; V447-M451 HydrophobicContact CG1-CG 4.13Å; V447-M451 WeakPolarHBondContact O-CB 3.22Å; V447-M451 WeakPolarHBondContact O-CG 3.3Å; V447-M451 PolarHBondContact O-N 2.92Å
448	E	77.3	Confident	74.2	Confident	128 Å²	128	67.9 Å²	67.9	60%	0.598	36%	0.36	S	S	*	.	H	α-helix	trans	-65.4	-40.4	179.5	-166.4	176.1	-171.3	0	0	112.7	L245 S446 M451 S452	L245-E448 HydrophobicContact CD1-CB 4.45Å; L245-E448 HydrophobicContact CD1-CG 3.67Å; L245-E448 HydrophobicContact CD2-CG 4.27Å; S446-E448 PolarHBondContact O-N 3.42Å; E448-M451 PolarHBondContact O-N 3.44Å; E448-S452 WeakPolarHBondContact O-CB 3.22Å; E448-S452 PolarHBondContact O-N 3.23Å
449	L	79.4	Confident	74.1	Confident	7 Å²	7	64.6 Å²	64.6	4%	0.037	35%	0.346	C	S	.	.	H	α-helix	trans	-66.5	-46	176.8	-64.4	176.1	0	0	0	111.2	A241 F244 L245 S446 M451 S452 L453	A241-L449 HydrophobicContact CB-CD1 3.94Å; A241-L449 HydrophobicContact CB-CD2 4.38Å; A241-L449 HydrophobicContact CB-CG 4.32Å; F244-L449 HydrophobicContact CB-CD2 3.88Å; F244-L449 HydrophobicContact CD1-CD2 3.39Å; F244-L449 HydrophobicContact CE1-CD2 4.25Å; F244-L449 HydrophobicContact CG-CD2 3.94Å; L245-L449 HydrophobicContact CD1-CD2 4.4Å; L245-L449 HydrophobicContact CD2-CD2 3.85Å; L245-L449 HydrophobicContact CG-CD2 3.68Å; S446-L449 PolarHBondContact O-N 3.05Å; S446-L449 VanDerWaalsContact O-N 3.11Å; L449-M451 VanDerWaalsContact C-N 3.3Å; L449-M451 PolarHBondContact O-N 2.89Å; L449-S452 PolarHBondContact O-N 3.06Å; L449-L453 WeakPolarHBondContact O-CG 3.17Å; L449-L453 PolarHBondContact O-N 2.74Å; L449-L453 VanDerWaalsContact O-N 3.09Å
450	Q	78.4	Confident	74.3	Confident	81 Å²	81	66.2 Å²	66.2	38%	0.379	35%	0.352	S	S	.	.	H	α-helix	trans	-61	-43.5	178.5	-69	-174.9	-32.2	0	0	110.7	S446 V447 S452 L453 E454	S446-Q450 PolarHBondContact O-N 2.72Å; V447-Q450 PolarHBondContact O-N 3.47Å; Q450-S452 PolarHBondContact O-N 3.22Å; Q450-L453 PolarHBondContact O-N 2.92Å; Q450-E454 WeakPolarHBondContact O-CB 2.99Å; Q450-E454 WeakPolarHBondContact O-CG 3.21Å; Q450-E454 PolarHBondContact O-N 3.18Å
451	M	82.9	Confident	74.6	Confident	87 Å²	87	68.2 Å²	68.2	43%	0.429	36%	0.355	S	S	.	.	H	α-helix	trans	-64	-41.1	177.9	-68.3	-88.8	49.3	0	0	112.8	V447 E448 L449 L453 E454 E455	V447-M451 HydrophobicContact CG1-CG 4.13Å; V447-M451 WeakPolarHBondContact O-CB 3.22Å; V447-M451 WeakPolarHBondContact O-CG 3.3Å; V447-M451 PolarHBondContact O-N 2.92Å; E448-M451 PolarHBondContact O-N 3.44Å; L449-M451 VanDerWaalsContact C-N 3.3Å; L449-M451 PolarHBondContact O-N 2.89Å; M451-L453 PolarHBondContact O-N 3.43Å; M451-E454 HydrophobicContact CE-CB 4.1Å; M451-E454 WeakPolarHBondContact CE-OE2 3.27Å; M451-E454 PolarHBondContact O-N 3.04Å; M451-E455 WeakPolarHBondContact O-CG 3.45Å; M451-E455 PolarHBondContact O-N 3.42Å
