A0A077ZE62_TRITR Loading...

EMP24 GP25L domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZE62, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 217 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	65.9	Low	83.9	Confident	196 Å²	196	117.4 Å²	117.4	97%	0.966	63%	0.628	S	S	*	*				0	-47	0	-109.9	176.7	-115.7	0	0	112.7	A3 R4 N5	M1-A3 PolarHBondContact O-N 3.09Å; M1-R4 PolarHBondContact O-N 2.9Å; M1-N5 PolarHBondContact O-N 2.92Å
2	A	78.5	Confident	84.1	Confident	82 Å²	82	117.8 Å²	117.8	68%	0.678	62%	0.621	S	S	*	*	H	α-helix	trans	-56.6	-44.6	-178.2	0	0	0	0	0	115.4	R4 N5 L6	A2-R4 VanDerWaalsContact C-N 3.31Å; A2-R4 PolarHBondContact O-N 3.38Å; A2-N5 PolarHBondContact O-N 3Å; A2-N5 VanDerWaalsContact O-N 3.17Å; A2-L6 PolarHBondContact O-N 3.32Å
3	A	82	Confident	84.2	Confident	82 Å²	82	116.2 Å²	116.2	68%	0.678	61%	0.611	S	S	*	*	H	α-helix	trans	-62.5	-34.7	-179.3	0	0	0	0	0	113.6	M1 L6 L7	M1-A3 PolarHBondContact O-N 3.09Å; A3-L6 PolarHBondContact O-N 3.25Å; A3-L7 PolarHBondContact O-N 2.99Å
4	R	85.9	Confident	84.3	Confident	176 Å²	176	114.9 Å²	114.9	66%	0.664	61%	0.61	S	S	*	*	H	α-helix	trans	-67.9	-38.4	176.7	-166.9	176.9	74	-176.8	5.1	111.3	M1 A2 M8	M1-R4 PolarHBondContact O-N 2.9Å; A2-R4 VanDerWaalsContact C-N 3.31Å; A2-R4 PolarHBondContact O-N 3.38Å; R4-M8 WeakPolarHBondContact O-CG 3.22Å; R4-M8 PolarHBondContact O-N 3.12Å
5	N	83.8	Confident	84.2	Confident	104 Å²	104	111.4 Å²	111.4	56%	0.556	60%	0.598	S	S	*	*	H	α-helix	trans	-69.4	-37.5	177	-68.6	4.9	0	0	0	111.7	M1 A2 M8 L9	M1-N5 PolarHBondContact O-N 2.92Å; A2-N5 PolarHBondContact O-N 3Å; A2-N5 VanDerWaalsContact O-N 3.17Å; N5-M8 PolarHBondContact O-N 3.32Å; N5-L9 WeakPolarHBondContact O-CB 3.34Å; N5-L9 PolarHBondContact O-N 3.06Å
6	L	87.5	Confident	83.9	Confident	111 Å²	111	112.8 Å²	112.8	58%	0.581	60%	0.598	S	S	*	*	H	α-helix	trans	-65.4	-42.2	175.3	-163.6	82.4	0	0	0	111.8	A2 A3 L9 L10	A2-L6 PolarHBondContact O-N 3.32Å; A3-L6 PolarHBondContact O-N 3.25Å; L6-L9 PolarHBondContact O-N 2.95Å; L6-L10 HydrophobicContact CG-CD1 4.44Å; L6-L10 PolarHBondContact O-N 3.25Å
7	L	88.9	Confident	83.6	Confident	107 Å²	107	110.1 Å²	110.1	56%	0.56	60%	0.595	S	S	*	*	H	α-helix	trans	-63.1	-42.6	175.7	-169.1	79.7	0	0	0	111.6	A3 L9 L10 L11	A3-L7 PolarHBondContact O-N 2.99Å; L7-L9 VanDerWaalsContact C-N 3.34Å; L7-L10 PolarHBondContact O-N 2.94Å; L7-L11 HydrophobicContact CG-CD1 4.3Å; L7-L11 WeakPolarHBondContact O-CB 3.31Å; L7-L11 WeakPolarHBondContact O-CG 3.45Å; L7-L11 PolarHBondContact O-N 3.34Å
8	M	87.5	Confident	83.1	Confident	128 Å²	128	108.7 Å²	108.7	63%	0.631	60%	0.595	S	S	*	*	H	α-helix	trans	-63.4	-39.6	176	-69.3	-79.9	-81.5	0	0	111.7	R4 N5 F12	R4-M8 WeakPolarHBondContact O-CG 3.22Å; R4-M8 PolarHBondContact O-N 3.12Å; N5-M8 PolarHBondContact O-N 3.32Å; M8-F12 WeakPolarHBondContact O-CB 3.25Å; M8-F12 PolarHBondContact O-N 3.23Å
9	L	87.8	Confident	82.3	Confident	101 Å²	101	109.7 Å²	109.7	53%	0.529	60%	0.595	S	S	.	*	H	α-helix	trans	-65.8	-43.3	176	-166.2	89.3	0	0	0	112	N5 L6 L7 F12 I13	N5-L9 WeakPolarHBondContact O-CB 3.34Å; N5-L9 PolarHBondContact O-N 3.06Å; L6-L9 PolarHBondContact O-N 2.95Å; L7-L9 VanDerWaalsContact C-N 3.34Å; L9-F12 WeakPolarHBondContact O-CB 3.39Å; L9-F12 PolarHBondContact O-N 3.46Å; L9-I13 HydrophobicContact CD2-CD1 4.36Å; L9-I13 HydrophobicContact CG-CD1 4.3Å; L9-I13 WeakPolarHBondContact O-CG1 3.38Å; L9-I13 PolarHBondContact O-N 3.48Å
10	L	88.3	Confident	81.8	Confident	95 Å²	95	110.7 Å²	110.7	50%	0.497	60%	0.604	S	S	.	*	H	α-helix	trans	-62.8	-44	176.2	-85.6	158.4	0	0	0	111.8	L6 L7 F12 I13 V14	L6-L10 HydrophobicContact CG-CD1 4.44Å; L6-L10 PolarHBondContact O-N 3.25Å; L7-L10 PolarHBondContact O-N 2.94Å; L10-F12 VanDerWaalsContact C-N 3.29Å; L10-F12 PolarHBondContact O-N 2.86Å; L10-I13 PolarHBondContact O-N 2.92Å; L10-V14 VanDerWaalsContact O-CG2 3.3Å; L10-V14 WeakPolarHBondContact O-CG2 3.32Å; L10-V14 PolarHBondContact O-N 3.27Å
11	L	87.4	Confident	80.8	Confident	109 Å²	109	113.2 Å²	113.2	57%	0.571	61%	0.61	S	S	*	*	H	α-helix	trans	-61.6	-39.2	175.1	-76.3	166.6	0	0	0	111.6	L7 S15	L7-L11 HydrophobicContact CG-CD1 4.3Å; L7-L11 WeakPolarHBondContact O-CB 3.31Å; L7-L11 WeakPolarHBondContact O-CG 3.45Å; L7-L11 PolarHBondContact O-N 3.34Å; L11-S15 WeakPolarHBondContact O-CB 3.43Å; L11-S15 PolarHBondContact O-N 3.26Å; L11-S15 PolarHBondContact O-OG 3.49Å
12	F	85.7	Confident	81.1	Confident	123 Å²	123	107.2 Å²	107.2	54%	0.539	59%	0.592	S	S	.	*	H	α-helix	trans	-62.7	-49.3	174.7	-167.2	-98.4	0	0	0	111.2	M8 L9 L10 V14 S15 F16	M8-F12 WeakPolarHBondContact O-CB 3.25Å; M8-F12 PolarHBondContact O-N 3.23Å; L9-F12 WeakPolarHBondContact O-CB 3.39Å; L9-F12 PolarHBondContact O-N 3.46Å; L10-F12 VanDerWaalsContact C-N 3.29Å; L10-F12 PolarHBondContact O-N 2.86Å; F12-V14 PolarHBondContact O-N 3.48Å; F12-S15 WeakPolarHBondContact CA-OG 3.36Å; F12-S15 PolarHBondContact O-N 2.95Å; F12-S15 PolarHBondContact O-OG 3.28Å; F12-F16 AromaticContact CD1-CD2 3.97Å; F12-F16 HydrophobicContact CD1-CD2 3.97Å; F12-F16 HydrophobicContact CD1-CE2 4.02Å; F12-F16 HydrophobicContact CD2-CD2 4.5Å; F12-F16 HydrophobicContact CD2-CE2 4.08Å; F12-F16 AromaticContact CE1-CD2 3.76Å; F12-F16 HydrophobicContact CE1-CD2 3.76Å; F12-F16 AromaticContact CE1-CE2 3.44Å; F12-F16 HydrophobicContact CE1-CE2 3.44Å; F12-F16 VanDerWaalsContact CE1-CE2 3.44Å; F12-F16 HydrophobicContact CE1-CZ 4.21Å; F12-F16 HydrophobicContact CE2-CD2 4.33Å; F12-F16 AromaticContact CE2-CE2 3.52Å; F12-F16 HydrophobicContact CE2-CE2 3.52Å; F12-F16 HydrophobicContact CE2-CZ 4.36Å; F12-F16 HydrophobicContact CG-CD2 4.35Å; F12-F16 HydrophobicContact CG-CE2 4.32Å; F12-F16 AromaticContact CZ-CD2 3.97Å; F12-F16 HydrophobicContact CZ-CD2 3.97Å; F12-F16 AromaticContact CZ-CE2 3.17Å; F12-F16 HydrophobicContact CZ-CE2 3.17Å; F12-F16 AromaticContact CZ-CZ 3.8Å; F12-F16 HydrophobicContact CZ-CZ 3.8Å; F12-F16 WeakPolarHBondContact O-CD2 3.44Å; F12-F16 PolarHBondContact O-N 3.5Å; F12-F16 VanDerWaalsContact O-N 3.13Å
13	I	85.8	Confident	81.1	Confident	97 Å²	97	109 Å²	109	50%	0.497	59%	0.589	S	S	.	*	H	α-helix	trans	-60.9	-43.4	178.4	-65.8	165.9	0	0	0	111.5	L9 L10 S15 F16 A17	L9-I13 HydrophobicContact CD2-CD1 4.36Å; L9-I13 HydrophobicContact CG-CD1 4.3Å; L9-I13 WeakPolarHBondContact O-CG1 3.38Å; L9-I13 PolarHBondContact O-N 3.48Å; L10-I13 PolarHBondContact O-N 2.92Å; I13-S15 VanDerWaalsContact C-N 3.31Å; I13-S15 PolarHBondContact O-N 3.23Å; I13-F16 PolarHBondContact O-N 3Å; I13-A17 WeakPolarHBondContact O-CB 3.34Å; I13-A17 PolarHBondContact O-N 2.91Å
14	V	85.8	Confident	81.4	Confident	97 Å²	97	109.1 Å²	109.1	59%	0.588	57%	0.574	S	S	*	*	H	α-helix	trans	-63.6	-37.8	178	174.2	0	0	0	0	111.3	L10 F12 F16 A17 S18	L10-V14 VanDerWaalsContact O-CG2 3.3Å; L10-V14 WeakPolarHBondContact O-CG2 3.32Å; L10-V14 PolarHBondContact O-N 3.27Å; F12-V14 PolarHBondContact O-N 3.48Å; V14-F16 VanDerWaalsContact C-N 3.32Å; V14-F16 PolarHBondContact O-N 3.2Å; V14-A17 PolarHBondContact O-N 3.5Å; V14-S18 PolarHBondContact O-N 2.88Å
15	S	82.7	Confident	81.6	Confident	63 Å²	63	102 Å²	102	44%	0.441	55%	0.548	S	S	.	.	H	α-helix	trans	-67	-29.2	176.6	68	0	0	0	0	114	L11 F12 I13 S18	L11-S15 WeakPolarHBondContact O-CB 3.43Å; L11-S15 PolarHBondContact O-N 3.26Å; L11-S15 PolarHBondContact O-OG 3.49Å; F12-S15 WeakPolarHBondContact CA-OG 3.36Å; F12-S15 PolarHBondContact O-N 2.95Å; F12-S15 PolarHBondContact O-OG 3.28Å; I13-S15 VanDerWaalsContact C-N 3.31Å; I13-S15 PolarHBondContact O-N 3.23Å; S15-S18 PolarHBondContact O-OG 3.07Å
16	F	79.5	Confident	81.9	Confident	134 Å²	134	100.7 Å²	100.7	59%	0.588	54%	0.541	S	S	*	.	H	α-helix	trans	-83.3	-30	173.8	-85.2	-92.7	0	0	0	112.5	F12 I13 V14 S18 E19	F12-F16 AromaticContact CD1-CD2 3.97Å; F12-F16 HydrophobicContact CD1-CD2 3.97Å; F12-F16 HydrophobicContact CD1-CE2 4.02Å; F12-F16 HydrophobicContact CD2-CD2 4.5Å; F12-F16 HydrophobicContact CD2-CE2 4.08Å; F12-F16 AromaticContact CE1-CD2 3.76Å; F12-F16 HydrophobicContact CE1-CD2 3.76Å; F12-F16 AromaticContact CE1-CE2 3.44Å; F12-F16 HydrophobicContact CE1-CE2 3.44Å; F12-F16 VanDerWaalsContact CE1-CE2 3.44Å; F12-F16 HydrophobicContact CE1-CZ 4.21Å; F12-F16 HydrophobicContact CE2-CD2 4.33Å; F12-F16 AromaticContact CE2-CE2 3.52Å; F12-F16 HydrophobicContact CE2-CE2 3.52Å; F12-F16 HydrophobicContact CE2-CZ 4.36Å; F12-F16 HydrophobicContact CG-CD2 4.35Å; F12-F16 HydrophobicContact CG-CE2 4.32Å; F12-F16 AromaticContact CZ-CD2 3.97Å; F12-F16 HydrophobicContact CZ-CD2 3.97Å; F12-F16 AromaticContact CZ-CE2 3.17Å; F12-F16 HydrophobicContact CZ-CE2 3.17Å; F12-F16 AromaticContact CZ-CZ 3.8Å; F12-F16 HydrophobicContact CZ-CZ 3.8Å; F12-F16 WeakPolarHBondContact O-CD2 3.44Å; F12-F16 PolarHBondContact O-N 3.5Å; F12-F16 VanDerWaalsContact O-N 3.13Å; I13-F16 PolarHBondContact O-N 3Å; V14-F16 VanDerWaalsContact C-N 3.32Å; V14-F16 PolarHBondContact O-N 3.2Å; F16-S18 PolarHBondContact O-N 2.9Å; F16-E19 PolarHBondContact O-N 3.29Å
17	A	78.1	Confident	82	Confident	66 Å²	66	95.4 Å²	95.4	55%	0.545	51%	0.513	S	S	.	.	H	α-helix	trans	-68.7	-22.4	178.5	0	0	0	0	0	113.2	I13 V14 E19	I13-A17 WeakPolarHBondContact O-CB 3.34Å; I13-A17 PolarHBondContact O-N 2.91Å; V14-A17 PolarHBondContact O-N 3.5Å; A17-E19 VanDerWaalsContact C-N 3.27Å; A17-E19 PolarHBondContact O-N 3.5Å