452	S	84.1	Confident	75.6	Confident	12 Å²	12	67.6 Å²	67.6	8%	0.084	34%	0.339	C	S	.	.	H	α-helix	trans	-65	-37.5	178	-169.3	0	0	0	0	113	V248 E448 L449 Q450 M456	V248-S452 WeakPolarHBondContact CG1-OG 3.21Å; E448-S452 WeakPolarHBondContact O-CB 3.22Å; E448-S452 PolarHBondContact O-N 3.23Å; L449-S452 PolarHBondContact O-N 3.06Å; Q450-S452 PolarHBondContact O-N 3.22Å; S452-M456 PolarHBondContact O-N 3.49Å; S452-M456 VanDerWaalsContact O-N 3.15Å
453	L	84.1	Confident	76.7	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-71	-38.5	174.4	-64.1	170	0	0	0	112.2	F244 I382 M386 F389 L449 Q450 M451 M456 M457	F244-L453 HydrophobicContact CE1-CD2 3.97Å; F244-L453 HydrophobicContact CE1-CG 4.37Å; F244-L453 HydrophobicContact CZ-CD2 3.95Å; I382-L453 HydrophobicContact CG2-CB 4.33Å; I382-L453 HydrophobicContact CG2-CD2 4.34Å; M386-L453 HydrophobicContact CG-CB 4Å; M386-L453 HydrophobicContact CG-CD1 3.89Å; M386-L453 HydrophobicContact SD-CB 4.32Å; F389-L453 HydrophobicContact CD2-CD1 3.7Å; F389-L453 HydrophobicContact CE2-CD1 3.52Å; L449-L453 WeakPolarHBondContact O-CG 3.17Å; L449-L453 PolarHBondContact O-N 2.74Å; L449-L453 VanDerWaalsContact O-N 3.09Å; Q450-L453 PolarHBondContact O-N 2.92Å; M451-L453 PolarHBondContact O-N 3.43Å; L453-M456 HydrophobicContact CD2-CE 3.39Å; L453-M456 HydrophobicContact CG-CE 4.42Å; L453-M456 WeakPolarHBondContact O-CB 3.47Å; L453-M456 PolarHBondContact O-N 3.05Å; L453-M457 PolarHBondContact O-N 3.35Å
454	E	86.4	Confident	78	Confident	79 Å²	79	69.3 Å²	69.3	37%	0.369	34%	0.335	S	S	.	.	H	α-helix	trans	-62.9	-44	174.7	-76.5	177.5	-167.7	0	0	111.1	M386 Q450 M451 M456 M457 D458	M386-E454 HydrophobicContact CE-CG 3.71Å; Q450-E454 WeakPolarHBondContact O-CB 2.99Å; Q450-E454 WeakPolarHBondContact O-CG 3.21Å; Q450-E454 PolarHBondContact O-N 3.18Å; M451-E454 HydrophobicContact CE-CB 4.1Å; M451-E454 WeakPolarHBondContact CE-OE2 3.27Å; M451-E454 PolarHBondContact O-N 3.04Å; E454-M456 VanDerWaalsContact C-N 3.29Å; E454-M456 PolarHBondContact O-N 3.12Å; E454-M457 HydrophobicContact CG-CE 4.45Å; E454-M457 WeakPolarHBondContact O-CB 2.98Å; E454-M457 PolarHBondContact O-N 2.82Å; E454-D458 PolarHBondContact O-N 3.29Å
455	E	86.7	Confident	79.6	Confident	100 Å²	100	71.5 Å²	71.5	47%	0.467	35%	0.345	S	S	.	.	H	α-helix	trans	-56.3	-42.5	171.8	-75.9	179.6	-165.7	0	0	112	R252 M451 M457 D458 L459	R252-E455 IonicContact NH1-OE2 3.57Å; R252-E455 PolarHBondContact NH1-OE2 3.31Å; M451-E455 WeakPolarHBondContact O-CG 3.45Å; M451-E455 PolarHBondContact O-N 3.42Å; E455-M457 VanDerWaalsContact C-N 3.34Å; E455-M457 PolarHBondContact O-N 3.14Å; E455-D458 PolarHBondContact O-N 3.15Å; E455-L459 VanDerWaalsContact O-CG 3.26Å; E455-L459 WeakPolarHBondContact O-CG 3.29Å; E455-L459 PolarHBondContact O-N 3.18Å; E455-L459 VanDerWaalsContact O-N 3.15Å
456	M	85.3	Confident	81.3	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-64.8	-36.2	175.3	-77.4	-165.1	-67.7	0	0	112.7	V248 I382 S452 L453 E454 D458 L459 Y460	V248-M456 HydrophobicContact CB-CE 4.49Å; V248-M456 HydrophobicContact CG1-CE 3.69Å; V248-M456 HydrophobicContact CG1-CG 4.36Å; V248-M456 HydrophobicContact CG1-SD 3.74Å; V248-M456 HydrophobicContact CG2-CE 4.02Å; I382-M456 HydrophobicContact CD1-CE 3.75Å; I382-M456 HydrophobicContact CD1-SD 4.04Å; I382-M456 HydrophobicContact CG1-CB 4.43Å; I382-M456 HydrophobicContact CG2-CB 4.29Å; I382-M456 HydrophobicContact CG2-CE 4.45Å; S452-M456 PolarHBondContact O-N 3.49Å; S452-M456 VanDerWaalsContact O-N 3.15Å; L453-M456 HydrophobicContact CD2-CE 3.39Å; L453-M456 HydrophobicContact CG-CE 4.42Å; L453-M456 WeakPolarHBondContact O-CB 3.47Å; L453-M456 PolarHBondContact O-N 3.05Å; E454-M456 VanDerWaalsContact C-N 3.29Å; E454-M456 PolarHBondContact O-N 3.12Å; M456-D458 VanDerWaalsContact C-N 3.32Å; M456-L459 PolarHBondContact O-N 2.91Å; M456-Y460 HydrophobicContact CB-CD2 4.12Å; M456-Y460 HydrophobicContact CB-CE2 3.87Å; M456-Y460 HydrophobicContact CG-CE2 3.98Å; M456-Y460 WeakPolarHBondContact O-CD2 3.11Å; M456-Y460 PolarHBondContact O-N 3.24Å; M456-Y460 HydrophobicContact SD-CE2 4.16Å
457	M	88.1	Confident	82.4	Confident	36 Å²	36	63 Å²	63	18%	0.177	32%	0.317	C	S	.	.	H	α-helix	trans	-67.5	-33.7	175.3	-71.9	-156.4	-49.8	0	0	112.9	I382 R383 M386 L453 E454 E455 L459	I382-M457 HydrophobicContact CB-CG 4.31Å; I382-M457 HydrophobicContact CG2-CG 3.66Å; R383-M457 HydrophobicContact CB-SD 4.4Å; R383-M457 PolarHBondContact NE-SD 3.2Å; R383-M457 PolarHBondContact NH2-SD 3.33Å; M386-M457 HydrophobicContact CE-CE 3.99Å; M386-M457 HydrophobicContact SD-CE 3.69Å; M386-M457 HydrophobicContact SD-CG 4.11Å; M386-M457 HydrophobicContact SD-SD 3.5Å; L453-M457 PolarHBondContact O-N 3.35Å; E454-M457 HydrophobicContact CG-CE 4.45Å; E454-M457 WeakPolarHBondContact O-CB 2.98Å; E454-M457 PolarHBondContact O-N 2.82Å; E455-M457 VanDerWaalsContact C-N 3.34Å; E455-M457 PolarHBondContact O-N 3.14Å; M457-L459 VanDerWaalsContact C-N 3.28Å