18	S	74	Confident	81.8	Confident	86 Å²	86	91.1 Å²	91.1	60%	0.601	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-9.3	179.6	48.2	0	0	0	0	114.9	V14 S15 F16	V14-S18 PolarHBondContact O-N 2.88Å; S15-S18 PolarHBondContact O-OG 3.07Å; F16-S18 PolarHBondContact O-N 2.9Å
19	E	69.2	Low	81.5	Confident	127 Å²	127	88.2 Å²	88.2	59%	0.593	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	23.7	-171.4	-64.6	-68.8	159.7	0	0	113.6	F16 A17 F21	F16-E19 PolarHBondContact O-N 3.29Å; A17-E19 VanDerWaalsContact C-N 3.27Å; A17-E19 PolarHBondContact O-N 3.5Å; E19-F21 PolarHBondContact O-N 3.22Å; E19-F21 WeakPolarHBondContact OE2-CE2 3.34Å
20	V	70.8	Confident	81.1	Confident	129 Å²	129	88.3 Å²	88.3	78%	0.782	48%	0.484	S	S	*	.			trans	-78.8	91.2	175.3	-173.5	0	0	0	0	109.8
21	F	62.6	Low	81.1	Confident	165 Å²	165	87.3 Å²	87.3	72%	0.724	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-85	121.3	170.4	-79.6	-84.7	0	0	0	110.8	E19	E19-F21 PolarHBondContact O-N 3.22Å; E19-F21 WeakPolarHBondContact OE2-CE2 3.34Å
22	A	70.8	Confident	81.3	Confident	70 Å²	70	87.3 Å²	87.3	58%	0.579	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-75.3	143.9	165.1	0	0	0	0	0	110	F24	A22-F24 PolarHBondContact O-N 2.97Å
23	L	79.1	Confident	81.7	Confident	119 Å²	119	84.6 Å²	84.6	62%	0.623	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-73.6	119.5	177.1	-171.5	148.6	0	0	0	109.7	F25	L23-F25 HydrophobicContact CD2-CD1 4.48Å
24	F	87.8	Confident	82.1	Confident	84 Å²	84	82.8 Å²	82.8	37%	0.368	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	155.2	168.9	68.3	-86.8	0	0	0	108.6	A22 R120 V121 D122	A22-F24 PolarHBondContact O-N 2.97Å; F24-R120 HydrophobicContact CB-CG 4.14Å; F24-R120 HydrophobicContact CD2-CG 3.93Å; F24-R120 VanDerWaalsContact CE1-NH1 3.34Å; F24-R120 HydrophobicContact CG-CG 4.31Å; F24-R120 VanDerWaalsContact CZ-NH1 3.34Å; F24-V121 WeakPolarHBondContact CA-O 3.5Å; F24-D122 WeakPolarHBondContact CB-OD1 3.37Å
25	F	90.4	Very high	82.5	Confident	26 Å²	26	80.9 Å²	80.9	11%	0.114	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	159.2	174.5	61.6	-82.4	0	0	0	110.5	L23 I27 K33 F35 V121 L123	L23-F25 HydrophobicContact CD2-CD1 4.48Å; F25-I27 HydrophobicContact CD2-CD1 4.17Å; F25-I27 HydrophobicContact CD2-CG1 3.64Å; F25-I27 HydrophobicContact CE2-CD1 3.39Å; F25-I27 HydrophobicContact CE2-CG1 3.4Å; F25-I27 VanDerWaalsContact CE2-CG1 3.4Å; F25-I27 HydrophobicContact CZ-CD1 4.15Å; F25-K33 HydrophobicContact CD2-CB 4.12Å; F25-K33 HydrophobicContact CD2-CG 3.85Å; F25-K33 HydrophobicContact CE2-CB 3.66Å; F25-K33 HydrophobicContact CE2-CG 3.8Å; F25-F35 HydrophobicContact CD1-CE2 4.26Å; F25-F35 AromaticContact CD1-CZ 3.67Å; F25-F35 HydrophobicContact CD1-CZ 3.67Å; F25-F35 HydrophobicContact CD2-CZ 4.43Å; F25-F35 AromaticContact CE1-CE2 3.68Å; F25-F35 HydrophobicContact CE1-CE2 3.68Å; F25-F35 AromaticContact CE1-CZ 3.54Å; F25-F35 HydrophobicContact CE1-CZ 3.54Å; F25-F35 HydrophobicContact CE2-CE2 4.13Å; F25-F35 HydrophobicContact CE2-CZ 4.28Å; F25-F35 HydrophobicContact CG-CZ 4.12Å; F25-F35 AromaticContact CZ-CE2 3.6Å; F25-F35 HydrophobicContact CZ-CE2 3.6Å; F25-F35 AromaticContact CZ-CZ 3.87Å; F25-F35 HydrophobicContact CZ-CZ 3.87Å; F25-V121 HydrophobicContact CD1-CB 4.39Å; F25-V121 WeakPolarHBondContact CD1-O 3.3Å; F25-V121 HydrophobicContact CD2-CB 4.4Å; F25-V121 HydrophobicContact CE1-CB 3.91Å; F25-V121 HydrophobicContact CE1-CG1 3.82Å; F25-V121 HydrophobicContact CE2-CB 3.97Å; F25-V121 HydrophobicContact CE2-CG1 4.32Å; F25-V121 HydrophobicContact CE2-CG2 4.48Å; F25-V121 HydrophobicContact CZ-CB 3.68Å; F25-V121 HydrophobicContact CZ-CG1 3.59Å; F25-V121 PolarHBondContact N-O 3.48Å; F25-V121 PolarHBondContact O-N 2.84Å; F25-L123 HydrophobicContact CE1-CB 3.76Å; F25-L123 HydrophobicContact CE1-CD2 4.28Å
26	L	89.4	Confident	83.1	Confident	78 Å²	78	81.8 Å²	81.8	41%	0.408	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	134.8	178.7	-62.6	173.8	0	0	0	109.4	K33 M118 L119 R120	L26-K33 VanDerWaalsContact O-CE 3.22Å; L26-K33 WeakPolarHBondContact O-CE 3.36Å; L26-M118 HydrophobicContact CB-CB 4.17Å; L26-M118 HydrophobicContact CB-SD 3.98Å; L26-M118 HydrophobicContact CD1-SD 3.83Å; L26-M118 HydrophobicContact CD2-CB 4.23Å; L26-M118 HydrophobicContact CG-SD 4.47Å; L26-L119 CarbonylContact C-O 3.57Å; L26-L119 WeakPolarHBondContact CA-O 3.26Å; L26-R120 HydrophobicContact CD2-CB 4.02Å
27	I	89.6	Confident	83.8	Confident	0 Å²	0	79.1 Å²	79.1	0%	0	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	123.8	174.9	-50.3	-175.4	0	0	0	108.3	F25 E31 K33 M69 L119 V121	F25-I27 HydrophobicContact CD2-CD1 4.17Å; F25-I27 HydrophobicContact CD2-CG1 3.64Å; F25-I27 HydrophobicContact CE2-CD1 3.39Å; F25-I27 HydrophobicContact CE2-CG1 3.4Å; F25-I27 VanDerWaalsContact CE2-CG1 3.4Å; F25-I27 HydrophobicContact CZ-CD1 4.15Å; I27-E31 HydrophobicContact CG2-CB 4Å; I27-E31 VanDerWaalsContact CG2-O 3.28Å; I27-E31 WeakPolarHBondContact CG2-O 3.48Å; I27-K33 HydrophobicContact CD1-CG 4.4Å; I27-K33 HydrophobicContact CG1-CG 3.92Å; I27-M69 HydrophobicContact CD1-CE 3.93Å; I27-M69 HydrophobicContact CD1-SD 4.27Å; I27-L119 PolarHBondContact N-O 3.45Å; I27-L119 PolarHBondContact O-N 3.22Å; I27-V121 HydrophobicContact CD1-CB 4.21Å; I27-V121 HydrophobicContact CD1-CG2 3.47Å; I27-V121 VanDerWaalsContact CD1-CG2 3.47Å; I27-V121 HydrophobicContact CG1-CG2 3.84Å
28	G	85.2	Confident	84.4	Confident	17 Å²	17	79.5 Å²	79.5	18%	0.175	42%	0.42	C	S	.	.			trans	-79.2	175.6	169.9	0	0	0	0	0	113.2	T30 E31 W113	G28-T30 PolarHBondContact O-N 3.41Å; G28-E31 PolarHBondContact N-OE2 2.95Å; G28-E31 WeakPolarHBondContact O-CB 3.49Å; G28-E31 PolarHBondContact O-N 2.97Å; G28-W113 VanDerWaalsContact C-CZ2 3.49Å; G28-W113 WeakPolarHBondContact O-CZ2 3.34Å
29	E	81.4	Confident	85.3	Confident	67 Å²	67	75.5 Å²	75.5	31%	0.313	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	133.3	-179.7	-10.6	-164.4	130.3	0	0	109.7	E31 W113 S115	E29-E31 PolarHBondContact O-N 3.44Å; E29-W113 HydrophobicContact CB-CZ2 4.26Å; E29-W113 PolarHBondContact OE1-NE1 3.04Å; E29-S115 VanDerWaalsContact OE1-CA 3.32Å; E29-S115 WeakPolarHBondContact OE1-CA 3.42Å
30	T	79.7	Confident	86.4	Confident	102 Å²	102	69.7 Å²	69.7	63%	0.626	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	8.9	-176.6	67.4	0	0	0	0	115.4	G28	G28-T30 PolarHBondContact O-N 3.41Å
31	E	88.3	Confident	87.3	Confident	74 Å²	74	66.4 Å²	66.4	35%	0.346	34%	0.343	S	S	.	.			trans	-76.9	133.1	178.7	-169.8	-179.8	-167.7	0	0	110.4	I27 G28 E29 K33	I27-E31 HydrophobicContact CG2-CB 4Å; I27-E31 VanDerWaalsContact CG2-O 3.28Å; I27-E31 WeakPolarHBondContact CG2-O 3.48Å; G28-E31 PolarHBondContact N-OE2 2.95Å; G28-E31 WeakPolarHBondContact O-CB 3.49Å; G28-E31 PolarHBondContact O-N 2.97Å; E29-E31 PolarHBondContact O-N 3.44Å; E31-K33 VanDerWaalsContact CD-CE 3.45Å; E31-K33 HydrophobicContact CG-CD 4.43Å; E31-K33 WeakPolarHBondContact OE1-CE 3.3Å; E31-K33 IonicContact OE1-NZ 3.57Å; E31-K33 PolarHBondContact OE1-NZ 3.16Å; E31-K33 IonicContact OE2-NZ 3.4Å
32	R	91.4	Very high	88.7	Confident	110 Å²	110	64.8 Å²	64.8	42%	0.415	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	117.6	175.4	-179.3	173.3	173.1	154.4	1.2	109.8	C34 E72 C105 F107	R32-C34 PolarHBondContact NE-SG 3.11Å; R32-E72 IonicContact CZ-OE1 2.74Å; R32-E72 IonicContact NH1-OE1 3.95Å; R32-E72 PolarHBondContact NH1-OE1 3.28Å; R32-E72 VanDerWaalsContact NH1-OE1 3.09Å; R32-E72 IonicContact NH2-OE1 3.12Å; R32-E72 PolarHBondContact NH2-OE1 3.21Å; R32-C105 HydrophobicContact CG-CB 4.17Å; R32-C105 PolarHBondContact NE-SG 2.81Å; R32-C105 PolarHBondContact NH2-SG 2.82Å; R32-F107 HydrophobicContact CB-CB 3.93Å; R32-F107 HydrophobicContact CG-CB 4.14Å; R32-F107 HydrophobicContact CG-CD1 4.01Å; R32-F107 HydrophobicContact CG-CG 4.38Å
33	K	94.2	Very high	89.7	Confident	65 Å²	65	61.5 Å²	61.5	28%	0.283	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	128.6	173.2	-64.9	-60.8	-161.3	-172.2	0	109.2	F25 L26 I27 E31 C105 L106	F25-K33 HydrophobicContact CD2-CB 4.12Å; F25-K33 HydrophobicContact CD2-CG 3.85Å; F25-K33 HydrophobicContact CE2-CB 3.66Å; F25-K33 HydrophobicContact CE2-CG 3.8Å; L26-K33 VanDerWaalsContact O-CE 3.22Å; L26-K33 WeakPolarHBondContact O-CE 3.36Å; I27-K33 HydrophobicContact CD1-CG 4.4Å; I27-K33 HydrophobicContact CG1-CG 3.92Å; E31-K33 VanDerWaalsContact CD-CE 3.45Å; E31-K33 HydrophobicContact CG-CD 4.43Å; E31-K33 WeakPolarHBondContact OE1-CE 3.3Å; E31-K33 IonicContact OE1-NZ 3.57Å; E31-K33 PolarHBondContact OE1-NZ 3.16Å; E31-K33 IonicContact OE2-NZ 3.4Å; K33-C105 CarbonylContact O-C 3.51Å; K33-C105 VanDerWaalsContact O-CA 3.3Å; K33-C105 WeakPolarHBondContact O-CA 3.38Å; K33-L106 PolarHBondContact N-O 2.9Å; K33-L106 PolarHBondContact O-N 2.85Å
34	C	95	Very high	90.3	Very high	60 Å²	60	59.8 Å²	59.8	41%	0.405	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	140.3	-177.7	-62.3	0	0	0	0	110.5	R32 T103 I104 C105	R32-C34 PolarHBondContact NE-SG 3.11Å; C34-T103 HydrophobicContact CB-CG2 3.71Å; C34-I104 CarbonylContact C-O 3.56Å; C34-I104 WeakPolarHBondContact CA-O 3.45Å; C34-C105 HydrophobicContact CB-CB 4.16Å; C34-C105 WeakPolarHBondContact CB-SG 3.49Å; C34-C105 WeakPolarHBondContact SG-CB 3.37Å; C34-C105 CovalentContact SG-SG 2.04Å; C34-C105 PolarHBondContact SG-SG 2.91Å