458	D	85.8	Confident	83.2	Confident	145 Å²	145	59.9 Å²	59.9	78%	0.775	29%	0.293	S	S	*	.	H	α-helix	trans	-73.5	-24	178.2	-72.9	-18.9	0	0	0	112.1	E454 E455 M456	E454-D458 PolarHBondContact O-N 3.29Å; E455-D458 PolarHBondContact O-N 3.15Å; M456-D458 VanDerWaalsContact C-N 3.32Å
459	L	82.4	Confident	83.7	Confident	63 Å²	63	54.3 Å²	54.3	33%	0.33	27%	0.267	S	S	.	.	H	α-helix	trans	-83.7	-26.7	178.4	-71.1	169.7	0	0	0	114.1	R252 E455 M456 M457	R252-L459 VanDerWaalsContact CZ-CD1 3.48Å; E455-L459 VanDerWaalsContact O-CG 3.26Å; E455-L459 WeakPolarHBondContact O-CG 3.29Å; E455-L459 PolarHBondContact O-N 3.18Å; E455-L459 VanDerWaalsContact O-N 3.15Å; M456-L459 PolarHBondContact O-N 2.91Å; M457-L459 VanDerWaalsContact C-N 3.28Å
460	Y	80.6	Confident	84.1	Confident	40 Å²	40	58.5 Å²	58.5	16%	0.157	29%	0.288	C	S	.	.			trans	-114.9	0	-164.9	-60.2	-38.6	0	0	0	117	D255 F257 H339 V378 M456	D255-Y460 VanDerWaalsContact O-CE1 3.32Å; D255-Y460 WeakPolarHBondContact O-CE1 3.4Å; F257-Y460 HydrophobicContact CB-CE1 3.95Å; F257-Y460 HydrophobicContact CB-CE2 4.41Å; F257-Y460 AromaticContact CD2-CE2 3.95Å; F257-Y460 HydrophobicContact CD2-CE2 3.95Å; F257-Y460 AromaticContact CD2-CZ 3.99Å; H339-Y460 HydrophobicContact CB-CD1 4.32Å; H339-Y460 HydrophobicContact CB-CG 4.39Å; H339-Y460 WeakPolarHBondContact CB-OXT 2.87Å; H339-Y460 PolarHBondContact CD2-OXT 3.25Å; H339-Y460 AromaticContact CE1-CD1 3.65Å; H339-Y460 AromaticContact CG-CD1 3.59Å; H339-Y460 AromaticContact ND1-CD1 3.28Å; H339-Y460 VanDerWaalsContact ND1-CD1 3.28Å; H339-Y460 WeakPolarHBondContact ND1-CD1 3.38Å; H339-Y460 AromaticContact ND1-CE1 3.84Å; V378-Y460 HydrophobicContact CG1-CD2 3.6Å; V378-Y460 HydrophobicContact CG1-CE2 4Å; V378-Y460 HydrophobicContact CG1-CG 4.14Å; M456-Y460 HydrophobicContact CB-CD2 4.12Å; M456-Y460 HydrophobicContact CB-CE2 3.87Å; M456-Y460 HydrophobicContact CG-CE2 3.98Å; M456-Y460 WeakPolarHBondContact O-CD2 3.11Å; M456-Y460 PolarHBondContact O-N 3.24Å; M456-Y460 HydrophobicContact SD-CE2 4.16Å

Retrieved 460 of 460 residues in 134.4 ms (Link to these results)

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