35	F	94.3	Very high	90.7	Very high	57 Å²	57	55.8 Å²	55.8	25%	0.25	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	127.3	175.7	-62.1	-90.7	0	0	0	107.8	F25 T103 I104 L106 L123	F25-F35 HydrophobicContact CD1-CE2 4.26Å; F25-F35 AromaticContact CD1-CZ 3.67Å; F25-F35 HydrophobicContact CD1-CZ 3.67Å; F25-F35 HydrophobicContact CD2-CZ 4.43Å; F25-F35 AromaticContact CE1-CE2 3.68Å; F25-F35 HydrophobicContact CE1-CE2 3.68Å; F25-F35 AromaticContact CE1-CZ 3.54Å; F25-F35 HydrophobicContact CE1-CZ 3.54Å; F25-F35 HydrophobicContact CE2-CE2 4.13Å; F25-F35 HydrophobicContact CE2-CZ 4.28Å; F25-F35 HydrophobicContact CG-CZ 4.12Å; F25-F35 AromaticContact CZ-CE2 3.6Å; F25-F35 HydrophobicContact CZ-CE2 3.6Å; F25-F35 AromaticContact CZ-CZ 3.87Å; F25-F35 HydrophobicContact CZ-CZ 3.87Å; F35-T103 WeakPolarHBondContact O-CA 3.14Å; F35-I104 PolarHBondContact N-O 2.94Å; F35-I104 PolarHBondContact O-N 2.9Å; F35-L106 HydrophobicContact CD2-CD1 4.34Å; F35-L106 HydrophobicContact CE2-CD1 4.4Å; F35-L123 HydrophobicContact CD2-CD2 3.61Å; F35-L123 HydrophobicContact CE2-CD2 3.62Å; F35-L123 HydrophobicContact CG-CD2 4.18Å; F35-L123 HydrophobicContact CZ-CD2 4.19Å
36	V	94.9	Very high	90.8	Very high	81 Å²	81	55.3 Å²	55.3	49%	0.491	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.4	179.7	-177.2	0	0	0	0	107.5	E101 H102 T103	V36-E101 HydrophobicContact CG1-CB 3.82Å; V36-E101 HydrophobicContact CG1-CG 3.98Å; V36-H102 WeakPolarHBondContact CA-O 3.22Å; V36-T103 HydrophobicContact CG2-CG2 4.25Å
37	E	92.9	Very high	91	Very high	79 Å²	79	51.7 Å²	51.7	37%	0.369	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	130.8	-178.6	-70.5	-69.8	166.9	0	0	109.6	I39 E101 H102 I104 L125	E37-I39 HydrophobicContact CB-CD1 4.32Å; E37-I39 HydrophobicContact CB-CG1 4.08Å; E37-I39 PolarHBondContact O-N 3.3Å; E37-E101 CarbonylContact O-C 3.59Å; E37-E101 WeakPolarHBondContact O-CA 3.41Å; E37-H102 PolarHBondContact N-O 2.99Å; E37-H102 PolarHBondContact O-N 2.64Å; E37-I104 HydrophobicContact CB-CD1 4.23Å; E37-I104 HydrophobicContact CG-CD1 4.14Å; E37-L125 HydrophobicContact CG-CD2 3.57Å
38	E	92	Very high	91.2	Very high	74 Å²	74	53.8 Å²	53.8	35%	0.346	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	109.3	172.4	-70	-173.6	179.3	0	0	108.9	E101 Y166 R170	E38-E101 HydrophobicContact CG-CG 4.05Å; E38-Y166 HydrophobicContact CB-CE1 4.36Å; E38-R170 IonicContact OE1-CZ 3.66Å; E38-R170 VanDerWaalsContact OE1-CZ 3.27Å; E38-R170 IonicContact OE1-NH1 3.08Å; E38-R170 PolarHBondContact OE1-NH1 3.47Å; E38-R170 IonicContact OE1-NH2 3.72Å; E38-R170 PolarHBondContact OE1-NH2 2.91Å; E38-R170 VanDerWaalsContact OE1-NH2 3.08Å; E38-R170 IonicContact OE2-CZ 3.78Å; E38-R170 IonicContact OE2-NH1 3.09Å; E38-R170 PolarHBondContact OE2-NH1 3.33Å
39	I	92.4	Very high	91.6	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	129.8	-174.8	-53.6	168.3	0	0	0	109.1	E37 T43 V45 F94 P99 G100 H102 V127	E37-I39 HydrophobicContact CB-CD1 4.32Å; E37-I39 HydrophobicContact CB-CG1 4.08Å; E37-I39 PolarHBondContact O-N 3.3Å; I39-T43 HydrophobicContact CG2-CG2 4.05Å; I39-V45 HydrophobicContact CD1-CG2 3.71Å; I39-V45 HydrophobicContact CG1-CG2 4.38Å; I39-V45 HydrophobicContact CG2-CG2 4.18Å; I39-F94 HydrophobicContact CD1-CE2 3.99Å; I39-F94 HydrophobicContact CD1-CZ 3.87Å; I39-P99 WeakPolarHBondContact O-CA 3.24Å; I39-G100 PolarHBondContact N-O 3.04Å; I39-G100 PolarHBondContact O-N 3.44Å; I39-H102 HydrophobicContact CD1-CB 3.69Å; I39-V127 HydrophobicContact CG2-CG1 4.32Å
40	P	91.7	Very high	92.1	Very high	6 Å²	6	55.4 Å²	55.4	4%	0.039	28%	0.279	C	S	.	.			trans	-64	166	171.4	-18.6	30.9	0	0	0	112.7	T43 S96 K162 E163	P40-T43 PolarHBondContact O-OG1 3.41Å; P40-S96 WeakPolarHBondContact O-CB 3.36Å; P40-S96 PolarHBondContact O-OG 3.46Å; P40-K162 HydrophobicContact CB-CB 4.14Å; P40-E163 HydrophobicContact CG-CG 3.85Å
41	D	90.7	Very high	92.6	Very high	60 Å²	60	50.7 Å²	50.7	32%	0.321	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	149.9	171.9	130.4	-45.7	0	0	0	111.2	T43 P99	D41-T43 PolarHBondContact O-N 3.17Å; D41-T43 PolarHBondContact O-OG1 3.32Å; D41-P99 HydrophobicContact CB-CB 4.31Å; D41-P99 HydrophobicContact CB-CG 4.38Å
42	Q	90.9	Very high	92.6	Very high	130 Å²	130	47.9 Å²	47.9	61%	0.607	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	29.1	171.4	-61.9	169.3	40.4	0	0	114.6	S96	Q42-S96 VanDerWaalsContact CA-O 3.24Å; Q42-S96 WeakPolarHBondContact CA-O 3.04Å; Q42-S96 PolarHBondContact N-O 3.39Å
43	T	92.2	Very high	92.4	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.012	23%	0.232	C	C	.	.			trans	-101.7	127.4	-178.8	-57.9	0	0	0	0	109.4	I39 P40 D41 S96 V127	I39-T43 HydrophobicContact CG2-CG2 4.05Å; P40-T43 PolarHBondContact O-OG1 3.41Å; D41-T43 PolarHBondContact O-N 3.17Å; D41-T43 PolarHBondContact O-OG1 3.32Å; T43-S96 PolarHBondContact O-N 3.04Å; T43-V127 HydrophobicContact CG2-CG1 3.71Å
44	M	92.9	Very high	91.9	Very high	82 Å²	82	47.7 Å²	47.7	40%	0.404	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	140	177.4	-172.4	-178.6	-61.3	0	0	110.2	T93 G128 A131	M44-T93 HydrophobicContact CG-CG2 4.22Å; M44-T93 HydrophobicContact SD-CG2 4.17Å; M44-G128 PolarHBondContact O-N 3.12Å; M44-A131 HydrophobicContact CG-CB 4.47Å
45	V	94.4	Very high	91.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	132	175.5	179.3	0	0	0	0	110.3	I39 T93 F94 L125 Q126 V127	I39-V45 HydrophobicContact CD1-CG2 3.71Å; I39-V45 HydrophobicContact CG1-CG2 4.38Å; I39-V45 HydrophobicContact CG2-CG2 4.18Å; V45-T93 WeakPolarHBondContact O-CA 3.15Å; V45-F94 HydrophobicContact CB-CD1 4.11Å; V45-F94 HydrophobicContact CB-CE1 3.61Å; V45-F94 HydrophobicContact CB-CE2 4.1Å; V45-F94 HydrophobicContact CB-CZ 3.6Å; V45-F94 HydrophobicContact CG1-CD1 4.37Å; V45-F94 HydrophobicContact CG1-CE1 3.57Å; V45-F94 HydrophobicContact CG1-CZ 3.77Å; V45-F94 HydrophobicContact CG2-CE1 4.46Å; V45-F94 HydrophobicContact CG2-CE2 4.21Å; V45-F94 HydrophobicContact CG2-CZ 3.95Å; V45-F94 PolarHBondContact N-O 2.97Å; V45-F94 PolarHBondContact O-N 3.4Å; V45-L125 HydrophobicContact CG1-CD1 3.36Å; V45-L125 HydrophobicContact CG1-CD2 4.35Å; V45-L125 HydrophobicContact CG1-CG 3.84Å; V45-Q126 CarbonylContact C-O 3.57Å; V45-Q126 WeakPolarHBondContact CA-O 3.31Å; V45-V127 HydrophobicContact CG1-CG2 4.18Å; V45-V127 HydrophobicContact CG2-CB 4.28Å; V45-V127 HydrophobicContact CG2-CG1 4Å; V45-V127 HydrophobicContact CG2-CG2 3.95Å
46	I	94.1	Very high	90.4	Very high	16 Å²	16	48.8 Å²	48.8	8%	0.082	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	117.3	174.6	-66.6	179.6	0	0	0	108.9	K91 I92 T93 Q126 A131	I46-K91 HydrophobicContact CG2-CD 4.32Å; I46-K91 HydrophobicContact CG2-CG 3.99Å; I46-I92 CarbonylContact C-O 3.57Å; I46-I92 VanDerWaalsContact CA-O 3.27Å; I46-I92 WeakPolarHBondContact CA-O 3.42Å; I46-T93 HydrophobicContact CG1-CG2 3.92Å; I46-Q126 PolarHBondContact N-O 3.02Å; I46-Q126 PolarHBondContact O-N 3.37Å; I46-A131 HydrophobicContact CB-CB 4.19Å; I46-A131 HydrophobicContact CD1-CB 3.94Å; I46-A131 WeakPolarHBondContact CD1-O 3.44Å; I46-A131 HydrophobicContact CG1-CB 3.87Å
47	G	93.3	Very high	89.7	Confident	2 Å²	2	53.4 Å²	53.4	2%	0.021	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	122.8	172.1	0	0	0	0	0	110.2	K91 I92 N124	G47-K91 CarbonylContact O-C 3.54Å; G47-K91 WeakPolarHBondContact O-CA 3.37Å; G47-I92 PolarHBondContact N-O 2.73Å; G47-I92 WeakPolarHBondContact O-CB 3.48Å; G47-I92 PolarHBondContact O-N 3.42Å; G47-N124 CarbonylContact C-O 3.54Å; G47-N124 WeakPolarHBondContact CA-O 3.41Å
48	S	93.6	Very high	89.2	Confident	45 Å²	45	53.1 Å²	53.1	32%	0.315	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	137.3	167.4	54.8	0	0	0	0	109.3	G90 N124	S48-G90 WeakPolarHBondContact CA-O 3.49Å; S48-N124 PolarHBondContact N-O 2.84Å; S48-N124 PolarHBondContact O-N 2.94Å
49	Y	92.8	Very high	88.6	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.008	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	150.7	176.8	77.1	-87.7	0	0	0	111.4	V51 M69 V71 Y86 A87 E89 G90 I92 L106 V121 D122	Y49-V51 HydrophobicContact CD2-CG2 3.8Å; Y49-V51 HydrophobicContact CE2-CG2 3.72Å; Y49-M69 HydrophobicContact CE2-CB 3.67Å; Y49-M69 HydrophobicContact CE2-CG 4.14Å; Y49-V71 HydrophobicContact CE1-CG2 3.99Å; Y49-Y86 WeakPolarHBondContact OH-CB 3.37Å; Y49-A87 PolarHBondContact OH-O 3.17Å; Y49-E89 WeakPolarHBondContact O-CA 3.39Å; Y49-G90 WeakPolarHBondContact CD1-O 3.49Å; Y49-G90 PolarHBondContact N-O 3.32Å; Y49-G90 PolarHBondContact O-N 2.91Å; Y49-I92 HydrophobicContact CD1-CD1 3.89Å; Y49-I92 HydrophobicContact CE1-CD1 4.25Å; Y49-L106 HydrophobicContact CD1-CD2 4.1Å; Y49-L106 HydrophobicContact CD2-CD2 4.28Å; Y49-L106 HydrophobicContact CG-CD2 3.87Å; Y49-V121 HydrophobicContact CD2-CG1 4.46Å; Y49-D122 CarbonylContact C-O 3.54Å; Y49-D122 WeakPolarHBondContact CA-O 3.44Å
50	K	92.3	Very high	88	Confident	116 Å²	116	61.1 Å²	61.1	50%	0.504	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	131.6	174.2	-69.1	-178.5	174.7	-176.9	0	109.9	E89 V121 D122	K50-E89 VanDerWaalsContact CE-CD 3.44Å; K50-E89 WeakPolarHBondContact CE-OE1 3.45Å; K50-E89 HydrophobicContact CG-CB 4.48Å; K50-E89 HydrophobicContact CG-CG 4.06Å; K50-E89 IonicContact NZ-OE1 3.27Å; K50-V121 WeakPolarHBondContact O-CA 3.42Å; K50-D122 PolarHBondContact N-O 2.94Å; K50-D122 PolarHBondContact O-N 3.47Å
51	V	90.6	Very high	87.4	Confident	3 Å²	3	65.6 Å²	65.6	2%	0.018	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	123.4	178.3	-177.6	0	0	0	0	109.7	Y49 A64 M69 S88 L119 V121	Y49-V51 HydrophobicContact CD2-CG2 3.8Å; Y49-V51 HydrophobicContact CE2-CG2 3.72Å; V51-A64 HydrophobicContact CG1-CB 3.87Å; V51-A64 PolarHBondContact O-N 3.31Å; V51-M69 HydrophobicContact CG2-CE 3.82Å; V51-S88 WeakPolarHBondContact CB-O 3.34Å; V51-S88 WeakPolarHBondContact CG2-O 3.38Å; V51-S88 PolarHBondContact N-O 3.48Å; V51-L119 HydrophobicContact CG1-CB 4.16Å; V51-L119 HydrophobicContact CG1-CD1 3.41Å; V51-L119 VanDerWaalsContact CG1-CD1 3.41Å; V51-L119 HydrophobicContact CG1-CD2 3.82Å; V51-L119 HydrophobicContact CG1-CG 4.02Å; V51-V121 HydrophobicContact CG2-CG2 4.1Å
52	S	89.1	Confident	87	Confident	15 Å²	15	64.9 Å²	64.9	11%	0.105	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	147.3	173.5	62.4	0	0	0	0	111.3	T62 R120	S52-T62 CarbonylContact C-O 3.55Å; S52-T62 VanDerWaalsContact CA-O 3.31Å; S52-T62 WeakPolarHBondContact CA-O 3.37Å; S52-R120 PolarHBondContact N-O 3.41Å; S52-R120 PolarHBondContact O-N 2.93Å; S52-R120 WeakPolarHBondContact OG-CB 3.37Å; S52-R120 PolarHBondContact OG-O 3.42Å
53	M	86	Confident	86.5	Confident	60 Å²	60	63.3 Å²	63.3	30%	0.296	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	143.6	174.1	58.2	-172.5	174	0	0	108.8	D55 H61 T62 A64 L119	M53-D55 PolarHBondContact O-N 2.95Å; M53-H61 CarbonylContact O-C 3.52Å; M53-H61 WeakPolarHBondContact O-CA 3.25Å; M53-T62 PolarHBondContact N-O 3.39Å; M53-T62 PolarHBondContact O-N 3.33Å; M53-A64 HydrophobicContact CB-CB 4.3Å; M53-A64 HydrophobicContact CE-CB 4.49Å; M53-A64 HydrophobicContact CG-CB 4.07Å; M53-A64 HydrophobicContact SD-CB 3.97Å; M53-L119 HydrophobicContact CB-CD2 4.11Å
54	F	82.9	Confident	86	Confident	111 Å²	111	63.2 Å²	63.2	49%	0.487	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	117.1	174.4	-178.2	-100.2	0	0	0	109.2	P56 H61	F54-P56 HydrophobicContact CE1-CB 4.48Å; F54-P56 WeakPolarHBondContact O-CD 3.49Å; F54-H61 AromaticContact CD2-CE1 3.94Å; F54-H61 AromaticContact CD2-NE2 3.96Å
55	D	81	Confident	85.2	Confident	42 Å²	42	64 Å²	64	23%	0.225	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	113.4	174.4	172.7	16.5	0	0	0	109.8	M53 Q57 T58 K59 T60 T62	M53-D55 PolarHBondContact O-N 2.95Å; D55-Q57 PolarHBondContact O-N 3.23Å; D55-Q57 PolarHBondContact OD1-N 2.97Å; D55-T58 WeakPolarHBondContact CB-OG1 3.37Å; D55-T58 PolarHBondContact O-N 3.38Å; D55-T58 VanDerWaalsContact OD2-CG2 3.3Å; D55-T58 WeakPolarHBondContact OD2-CG2 3.44Å; D55-T58 PolarHBondContact OD2-OG1 2.73Å; D55-K59 WeakPolarHBondContact O-CA 3.3Å; D55-K59 PolarHBondContact O-N 3.06Å; D55-T60 PolarHBondContact N-O 2.99Å; D55-T62 HydrophobicContact CB-CG2 4.24Å
56	P	78.4	Confident	84.4	Confident	97 Å²	97	69 Å²	69	63%	0.63	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-21.4	-178.5	26.7	-34.2	0	0	0	113.3	F54	F54-P56 HydrophobicContact CE1-CB 4.48Å; F54-P56 WeakPolarHBondContact O-CD 3.49Å
57	Q	79.4	Confident	83.8	Confident	179 Å²	179	68.7 Å²	68.7	84%	0.836	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-47.7	180	-63.2	-143.8	19.7	0	0	112.1	D55	D55-Q57 PolarHBondContact O-N 3.23Å; D55-Q57 PolarHBondContact OD1-N 2.97Å
58	T	82	Confident	83.5	Confident	73 Å²	73	69.7 Å²	69.7	45%	0.448	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-13.6	-179.9	55.9	0	0	0	0	112.7	D55 T60	D55-T58 WeakPolarHBondContact CB-OG1 3.37Å; D55-T58 PolarHBondContact O-N 3.38Å; D55-T58 VanDerWaalsContact OD2-CG2 3.3Å; D55-T58 WeakPolarHBondContact OD2-CG2 3.44Å; D55-T58 PolarHBondContact OD2-OG1 2.73Å; T58-T60 WeakPolarHBondContact CB-OG1 3.42Å; T58-T60 PolarHBondContact O-N 3.04Å; T58-T60 PolarHBondContact OG1-N 2.98Å; T58-T60 PolarHBondContact OG1-OG1 3.42Å
59	K	78.9	Confident	83.3	Confident	172 Å²	172	67.6 Å²	67.6	75%	0.748	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	27.7	-168.7	-58.6	-176	178.5	-177.7	0	112.2	D55	D55-K59 WeakPolarHBondContact O-CA 3.3Å; D55-K59 PolarHBondContact O-N 3.06Å
60	T	80.6	Confident	83.3	Confident	71 Å²	71	69.2 Å²	69.2	44%	0.436	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	154.3	179.5	62.8	0	0	0	0	110.5	D55 T58 T62	D55-T60 PolarHBondContact N-O 2.99Å; T58-T60 WeakPolarHBondContact CB-OG1 3.42Å; T58-T60 PolarHBondContact O-N 3.04Å; T58-T60 PolarHBondContact OG1-N 2.98Å; T58-T60 PolarHBondContact OG1-OG1 3.42Å; T60-T62 PolarHBondContact O-N 2.97Å
61	H	79	Confident	83.4	Confident	100 Å²	100	63.7 Å²	63.7	46%	0.463	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	115.4	170.2	-71.7	-84.2	0	0	0	108.5	M53 F54	M53-H61 CarbonylContact O-C 3.52Å; M53-H61 WeakPolarHBondContact O-CA 3.25Å; F54-H61 AromaticContact CD2-CE1 3.94Å; F54-H61 AromaticContact CD2-NE2 3.96Å
62	T	81.7	Confident	83.7	Confident	45 Å²	45	65.3 Å²	65.3	28%	0.276	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	151.1	176.9	57.2	0	0	0	0	109.8	S52 M53 D55 T60 A64	S52-T62 CarbonylContact C-O 3.55Å; S52-T62 VanDerWaalsContact CA-O 3.31Å; S52-T62 WeakPolarHBondContact CA-O 3.37Å; M53-T62 PolarHBondContact N-O 3.39Å; M53-T62 PolarHBondContact O-N 3.33Å; D55-T62 HydrophobicContact CB-CG2 4.24Å; T60-T62 PolarHBondContact O-N 2.97Å; T62-A64 PolarHBondContact O-N 3.27Å
63	M	81.3	Confident	84	Confident	97 Å²	97	64.6 Å²	64.6	48%	0.478	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	131.1	179.6	-173.4	176.3	-179.9	0	0	110	S65 S88 E89	M63-S65 PolarHBondContact O-N 2.93Å; M63-S88 VanDerWaalsContact CE-OG 3.22Å; M63-S88 WeakPolarHBondContact CE-OG 3.21Å; M63-E89 HydrophobicContact CE-CB 3.63Å
64	A	80.7	Confident	84.5	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	34%	0.342	C	S	.	.			trans	-80.2	63.4	-177.8	0	0	0	0	0	111.9	V51 M53 T62 S66 I67 S88 L119	V51-A64 HydrophobicContact CG1-CB 3.87Å; V51-A64 PolarHBondContact O-N 3.31Å; M53-A64 HydrophobicContact CB-CB 4.3Å; M53-A64 HydrophobicContact CE-CB 4.49Å; M53-A64 HydrophobicContact CG-CB 4.07Å; M53-A64 HydrophobicContact SD-CB 3.97Å; T62-A64 PolarHBondContact O-N 3.27Å; A64-S66 PolarHBondContact O-N 3.44Å; A64-I67 HydrophobicContact CB-CB 4.14Å; A64-I67 HydrophobicContact CB-CD1 3.81Å; A64-I67 HydrophobicContact CB-CG1 4.12Å; A64-I67 PolarHBondContact O-N 2.94Å; A64-S88 WeakPolarHBondContact O-CB 3.48Å; A64-S88 PolarHBondContact O-OG 3.35Å; A64-L119 HydrophobicContact CB-CD2 4.16Å
65	S	77	Confident	85.2	Confident	98 Å²	98	58 Å²	58	69%	0.685	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-27.6	-169.1	59.6	0	0	0	0	115.6	M63	M63-S65 PolarHBondContact O-N 2.93Å
66	S	77.5	Confident	85.8	Confident	105 Å²	105	58.2 Å²	58.2	73%	0.734	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-2.1	179.9	55.1	0	0	0	0	114.7	A64	A64-S66 PolarHBondContact O-N 3.44Å
67	I	81.7	Confident	86.6	Confident	10 Å²	10	58.5 Å²	58.5	5%	0.051	32%	0.323	C	S	.	.			trans	-116.6	114.5	-167.9	-50.8	179.5	0	0	0	109.3	A64 S88 T110 W113 L119	A64-I67 HydrophobicContact CB-CB 4.14Å; A64-I67 HydrophobicContact CB-CD1 3.81Å; A64-I67 HydrophobicContact CB-CG1 4.12Å; A64-I67 PolarHBondContact O-N 2.94Å; I67-S88 WeakPolarHBondContact O-CA 3.31Å; I67-S88 PolarHBondContact O-N 2.98Å; I67-T110 HydrophobicContact CG2-CG2 3.95Å; I67-W113 HydrophobicContact CD1-CB 4.01Å; I67-W113 HydrophobicContact CD1-CD2 4.36Å; I67-W113 HydrophobicContact CD1-CE3 3.64Å; I67-W113 HydrophobicContact CG1-CE3 4.41Å; I67-W113 HydrophobicContact CG2-CE3 3.64Å; I67-W113 HydrophobicContact CG2-CZ3 3.69Å; I67-L119 HydrophobicContact CD1-CD2 4.01Å; I67-L119 HydrophobicContact CG2-CD1 4.08Å
68	G	86.2	Confident	87.3	Confident	23 Å²	23	54.7 Å²	54.7	24%	0.237	32%	0.316	C	S	.	.			trans	-84.1	151.1	172.4	0	0	0	0	0	112.1	Y86 S108	G68-Y86 CarbonylContact C-O 3.56Å; G68-Y86 WeakPolarHBondContact CA-O 3.35Å; G68-S108 PolarHBondContact O-OG 3.39Å
69	M	89.3	Confident	88	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	126.2	173.5	-166.9	62.5	63.7	0	0	109.7	I27 Y49 V51 Y86 A87 L106 F107 L119 V121	I27-M69 HydrophobicContact CD1-CE 3.93Å; I27-M69 HydrophobicContact CD1-SD 4.27Å; Y49-M69 HydrophobicContact CE2-CB 3.67Å; Y49-M69 HydrophobicContact CE2-CG 4.14Å; V51-M69 HydrophobicContact CG2-CE 3.82Å; M69-Y86 PolarHBondContact N-O 2.66Å; M69-Y86 PolarHBondContact O-N 3.23Å; M69-A87 PolarHBondContact N-O 3.45Å; M69-L106 HydrophobicContact CG-CB 4Å; M69-L106 HydrophobicContact CG-CD2 4.1Å; M69-L106 HydrophobicContact CG-CG 4.49Å; M69-L106 HydrophobicContact SD-CB 4.02Å; M69-F107 PolarHBondContact SD-N 3.42Å; M69-F107 VanDerWaalsContact SD-N 3.42Å; M69-F107 VanDerWaalsContact SD-O 3.37Å; M69-L119 HydrophobicContact CE-CD1 4.12Å; M69-V121 HydrophobicContact CE-CG2 4.13Å
70	H	93.4	Very high	88.8	Confident	36 Å²	36	52.3 Å²	52.3	17%	0.167	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	129.6	170.2	-166.3	93.8	0	0	0	108.9	S83 L85 L106 F107	H70-S83 PolarHBondContact CE1-OG 3.14Å; H70-S83 VanDerWaalsContact CE1-OG 3.25Å; H70-S83 PolarHBondContact NE2-OG 2.91Å; H70-L85 HydrophobicContact CB-CD1 4.18Å; H70-L106 WeakPolarHBondContact O-CA 2.95Å; H70-F107 WeakPolarHBondContact CA-O 2.96Å; H70-F107 HydrophobicContact CB-CD1 4.44Å; H70-F107 HydrophobicContact CB-CD2 4.01Å; H70-F107 HydrophobicContact CB-CE1 4.2Å; H70-F107 HydrophobicContact CB-CE2 3.72Å; H70-F107 HydrophobicContact CB-CG 4.37Å; H70-F107 HydrophobicContact CB-CZ 3.83Å; H70-F107 WeakPolarHBondContact CB-O 3.4Å; H70-F107 AromaticContact CD2-CE1 3.39Å; H70-F107 WeakPolarHBondContact CD2-CE1 3.39Å; H70-F107 AromaticContact CD2-CE2 3.87Å; H70-F107 AromaticContact CD2-CZ 3.1Å; H70-F107 WeakPolarHBondContact CD2-CZ 3.37Å; H70-F107 AromaticContact CG-CE2 3.85Å; H70-F107 AromaticContact CG-CZ 3.57Å; H70-F107 PolarHBondContact N-O 2.92Å; H70-F107 AromaticContact NE2-CZ 3.91Å; H70-F107 PolarHBondContact O-N 3.31Å
71	V	94.9	Very high	89.4	Confident	0 Å²	0	52 Å²	52	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124.7	178.9	-178.3	0	0	0	0	108.4	Y49 V73 S83 R84 Y86 I92 C105 L106	Y49-V71 HydrophobicContact CE1-CG2 3.99Å; V71-V73 HydrophobicContact CG1-CG2 4.5Å; V71-S83 WeakPolarHBondContact O-CA 3.44Å; V71-R84 PolarHBondContact N-O 3.5Å; V71-R84 PolarHBondContact O-N 2.97Å; V71-Y86 HydrophobicContact CB-CD2 4.09Å; V71-Y86 HydrophobicContact CB-CE2 4.06Å; V71-Y86 HydrophobicContact CG2-CD2 3.78Å; V71-Y86 HydrophobicContact CG2-CE2 4.18Å; V71-I92 HydrophobicContact CB-CD1 4.25Å; V71-I92 HydrophobicContact CB-CG1 4.4Å; V71-I92 HydrophobicContact CG1-CD1 3.58Å; V71-I92 HydrophobicContact CG1-CG1 3.93Å; V71-I92 HydrophobicContact CG1-CG2 4.36Å; V71-I92 HydrophobicContact CG2-CD1 3.86Å; V71-I92 HydrophobicContact CG2-CG1 4.23Å; V71-C105 WeakPolarHBondContact CA-O 3.37Å; V71-L106 HydrophobicContact CG2-CD2 4.38Å; V71-L106 HydrophobicContact CG2-CG 4.36Å
72	E	95.9	Very high	90.2	Very high	37 Å²	37	48.1 Å²	48.1	17%	0.173	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	129.1	176.7	-172.9	174.6	99.8	0	0	109.7	R32 T74 V80 L82 C105 F107	R32-E72 IonicContact CZ-OE1 2.74Å; R32-E72 IonicContact NH1-OE1 3.95Å; R32-E72 PolarHBondContact NH1-OE1 3.28Å; R32-E72 VanDerWaalsContact NH1-OE1 3.09Å; R32-E72 IonicContact NH2-OE1 3.12Å; R32-E72 PolarHBondContact NH2-OE1 3.21Å; E72-T74 HydrophobicContact CG-CG2 4.44Å; E72-V80 HydrophobicContact CG-CG1 4.27Å; E72-V80 HydrophobicContact CG-CG2 4.48Å; E72-L82 CarbonylContact C-O 3.51Å; E72-L82 WeakPolarHBondContact CA-O 3.49Å; E72-C105 PolarHBondContact N-O 3.21Å; E72-C105 PolarHBondContact O-N 3.47Å; E72-F107 HydrophobicContact CB-CE1 4.25Å
73	V	96.7	Very high	90.8	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	125	176.6	-177.9	0	0	0	0	108.3	V71 V81 L82 F94 T103 I104	V71-V73 HydrophobicContact CG1-CG2 4.5Å; V73-V81 HydrophobicContact CG1-CB 4.43Å; V73-V81 PolarHBondContact O-N 3.33Å; V73-L82 HydrophobicContact CB-CB 4.21Å; V73-L82 HydrophobicContact CG2-CB 4.36Å; V73-L82 HydrophobicContact CG2-CD2 4.23Å; V73-L82 PolarHBondContact N-O 3.13Å; V73-L82 PolarHBondContact O-N 2.99Å; V73-F94 HydrophobicContact CG1-CD1 4.14Å; V73-F94 HydrophobicContact CG1-CD2 4.13Å; V73-F94 HydrophobicContact CG1-CE1 3.87Å; V73-F94 HydrophobicContact CG1-CE2 3.87Å; V73-F94 HydrophobicContact CG1-CG 4.26Å; V73-F94 HydrophobicContact CG1-CZ 3.73Å; V73-F94 HydrophobicContact CG2-CD1 4.14Å; V73-F94 HydrophobicContact CG2-CE1 4.11Å; V73-T103 VanDerWaalsContact CA-O 3.31Å; V73-T103 WeakPolarHBondContact CA-O 3.46Å; V73-I104 HydrophobicContact CG1-CG1 4.39Å; V73-I104 HydrophobicContact CG2-CG1 4.27Å; V73-I104 HydrophobicContact CG2-CG2 4.3Å
74	T	97	Very high	91.4	Very high	19 Å²	19	51.2 Å²	51.2	12%	0.117	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	145.4	175.5	63.2	0	0	0	0	111.7	E72 Q79 V80 H102 T103	E72-T74 HydrophobicContact CG-CG2 4.44Å; T74-Q79 CarbonylContact C-O 3.6Å; T74-Q79 VanDerWaalsContact CA-O 3.22Å; T74-Q79 WeakPolarHBondContact CA-O 3.35Å; T74-V80 HydrophobicContact CG2-CG2 4.21Å; T74-H102 VanDerWaalsContact O-CA 3.26Å; T74-H102 WeakPolarHBondContact O-CA 3.33Å; T74-H102 WeakPolarHBondContact O-CB 3.44Å; T74-T103 PolarHBondContact N-O 2.79Å; T74-T103 PolarHBondContact O-N 2.93Å; T74-T103 WeakPolarHBondContact OG1-CB 3.16Å
75	D	95.6	Very high	92	Very high	14 Å²	14	57 Å²	57	8%	0.075	33%	0.328	C	S	.	.			trans	-78.3	175.7	172.6	86	-13.8	0	0	0	111.5	D77 S78 Q79 V81 K98	D75-D77 PolarHBondContact O-N 2.98Å; D75-D77 WeakPolarHBondContact OD1-CA 3.24Å; D75-D77 PolarHBondContact OD1-N 3.29Å; D75-S78 PolarHBondContact O-N 2.95Å; D75-S78 PolarHBondContact OD1-N 2.9Å; D75-Q79 PolarHBondContact N-O 2.92Å; D75-Q79 WeakPolarHBondContact OD1-CA 3.33Å; D75-Q79 WeakPolarHBondContact OD1-CB 3.27Å; D75-Q79 PolarHBondContact OD1-N 2.93Å; D75-V81 HydrophobicContact CB-CG2 3.74Å; D75-K98 IonicContact OD2-NZ 3.33Å; D75-K98 PolarHBondContact OD2-NZ 2.82Å
76	P	94.9	Very high	92.7	Very high	47 Å²	47	54.7 Å²	54.7	31%	0.305	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-21.9	179.2	-23.5	33.9	0	0	0	114.7	S78 E101	P76-S78 VanDerWaalsContact C-N 3.25Å; P76-S78 PolarHBondContact O-N 2.83Å; P76-E101 VanDerWaalsContact CA-O 3.25Å; P76-E101 WeakPolarHBondContact CA-O 3.4Å; P76-E101 WeakPolarHBondContact CG-O 3.45Å
77	D	95.3	Very high	93.3	Very high	102 Å²	102	52.6 Å²	52.6	55%	0.545	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	14.3	176.6	-67.6	-34.4	0	0	0	111.9	D75 Q79 K98	D75-D77 PolarHBondContact O-N 2.98Å; D75-D77 WeakPolarHBondContact OD1-CA 3.24Å; D75-D77 PolarHBondContact OD1-N 3.29Å; D77-Q79 HydrophobicContact CB-CG 4.24Å; D77-Q79 PolarHBondContact O-N 2.8Å; D77-K98 WeakPolarHBondContact OD2-CE 3.4Å; D77-K98 IonicContact OD2-NZ 3.56Å; D77-K98 PolarHBondContact OD2-NZ 2.92Å
78	S	93.8	Very high	93.7	Very high	99 Å²	99	52.3 Å²	52.3	69%	0.692	29%	0.293	S	S	*	.	S	Bend	trans	61.8	21.8	-176.6	-52.2	0	0	0	0	114.5	D75 P76	D75-S78 PolarHBondContact O-N 2.95Å; D75-S78 PolarHBondContact OD1-N 2.9Å; P76-S78 VanDerWaalsContact C-N 3.25Å; P76-S78 PolarHBondContact O-N 2.83Å
79	Q	95.8	Very high	94	Very high	113 Å²	113	55.8 Å²	55.8	53%	0.528	30%	0.303	S	S	.	.			trans	-84.2	134.8	174.3	-54.7	-172.1	7.4	0	0	110.1	T74 D75 D77 V81	T74-Q79 CarbonylContact C-O 3.6Å; T74-Q79 VanDerWaalsContact CA-O 3.22Å; T74-Q79 WeakPolarHBondContact CA-O 3.35Å; D75-Q79 PolarHBondContact N-O 2.92Å; D75-Q79 WeakPolarHBondContact OD1-CA 3.33Å; D75-Q79 WeakPolarHBondContact OD1-CB 3.27Å; D75-Q79 PolarHBondContact OD1-N 2.93Å; D77-Q79 HydrophobicContact CB-CG 4.24Å; D77-Q79 PolarHBondContact O-N 2.8Å; Q79-V81 PolarHBondContact O-N 3.04Å
80	V	95.6	Very high	94.1	Very high	82 Å²	82	56.2 Å²	56.2	50%	0.497	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	112.4	178.1	179.9	0	0	0	0	109.5	E72 T74	E72-V80 HydrophobicContact CG-CG1 4.27Å; E72-V80 HydrophobicContact CG-CG2 4.48Å; T74-V80 HydrophobicContact CG2-CG2 4.21Å
81	V	94.7	Very high	94.1	Very high	65 Å²	65	60.9 Å²	60.9	39%	0.394	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	-39	175.4	-179.8	0	0	0	0	110.4	V73 D75 Q79 F94	V73-V81 HydrophobicContact CG1-CB 4.43Å; V73-V81 PolarHBondContact O-N 3.33Å; D75-V81 HydrophobicContact CB-CG2 3.74Å; Q79-V81 PolarHBondContact O-N 3.04Å; V81-F94 HydrophobicContact CG1-CB 4.46Å
82	L	94.4	Very high	94	Very high	18 Å²	18	61 Å²	61	9%	0.094	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	129.5	-179.2	-177.4	112.6	0	0	0	109.7	E72 V73 R84 I92	E72-L82 CarbonylContact C-O 3.51Å; E72-L82 WeakPolarHBondContact CA-O 3.49Å; V73-L82 HydrophobicContact CB-CB 4.21Å; V73-L82 HydrophobicContact CG2-CB 4.36Å; V73-L82 HydrophobicContact CG2-CD2 4.23Å; V73-L82 PolarHBondContact N-O 3.13Å; V73-L82 PolarHBondContact O-N 2.99Å; L82-R84 HydrophobicContact CG-CG 4.36Å; L82-I92 HydrophobicContact CD2-CG2 3.62Å
83	S	95.5	Very high	93.9	Very high	58 Å²	58	62.4 Å²	62.4	41%	0.406	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	113.8	169.8	165.8	0	0	0	0	108.1	H70 V71	H70-S83 PolarHBondContact CE1-OG 3.14Å; H70-S83 VanDerWaalsContact CE1-OG 3.25Å; H70-S83 PolarHBondContact NE2-OG 2.91Å; V71-S83 WeakPolarHBondContact O-CA 3.44Å
84	R	94.2	Very high	93.8	Very high	150 Å²	150	63.1 Å²	63.1	57%	0.566	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148.4	143.5	-175.8	-68.2	-172.7	-176.9	169.7	1.8	111.6	V71 L82 Y86	V71-R84 PolarHBondContact N-O 3.5Å; V71-R84 PolarHBondContact O-N 2.97Å; L82-R84 HydrophobicContact CG-CG 4.36Å; R84-Y86 HydrophobicContact CB-CD2 4.23Å; R84-Y86 HydrophobicContact CB-CE2 3.59Å
85	L	92.5	Very high	93.7	Very high	120 Å²	120	65.5 Å²	65.5	63%	0.628	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.9	129.5	169.4	-175.4	69.6	0	0	0	109.5	H70	H70-L85 HydrophobicContact CB-CD1 4.18Å
86	Y	91.9	Very high	93.6	Very high	50 Å²	50	65 Å²	65	20%	0.196	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	170.4	176.2	-67.8	-87.3	0	0	0	109.8	Y49 G68 M69 V71 R84 I92	Y49-Y86 WeakPolarHBondContact OH-CB 3.37Å; G68-Y86 CarbonylContact C-O 3.56Å; G68-Y86 WeakPolarHBondContact CA-O 3.35Å; M69-Y86 PolarHBondContact N-O 2.66Å; M69-Y86 PolarHBondContact O-N 3.23Å; V71-Y86 HydrophobicContact CB-CD2 4.09Å; V71-Y86 HydrophobicContact CB-CE2 4.06Å; V71-Y86 HydrophobicContact CG2-CD2 3.78Å; V71-Y86 HydrophobicContact CG2-CE2 4.18Å; R84-Y86 HydrophobicContact CB-CD2 4.23Å; R84-Y86 HydrophobicContact CB-CE2 3.59Å; Y86-I92 HydrophobicContact CE2-CG1 4.06Å
87	A	91.2	Very high	93.5	Very high	61 Å²	61	67.6 Å²	67.6	50%	0.504	37%	0.374	S	S	.	.			trans	-73.2	-152.6	175.9	0	0	0	0	0	111.1	Y49 M69 E89	Y49-A87 PolarHBondContact OH-O 3.17Å; M69-A87 PolarHBondContact N-O 3.45Å; A87-E89 VanDerWaalsContact C-N 3.3Å
88	S	88.8	Confident	93.4	Very high	5 Å²	5	65.9 Å²	65.9	4%	0.035	36%	0.362	C	S	.	.	S	Bend	trans	-79.7	-12.6	174.7	40.1	0	0	0	0	114.1	V51 M63 A64 I67	V51-S88 WeakPolarHBondContact CB-O 3.34Å; V51-S88 WeakPolarHBondContact CG2-O 3.38Å; V51-S88 PolarHBondContact N-O 3.48Å; M63-S88 VanDerWaalsContact CE-OG 3.22Å; M63-S88 WeakPolarHBondContact CE-OG 3.21Å; A64-S88 WeakPolarHBondContact O-CB 3.48Å; A64-S88 PolarHBondContact O-OG 3.35Å; I67-S88 WeakPolarHBondContact O-CA 3.31Å; I67-S88 PolarHBondContact O-N 2.98Å
89	E	92.5	Very high	93.3	Very high	96 Å²	96	64.5 Å²	64.5	45%	0.449	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	140.9	168.6	174.7	171.7	-171.6	0	0	108.2	Y49 K50 M63 A87	Y49-E89 WeakPolarHBondContact O-CA 3.39Å; K50-E89 VanDerWaalsContact CE-CD 3.44Å; K50-E89 WeakPolarHBondContact CE-OE1 3.45Å; K50-E89 HydrophobicContact CG-CB 4.48Å; K50-E89 HydrophobicContact CG-CG 4.06Å; K50-E89 IonicContact NZ-OE1 3.27Å; M63-E89 HydrophobicContact CE-CB 3.63Å; A87-E89 VanDerWaalsContact C-N 3.3Å
90	G	91.8	Very high	93.1	Very high	9 Å²	9	59.4 Å²	59.4	9%	0.093	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	148.5	178.7	0	0	0	0	0	112.9	S48 Y49	S48-G90 WeakPolarHBondContact CA-O 3.49Å; Y49-G90 WeakPolarHBondContact CD1-O 3.49Å; Y49-G90 PolarHBondContact N-O 3.32Å; Y49-G90 PolarHBondContact O-N 2.91Å
91	K	93.6	Very high	93.1	Very high	133 Å²	133	60.6 Å²	60.6	58%	0.578	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.8	118.9	168.7	-172.6	-179.7	-178.7	-179.6	0	108.3	I46 G47	I46-K91 HydrophobicContact CG2-CD 4.32Å; I46-K91 HydrophobicContact CG2-CG 3.99Å; G47-K91 CarbonylContact O-C 3.54Å; G47-K91 WeakPolarHBondContact O-CA 3.37Å
92	I	93.2	Very high	93.1	Very high	3 Å²	3	57.5 Å²	57.5	2%	0.015	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	135.3	-179.9	-54.8	140.9	0	0	0	106.8	I46 G47 Y49 V71 L82 Y86 F94	I46-I92 CarbonylContact C-O 3.57Å; I46-I92 VanDerWaalsContact CA-O 3.27Å; I46-I92 WeakPolarHBondContact CA-O 3.42Å; G47-I92 PolarHBondContact N-O 2.73Å; G47-I92 WeakPolarHBondContact O-CB 3.48Å; G47-I92 PolarHBondContact O-N 3.42Å; Y49-I92 HydrophobicContact CD1-CD1 3.89Å; Y49-I92 HydrophobicContact CE1-CD1 4.25Å; V71-I92 HydrophobicContact CB-CD1 4.25Å; V71-I92 HydrophobicContact CB-CG1 4.4Å; V71-I92 HydrophobicContact CG1-CD1 3.58Å; V71-I92 HydrophobicContact CG1-CG1 3.93Å; V71-I92 HydrophobicContact CG1-CG2 4.36Å; V71-I92 HydrophobicContact CG2-CD1 3.86Å; V71-I92 HydrophobicContact CG2-CG1 4.23Å; L82-I92 HydrophobicContact CD2-CG2 3.62Å; Y86-I92 HydrophobicContact CE2-CG1 4.06Å; I92-F94 HydrophobicContact CG2-CD1 4.5Å
93	T	94.1	Very high	93.2	Very high	66 Å²	66	58.3 Å²	58.3	41%	0.405	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	127.6	175.3	-54.4	0	0	0	0	109	M44 V45 I46	M44-T93 HydrophobicContact CG-CG2 4.22Å; M44-T93 HydrophobicContact SD-CG2 4.17Å; V45-T93 WeakPolarHBondContact O-CA 3.15Å; I46-T93 HydrophobicContact CG1-CG2 3.92Å
94	F	94.1	Very high	93.2	Very high	15 Å²	15	55.7 Å²	55.7	7%	0.066	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	161.3	173.7	71.5	-86.4	0	0	0	109.8	I39 V45 V73 V81 I92 I104	I39-F94 HydrophobicContact CD1-CE2 3.99Å; I39-F94 HydrophobicContact CD1-CZ 3.87Å; V45-F94 HydrophobicContact CB-CD1 4.11Å; V45-F94 HydrophobicContact CB-CE1 3.61Å; V45-F94 HydrophobicContact CB-CE2 4.1Å; V45-F94 HydrophobicContact CB-CZ 3.6Å; V45-F94 HydrophobicContact CG1-CD1 4.37Å; V45-F94 HydrophobicContact CG1-CE1 3.57Å; V45-F94 HydrophobicContact CG1-CZ 3.77Å; V45-F94 HydrophobicContact CG2-CE1 4.46Å; V45-F94 HydrophobicContact CG2-CE2 4.21Å; V45-F94 HydrophobicContact CG2-CZ 3.95Å; V45-F94 PolarHBondContact N-O 2.97Å; V45-F94 PolarHBondContact O-N 3.4Å; V73-F94 HydrophobicContact CG1-CD1 4.14Å; V73-F94 HydrophobicContact CG1-CD2 4.13Å; V73-F94 HydrophobicContact CG1-CE1 3.87Å; V73-F94 HydrophobicContact CG1-CE2 3.87Å; V73-F94 HydrophobicContact CG1-CG 4.26Å; V73-F94 HydrophobicContact CG1-CZ 3.73Å; V73-F94 HydrophobicContact CG2-CD1 4.14Å; V73-F94 HydrophobicContact CG2-CE1 4.11Å; V81-F94 HydrophobicContact CG1-CB 4.46Å; I92-F94 HydrophobicContact CG2-CD1 4.5Å; F94-I104 HydrophobicContact CE1-CG1 4.27Å; F94-I104 HydrophobicContact CZ-CG1 4.34Å
95	T	94.1	Very high	93.3	Very high	70 Å²	70	48.6 Å²	48.6	43%	0.429	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	134.7	174.4	-56.1	0	0	0	0	108.2
96	S	93.6	Very high	93.4	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.014	24%	0.24	C	C	.	.			trans	-70.6	129.6	177.3	179.1	0	0	0	0	111.4	P40 Q42 T43 K98 H102	P40-S96 WeakPolarHBondContact O-CB 3.36Å; P40-S96 PolarHBondContact O-OG 3.46Å; Q42-S96 VanDerWaalsContact CA-O 3.24Å; Q42-S96 WeakPolarHBondContact CA-O 3.04Å; Q42-S96 PolarHBondContact N-O 3.39Å; T43-S96 PolarHBondContact O-N 3.04Å; S96-K98 PolarHBondContact OG-N 3.37Å; S96-K98 PolarHBondContact OG-O 2.84Å; S96-H102 PolarHBondContact OG-CE1 2.89Å; S96-H102 PolarHBondContact OG-NE2 3.33Å
97	S	93.3	Very high	93.3	Very high	102 Å²	102	42.4 Å²	42.4	71%	0.713	24%	0.239	S	C	*	.	S	Bend	trans	-93.5	-20.3	173.7	-60.2	0	0	0	0	113.1
98	K	92.1	Very high	93.1	Very high	67 Å²	67	39.7 Å²	39.7	29%	0.291	22%	0.216	S	C	.	.	S	Bend	trans	-137.6	135.7	-176.3	-68.8	177.5	-168.5	152.4	0	109.3	D75 D77 S96 H102	D75-K98 IonicContact OD2-NZ 3.33Å; D75-K98 PolarHBondContact OD2-NZ 2.82Å; D77-K98 WeakPolarHBondContact OD2-CE 3.4Å; D77-K98 IonicContact OD2-NZ 3.56Å; D77-K98 PolarHBondContact OD2-NZ 2.92Å; S96-K98 PolarHBondContact OG-N 3.37Å; S96-K98 PolarHBondContact OG-O 2.84Å; K98-H102 PolarHBondContact O-CE1 3.47Å
99	P	92.6	Very high	92.5	Very high	69 Å²	69	46.1 Å²	46.1	45%	0.448	25%	0.25	S	C	.	.	S	Bend	trans	-68.9	137.5	176.7	30.3	-33	0	0	0	110.6	I39 D41 Y166	I39-P99 WeakPolarHBondContact O-CA 3.24Å; D41-P99 HydrophobicContact CB-CB 4.31Å; D41-P99 HydrophobicContact CB-CG 4.38Å; P99-Y166 HydrophobicContact CB-CD2 3.81Å; P99-Y166 HydrophobicContact CB-CE2 3.89Å
100	G	92.3	Very high	91.5	Very high	6 Å²	6	43.4 Å²	43.4	6%	0.062	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	145.4	-167.2	175.2	0	0	0	0	0	114.7	I39 H102	I39-G100 PolarHBondContact N-O 3.04Å; I39-G100 PolarHBondContact O-N 3.44Å; G100-H102 PolarHBondContact O-N 3.31Å; G100-H102 PolarHBondContact O-ND1 3.46Å
101	E	94.4	Very high	90.3	Very high	107 Å²	107	46.3 Å²	46.3	50%	0.5	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	113.1	178.9	-68.7	-179.9	-170.2	0	0	111.1	V36 E37 E38 P76	V36-E101 HydrophobicContact CG1-CB 3.82Å; V36-E101 HydrophobicContact CG1-CG 3.98Å; E37-E101 CarbonylContact O-C 3.59Å; E37-E101 WeakPolarHBondContact O-CA 3.41Å; E38-E101 HydrophobicContact CG-CG 4.05Å; P76-E101 VanDerWaalsContact CA-O 3.25Å; P76-E101 WeakPolarHBondContact CA-O 3.4Å; P76-E101 WeakPolarHBondContact CG-O 3.45Å
102	H	95.8	Very high	88.8	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	138.8	168.2	-63.4	62.4	0	0	0	108.8	V36 E37 I39 T74 S96 K98 G100	V36-H102 WeakPolarHBondContact CA-O 3.22Å; E37-H102 PolarHBondContact N-O 2.99Å; E37-H102 PolarHBondContact O-N 2.64Å; I39-H102 HydrophobicContact CD1-CB 3.69Å; T74-H102 VanDerWaalsContact O-CA 3.26Å; T74-H102 WeakPolarHBondContact O-CA 3.33Å; T74-H102 WeakPolarHBondContact O-CB 3.44Å; S96-H102 PolarHBondContact OG-CE1 2.89Å; S96-H102 PolarHBondContact OG-NE2 3.33Å; K98-H102 PolarHBondContact O-CE1 3.47Å; G100-H102 PolarHBondContact O-N 3.31Å; G100-H102 PolarHBondContact O-ND1 3.46Å
103	T	96.5	Very high	87.6	Confident	34 Å²	34	49.1 Å²	49.1	21%	0.209	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	119	179.1	-53.6	0	0	0	0	109.7	C34 F35 V36 V73 T74 C105	C34-T103 HydrophobicContact CB-CG2 3.71Å; F35-T103 WeakPolarHBondContact O-CA 3.14Å; V36-T103 HydrophobicContact CG2-CG2 4.25Å; V73-T103 VanDerWaalsContact CA-O 3.31Å; V73-T103 WeakPolarHBondContact CA-O 3.46Å; T74-T103 PolarHBondContact N-O 2.79Å; T74-T103 PolarHBondContact O-N 2.93Å; T74-T103 WeakPolarHBondContact OG1-CB 3.16Å; T103-C105 VanDerWaalsContact CG2-SG 3.55Å
104	I	95.4	Very high	86	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.015	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	111.6	176.2	-56	88.8	0	0	0	108	C34 F35 E37 V73 F94 L106 L125	C34-I104 CarbonylContact C-O 3.56Å; C34-I104 WeakPolarHBondContact CA-O 3.45Å; F35-I104 PolarHBondContact N-O 2.94Å; F35-I104 PolarHBondContact O-N 2.9Å; E37-I104 HydrophobicContact CB-CD1 4.23Å; E37-I104 HydrophobicContact CG-CD1 4.14Å; V73-I104 HydrophobicContact CG1-CG1 4.39Å; V73-I104 HydrophobicContact CG2-CG1 4.27Å; V73-I104 HydrophobicContact CG2-CG2 4.3Å; F94-I104 HydrophobicContact CE1-CG1 4.27Å; F94-I104 HydrophobicContact CZ-CG1 4.34Å; I104-L106 HydrophobicContact CG2-CD1 4.34Å; I104-L125 HydrophobicContact CD1-CD2 4.19Å
105	C	95.4	Very high	84.4	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.007	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	136.3	-178.5	-62.4	0	0	0	0	111.8	R32 K33 C34 V71 E72 T103	R32-C105 HydrophobicContact CG-CB 4.17Å; R32-C105 PolarHBondContact NE-SG 2.81Å; R32-C105 PolarHBondContact NH2-SG 2.82Å; K33-C105 CarbonylContact O-C 3.51Å; K33-C105 VanDerWaalsContact O-CA 3.3Å; K33-C105 WeakPolarHBondContact O-CA 3.38Å; C34-C105 HydrophobicContact CB-CB 4.16Å; C34-C105 WeakPolarHBondContact CB-SG 3.49Å; C34-C105 WeakPolarHBondContact SG-CB 3.37Å; C34-C105 CovalentContact SG-SG 2.04Å; C34-C105 PolarHBondContact SG-SG 2.91Å; V71-C105 WeakPolarHBondContact CA-O 3.37Å; E72-C105 PolarHBondContact N-O 3.21Å; E72-C105 PolarHBondContact O-N 3.47Å; T103-C105 VanDerWaalsContact CG2-SG 3.55Å
106	L	94.2	Very high	83.1	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	128.8	172.4	-61.7	92.9	0	0	0	108.8	K33 F35 Y49 M69 H70 V71 I104 V121 L123	K33-L106 PolarHBondContact N-O 2.9Å; K33-L106 PolarHBondContact O-N 2.85Å; F35-L106 HydrophobicContact CD2-CD1 4.34Å; F35-L106 HydrophobicContact CE2-CD1 4.4Å; Y49-L106 HydrophobicContact CD1-CD2 4.1Å; Y49-L106 HydrophobicContact CD2-CD2 4.28Å; Y49-L106 HydrophobicContact CG-CD2 3.87Å; M69-L106 HydrophobicContact CG-CB 4Å; M69-L106 HydrophobicContact CG-CD2 4.1Å; M69-L106 HydrophobicContact CG-CG 4.49Å; M69-L106 HydrophobicContact SD-CB 4.02Å; H70-L106 WeakPolarHBondContact O-CA 2.95Å; V71-L106 HydrophobicContact CG2-CD2 4.38Å; V71-L106 HydrophobicContact CG2-CG 4.36Å; I104-L106 HydrophobicContact CG2-CD1 4.34Å; L106-V121 HydrophobicContact CD2-CG1 4.45Å; L106-L123 HydrophobicContact CD1-CD1 4.42Å; L106-L123 HydrophobicContact CD1-CD2 4.03Å; L106-L123 HydrophobicContact CD2-CD1 4.46Å
107	F	91.3	Very high	82.2	Confident	41 Å²	41	59.1 Å²	59.1	18%	0.18	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	147.6	175.8	60	-86	0	0	0	111.5	R32 M69 H70 E72	R32-F107 HydrophobicContact CB-CB 3.93Å; R32-F107 HydrophobicContact CG-CB 4.14Å; R32-F107 HydrophobicContact CG-CD1 4.01Å; R32-F107 HydrophobicContact CG-CG 4.38Å; M69-F107 PolarHBondContact SD-N 3.42Å; M69-F107 VanDerWaalsContact SD-N 3.42Å; M69-F107 VanDerWaalsContact SD-O 3.37Å; H70-F107 WeakPolarHBondContact CA-O 2.96Å; H70-F107 HydrophobicContact CB-CD1 4.44Å; H70-F107 HydrophobicContact CB-CD2 4.01Å; H70-F107 HydrophobicContact CB-CE1 4.2Å; H70-F107 HydrophobicContact CB-CE2 3.72Å; H70-F107 HydrophobicContact CB-CG 4.37Å; H70-F107 HydrophobicContact CB-CZ 3.83Å; H70-F107 WeakPolarHBondContact CB-O 3.4Å; H70-F107 AromaticContact CD2-CE1 3.39Å; H70-F107 WeakPolarHBondContact CD2-CE1 3.39Å; H70-F107 AromaticContact CD2-CE2 3.87Å; H70-F107 AromaticContact CD2-CZ 3.1Å; H70-F107 WeakPolarHBondContact CD2-CZ 3.37Å; H70-F107 AromaticContact CG-CE2 3.85Å; H70-F107 AromaticContact CG-CZ 3.57Å; H70-F107 PolarHBondContact N-O 2.92Å; H70-F107 AromaticContact NE2-CZ 3.91Å; H70-F107 PolarHBondContact O-N 3.31Å; E72-F107 HydrophobicContact CB-CE1 4.25Å
108	S	86.8	Confident	81.7	Confident	3 Å²	3	59.7 Å²	59.7	2%	0.021	34%	0.34	C	S	.	.			trans	-95.2	131.8	173.4	-163.3	0	0	0	0	110.2	G68 T110	G68-S108 PolarHBondContact O-OG 3.39Å; S108-T110 VanDerWaalsContact C-N 3.32Å; S108-T110 WeakPolarHBondContact OG-CG2 3.39Å
109	N	76.3	Confident	81.5	Confident	140 Å²	140	56.6 Å²	56.6	75%	0.749	33%	0.327	S	S	*	.			trans	-88.7	-2.2	175.3	-161.8	20.4	0	0	0	112.5
110	T	71.4	Confident	81.3	Confident	40 Å²	40	55.9 Å²	55.9	25%	0.245	32%	0.315	C	S	.	.			trans	-95.4	130.6	177.9	-173.3	0	0	0	0	110.7	I67 S108 H112 W113	I67-T110 HydrophobicContact CG2-CG2 3.95Å; S108-T110 VanDerWaalsContact C-N 3.32Å; S108-T110 WeakPolarHBondContact OG-CG2 3.39Å; T110-H112 VanDerWaalsContact C-N 3.35Å; T110-H112 WeakPolarHBondContact OG1-CB 3.46Å; T110-H112 PolarHBondContact OG1-N 2.93Å; T110-W113 HydrophobicContact CG2-CE3 4.49Å
111	S	66.5	Low	81.2	Confident	70 Å²	70	55.6 Å²	55.6	49%	0.49	31%	0.312	S	S	.	.			trans	-96	10.3	168.3	63.2	0	0	0	0	112
112	H	60.8	Low	81.1	Confident	171 Å²	171	52.8 Å²	52.8	79%	0.792	30%	0.301	S	S	*	.			trans	-94.6	10.6	-169	-69.9	-73.8	0	0	0	114.8	T110	T110-H112 VanDerWaalsContact C-N 3.35Å; T110-H112 WeakPolarHBondContact OG1-CB 3.46Å; T110-H112 PolarHBondContact OG1-N 2.93Å
113	W	69	Low	80.9	Confident	23 Å²	23	54 Å²	54	9%	0.087	31%	0.307	C	S	.	.	S	Bend	trans	-85.7	164.9	171	66.9	35.6	0	0	0	110.9	G28 E29 I67 T110 S115 T117 L119	G28-W113 VanDerWaalsContact C-CZ2 3.49Å; G28-W113 WeakPolarHBondContact O-CZ2 3.34Å; E29-W113 HydrophobicContact CB-CZ2 4.26Å; E29-W113 PolarHBondContact OE1-NE1 3.04Å; I67-W113 HydrophobicContact CD1-CB 4.01Å; I67-W113 HydrophobicContact CD1-CD2 4.36Å; I67-W113 HydrophobicContact CD1-CE3 3.64Å; I67-W113 HydrophobicContact CG1-CE3 4.41Å; I67-W113 HydrophobicContact CG2-CE3 3.64Å; I67-W113 HydrophobicContact CG2-CZ3 3.69Å; T110-W113 HydrophobicContact CG2-CE3 4.49Å; W113-S115 PolarHBondContact O-N 3.33Å; W113-T117 PolarHBondContact NE1-O 2.88Å; W113-L119 HydrophobicContact CD2-CG 4.42Å; W113-L119 HydrophobicContact CE3-CD1 3.75Å; W113-L119 HydrophobicContact CE3-CD2 4.18Å; W113-L119 HydrophobicContact CE3-CG 3.82Å; W113-L119 HydrophobicContact CH2-CB 4.18Å; W113-L119 HydrophobicContact CH2-CD1 3.23Å; W113-L119 HydrophobicContact CH2-CG 3.35Å; W113-L119 HydrophobicContact CZ2-CD1 4.3Å; W113-L119 HydrophobicContact CZ2-CG 3.97Å; W113-L119 HydrophobicContact CZ3-CD1 2.91Å; W113-L119 HydrophobicContact CZ3-CD2 4.13Å; W113-L119 HydrophobicContact CZ3-CG 3.31Å
114	I	60.7	Low	80.7	Confident	130 Å²	130	56.2 Å²	56.2	67%	0.667	32%	0.318	S	S	*	.			trans	-57.8	117.8	-173	-62.7	163.3	0	0	0	109.2	G116 T117	I114-G116 PolarHBondContact O-N 3.45Å; I114-T117 HydrophobicContact CB-CG2 3.94Å; I114-T117 HydrophobicContact CG2-CG2 3.98Å; I114-T117 PolarHBondContact O-N 2.71Å; I114-T117 PolarHBondContact O-OG1 3.01Å
115	S	60.4	Low	80.6	Confident	110 Å²	110	58.3 Å²	58.3	77%	0.769	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.4	113.6	-178.9	-166.4	0	0	0	0	110.8	E29 W113	E29-S115 VanDerWaalsContact OE1-CA 3.32Å; E29-S115 WeakPolarHBondContact OE1-CA 3.42Å; W113-S115 PolarHBondContact O-N 3.33Å
116	G	65.8	Low	80.4	Confident	70 Å²	70	61.3 Å²	61.3	72%	0.722	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.2	-1.3	179.6	0	0	0	0	0	116.4	I114	I114-G116 PolarHBondContact O-N 3.45Å
117	T	76.3	Confident	80.2	Confident	53 Å²	53	63 Å²	63	33%	0.325	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-86.2	129.9	171.8	56.8	0	0	0	0	110.9	W113 I114	W113-T117 PolarHBondContact NE1-O 2.88Å; I114-T117 HydrophobicContact CB-CG2 3.94Å; I114-T117 HydrophobicContact CG2-CG2 3.98Å; I114-T117 PolarHBondContact O-N 2.71Å; I114-T117 PolarHBondContact O-OG1 3.01Å
118	M	81.8	Confident	80.1	Confident	115 Å²	115	61.4 Å²	61.4	57%	0.567	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-91.4	138.2	174.8	-65.9	-178.3	178.1	0	0	110	L26	L26-M118 HydrophobicContact CB-CB 4.17Å; L26-M118 HydrophobicContact CB-SD 3.98Å; L26-M118 HydrophobicContact CD1-SD 3.83Å; L26-M118 HydrophobicContact CD2-CB 4.23Å; L26-M118 HydrophobicContact CG-SD 4.47Å
119	L	87.1	Confident	79.8	Confident	2 Å²	2	62 Å²	62	1%	0.01	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	135.8	168.4	-72	-173	0	0	0	111	L26 I27 V51 M53 A64 I67 M69 W113 V121	L26-L119 CarbonylContact C-O 3.57Å; L26-L119 WeakPolarHBondContact CA-O 3.26Å; I27-L119 PolarHBondContact N-O 3.45Å; I27-L119 PolarHBondContact O-N 3.22Å; V51-L119 HydrophobicContact CG1-CB 4.16Å; V51-L119 HydrophobicContact CG1-CD1 3.41Å; V51-L119 VanDerWaalsContact CG1-CD1 3.41Å; V51-L119 HydrophobicContact CG1-CD2 3.82Å; V51-L119 HydrophobicContact CG1-CG 4.02Å; M53-L119 HydrophobicContact CB-CD2 4.11Å; A64-L119 HydrophobicContact CB-CD2 4.16Å; I67-L119 HydrophobicContact CD1-CD2 4.01Å; I67-L119 HydrophobicContact CG2-CD1 4.08Å; M69-L119 HydrophobicContact CE-CD1 4.12Å; W113-L119 HydrophobicContact CD2-CG 4.42Å; W113-L119 HydrophobicContact CE3-CD1 3.75Å; W113-L119 HydrophobicContact CE3-CD2 4.18Å; W113-L119 HydrophobicContact CE3-CG 3.82Å; W113-L119 HydrophobicContact CH2-CB 4.18Å; W113-L119 HydrophobicContact CH2-CD1 3.23Å; W113-L119 HydrophobicContact CH2-CG 3.35Å; W113-L119 HydrophobicContact CZ2-CD1 4.3Å; W113-L119 HydrophobicContact CZ2-CG 3.97Å; W113-L119 HydrophobicContact CZ3-CD1 2.91Å; W113-L119 HydrophobicContact CZ3-CD2 4.13Å; W113-L119 HydrophobicContact CZ3-CG 3.31Å; L119-V121 HydrophobicContact CB-CG2 4.47Å
120	R	89.1	Confident	80.1	Confident	53 Å²	53	61.5 Å²	61.5	20%	0.2	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	122	166	174.6	-177.7	173.4	118.8	6.8	108.9	F24 L26 S52 D122	F24-R120 HydrophobicContact CB-CG 4.14Å; F24-R120 HydrophobicContact CD2-CG 3.93Å; F24-R120 VanDerWaalsContact CE1-NH1 3.34Å; F24-R120 HydrophobicContact CG-CG 4.31Å; F24-R120 VanDerWaalsContact CZ-NH1 3.34Å; L26-R120 HydrophobicContact CD2-CB 4.02Å; S52-R120 PolarHBondContact N-O 3.41Å; S52-R120 PolarHBondContact O-N 2.93Å; S52-R120 WeakPolarHBondContact OG-CB 3.37Å; S52-R120 PolarHBondContact OG-O 3.42Å; R120-D122 IonicContact CZ-OD1 3.32Å; R120-D122 IonicContact NE-OD1 3.08Å; R120-D122 PolarHBondContact NE-OD1 3Å; R120-D122 IonicContact NE-OD2 2.67Å; R120-D122 IonicContact NH2-OD1 3.11Å; R120-D122 PolarHBondContact NH2-OD1 3.45Å; R120-D122 VanDerWaalsContact NH2-OD1 3.12Å
121	V	91.2	Very high	80.5	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	119.4	176.6	-175.9	0	0	0	0	109.1	F24 F25 I27 Y49 K50 V51 M69 L106 L119	F24-V121 WeakPolarHBondContact CA-O 3.5Å; F25-V121 HydrophobicContact CD1-CB 4.39Å; F25-V121 WeakPolarHBondContact CD1-O 3.3Å; F25-V121 HydrophobicContact CD2-CB 4.4Å; F25-V121 HydrophobicContact CE1-CB 3.91Å; F25-V121 HydrophobicContact CE1-CG1 3.82Å; F25-V121 HydrophobicContact CE2-CB 3.97Å; F25-V121 HydrophobicContact CE2-CG1 4.32Å; F25-V121 HydrophobicContact CE2-CG2 4.48Å; F25-V121 HydrophobicContact CZ-CB 3.68Å; F25-V121 HydrophobicContact CZ-CG1 3.59Å; F25-V121 PolarHBondContact N-O 3.48Å; F25-V121 PolarHBondContact O-N 2.84Å; I27-V121 HydrophobicContact CD1-CB 4.21Å; I27-V121 HydrophobicContact CD1-CG2 3.47Å; I27-V121 VanDerWaalsContact CD1-CG2 3.47Å; I27-V121 HydrophobicContact CG1-CG2 3.84Å; Y49-V121 HydrophobicContact CD2-CG1 4.46Å; K50-V121 WeakPolarHBondContact O-CA 3.42Å; V51-V121 HydrophobicContact CG2-CG2 4.1Å; M69-V121 HydrophobicContact CE-CG2 4.13Å; L106-V121 HydrophobicContact CD2-CG1 4.45Å; L119-V121 HydrophobicContact CB-CG2 4.47Å
122	D	91.8	Very high	81.2	Confident	48 Å²	48	59.5 Å²	59.5	26%	0.257	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	111.7	171.5	-56.9	-87.6	0	0	0	106.7	F24 Y49 K50 R120	F24-D122 WeakPolarHBondContact CB-OD1 3.37Å; Y49-D122 CarbonylContact C-O 3.54Å; Y49-D122 WeakPolarHBondContact CA-O 3.44Å; K50-D122 PolarHBondContact N-O 2.94Å; K50-D122 PolarHBondContact O-N 3.47Å; R120-D122 IonicContact CZ-OD1 3.32Å; R120-D122 IonicContact NE-OD1 3.08Å; R120-D122 PolarHBondContact NE-OD1 3Å; R120-D122 IonicContact NE-OD2 2.67Å; R120-D122 IonicContact NH2-OD1 3.11Å; R120-D122 PolarHBondContact NH2-OD1 3.45Å; R120-D122 VanDerWaalsContact NH2-OD1 3.12Å
123	L	92.1	Very high	82.3	Confident	26 Å²	26	55.5 Å²	55.5	14%	0.136	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	128.9	-177.8	175.1	68.8	0	0	0	109.7	F25 F35 L106	F25-L123 HydrophobicContact CE1-CB 3.76Å; F25-L123 HydrophobicContact CE1-CD2 4.28Å; F35-L123 HydrophobicContact CD2-CD2 3.61Å; F35-L123 HydrophobicContact CE2-CD2 3.62Å; F35-L123 HydrophobicContact CG-CD2 4.18Å; F35-L123 HydrophobicContact CZ-CD2 4.19Å; L106-L123 HydrophobicContact CD1-CD1 4.42Å; L106-L123 HydrophobicContact CD1-CD2 4.03Å; L106-L123 HydrophobicContact CD2-CD1 4.46Å
124	N	92.2	Very high	83.1	Confident	82 Å²	82	55.9 Å²	55.9	44%	0.439	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	112.2	174	-177.7	-3.9	0	0	0	109	G47 S48	G47-N124 CarbonylContact C-O 3.54Å; G47-N124 WeakPolarHBondContact CA-O 3.41Å; S48-N124 PolarHBondContact N-O 2.84Å; S48-N124 PolarHBondContact O-N 2.94Å
125	L	92	Very high	84.3	Confident	46 Å²	46	52.9 Å²	52.9	24%	0.241	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	124.6	177.8	-165.4	69.6	0	0	0	109.7	E37 V45 I104 V127	E37-L125 HydrophobicContact CG-CD2 3.57Å; V45-L125 HydrophobicContact CG1-CD1 3.36Å; V45-L125 HydrophobicContact CG1-CD2 4.35Å; V45-L125 HydrophobicContact CG1-CG 3.84Å; I104-L125 HydrophobicContact CD1-CD2 4.19Å; L125-V127 HydrophobicContact CD2-CG2 4.49Å; L125-V127 HydrophobicContact CG-CG2 4.41Å
126	Q	91.9	Very high	85.5	Confident	65 Å²	65	53.9 Å²	53.9	30%	0.304	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	126.6	178.1	-64.7	171.2	14	0	0	108.1	V45 I46 H130 A131	V45-Q126 CarbonylContact C-O 3.57Å; V45-Q126 WeakPolarHBondContact CA-O 3.31Å; I46-Q126 PolarHBondContact N-O 3.02Å; I46-Q126 PolarHBondContact O-N 3.37Å; Q126-H130 HydrophobicContact CB-CB 4.23Å; Q126-H130 PolarHBondContact OE1-O 3.49Å; Q126-A131 HydrophobicContact CB-CB 4.42Å
127	V	90.7	Very high	86.5	Confident	34 Å²	34	52 Å²	52	21%	0.206	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	137.8	-176.3	-179.6	0	0	0	0	108.5	I39 T43 V45 L125 D129	I39-V127 HydrophobicContact CG2-CG1 4.32Å; T43-V127 HydrophobicContact CG2-CG1 3.71Å; V45-V127 HydrophobicContact CG1-CG2 4.18Å; V45-V127 HydrophobicContact CG2-CB 4.28Å; V45-V127 HydrophobicContact CG2-CG1 4Å; V45-V127 HydrophobicContact CG2-CG2 3.95Å; L125-V127 HydrophobicContact CD2-CG2 4.49Å; L125-V127 HydrophobicContact CG-CG2 4.41Å; V127-D129 PolarHBondContact O-N 3.36Å
128	G	87.5	Confident	86.9	Confident	8 Å²	8	50.3 Å²	50.3	8%	0.082	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	70	-126.1	171.2	0	0	0	0	0	114.1	M44 H130 A131	M44-G128 PolarHBondContact O-N 3.12Å; G128-H130 PolarHBondContact O-N 3.23Å; G128-A131 WeakPolarHBondContact O-CB 3.4Å; G128-A131 PolarHBondContact O-N 3.49Å
129	D	82.4	Confident	87.2	Confident	17 Å²	17	50.6 Å²	50.6	9%	0.091	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-62	-31.7	-177.4	72.5	-46.9	0	0	0	112.5	V127 A131 Q132 Q156	V127-D129 PolarHBondContact O-N 3.36Å; D129-A131 PolarHBondContact O-N 3.2Å; D129-Q132 PolarHBondContact O-N 2.93Å; D129-Q156 HydrophobicContact CB-CG 4.31Å; D129-Q156 WeakPolarHBondContact OD2-CG 3.28Å
130	H	82	Confident	87.4	Confident	128 Å²	128	58.5 Å²	58.5	59%	0.593	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-68.5	-21.6	175.5	-66.1	-45.9	0	0	0	113.5	Q126 G128 Q132	Q126-H130 HydrophobicContact CB-CB 4.23Å; Q126-H130 PolarHBondContact OE1-O 3.49Å; G128-H130 PolarHBondContact O-N 3.23Å; H130-Q132 VanDerWaalsContact C-N 3.31Å
131	A	78.6	Confident	87.4	Confident	7 Å²	7	61.2 Å²	61.2	6%	0.058	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-79.7	-12	175.7	0	0	0	0	0	112.9	M44 I46 Q126 G128 D129	M44-A131 HydrophobicContact CG-CB 4.47Å; I46-A131 HydrophobicContact CB-CB 4.19Å; I46-A131 HydrophobicContact CD1-CB 3.94Å; I46-A131 WeakPolarHBondContact CD1-O 3.44Å; I46-A131 HydrophobicContact CG1-CB 3.87Å; Q126-A131 HydrophobicContact CB-CB 4.42Å; G128-A131 WeakPolarHBondContact O-CB 3.4Å; G128-A131 PolarHBondContact O-N 3.49Å; D129-A131 PolarHBondContact O-N 3.2Å
132	Q	81	Confident	87.2	Confident	61 Å²	61	71.9 Å²	71.9	29%	0.285	36%	0.36	S	S	.	.			trans	-84	129.6	-177.5	-65.7	-164.6	75.1	0	0	112.2	D129 H130 Y134 I137 D155	D129-Q132 PolarHBondContact O-N 2.93Å; H130-Q132 VanDerWaalsContact C-N 3.31Å; Q132-Y134 HydrophobicContact CB-CE1 4.43Å; Q132-Y134 HydrophobicContact CB-CE2 4.17Å; Q132-Y134 WeakPolarHBondContact O-CD2 3.45Å; Q132-Y134 PolarHBondContact O-N 3.44Å; Q132-I137 HydrophobicContact CB-CD1 4.35Å; Q132-D155 VanDerWaalsContact NE2-CG 3.29Å; Q132-D155 PolarHBondContact NE2-OD2 2.77Å
133	D	84.8	Confident	86.9	Confident	87 Å²	87	71.6 Å²	71.6	47%	0.465	36%	0.359	S	S	.	.			trans	-85.1	89.2	170.8	-167.1	-24.3	0	0	0	110.3	A135 E136 I137	D133-A135 PolarHBondContact O-N 3.37Å; D133-A135 WeakPolarHBondContact OD1-CB 3.46Å; D133-A135 PolarHBondContact OD1-N 3.44Å; D133-E136 HydrophobicContact CB-CB 4.11Å; D133-E136 PolarHBondContact O-N 3Å; D133-E136 PolarHBondContact OD1-N 3.4Å; D133-E136 VanDerWaalsContact OD1-N 3.16Å; D133-I137 WeakPolarHBondContact O-CG1 3.31Å; D133-I137 PolarHBondContact O-N 2.76Å; D133-I137 VanDerWaalsContact O-N 3.07Å
134	Y	85.9	Confident	86.9	Confident	32 Å²	32	75.5 Å²	75.5	13%	0.125	38%	0.38	C	S	.	.	H	α-helix	trans	-61.5	-25	178	-66.9	-73.3	0	0	0	113.3	Q132 A138 L148 Q152	Q132-Y134 HydrophobicContact CB-CE1 4.43Å; Q132-Y134 HydrophobicContact CB-CE2 4.17Å; Q132-Y134 WeakPolarHBondContact O-CD2 3.45Å; Q132-Y134 PolarHBondContact O-N 3.44Å; Y134-A138 VanDerWaalsContact O-CB 3.25Å; Y134-A138 WeakPolarHBondContact O-CB 3.35Å; Y134-A138 PolarHBondContact O-N 2.91Å; Y134-L148 HydrophobicContact CD1-CD1 4.4Å; Y134-Q152 HydrophobicContact CD1-CG 3.35Å; Y134-Q152 HydrophobicContact CD2-CG 3.95Å; Y134-Q152 HydrophobicContact CE1-CB 4.16Å; Y134-Q152 HydrophobicContact CE1-CG 3.4Å; Y134-Q152 VanDerWaalsContact CE1-CG 3.4Å; Y134-Q152 HydrophobicContact CE2-CG 3.99Å; Y134-Q152 HydrophobicContact CG-CG 3.63Å
135	A	85.6	Confident	86.9	Confident	66 Å²	66	77.5 Å²	77.5	55%	0.545	39%	0.391	S	S	.	.	H	α-helix	trans	-71	-41.8	177.1	0	0	0	0	0	110.7	D133 A138 V139	D133-A135 PolarHBondContact O-N 3.37Å; D133-A135 WeakPolarHBondContact OD1-CB 3.46Å; D133-A135 PolarHBondContact OD1-N 3.44Å; A135-A138 PolarHBondContact O-N 2.87Å; A135-V139 WeakPolarHBondContact O-CG2 3.49Å; A135-V139 PolarHBondContact O-N 3.45Å
136	E	86.2	Confident	86.9	Confident	131 Å²	131	81 Å²	81	61%	0.612	41%	0.409	S	S	*	.	H	α-helix	trans	-64.1	-44.2	173.6	-169.8	-179.1	165.8	0	0	111.5	D133 A138 V139 K140	D133-E136 HydrophobicContact CB-CB 4.11Å; D133-E136 PolarHBondContact O-N 3Å; D133-E136 PolarHBondContact OD1-N 3.4Å; D133-E136 VanDerWaalsContact OD1-N 3.16Å; E136-A138 PolarHBondContact O-N 3.3Å; E136-V139 PolarHBondContact O-N 2.74Å; E136-K140 WeakPolarHBondContact O-CB 3.49Å; E136-K140 PolarHBondContact O-N 2.85Å
137	I	85.6	Confident	86.9	Confident	30 Å²	30	83 Å²	83	15%	0.154	42%	0.418	C	S	.	.	H	α-helix	trans	-61.6	-45	178.1	-64.1	167	0	0	0	110.7	Q132 D133 V139 K140 E141 L143	Q132-I137 HydrophobicContact CB-CD1 4.35Å; D133-I137 WeakPolarHBondContact O-CG1 3.31Å; D133-I137 PolarHBondContact O-N 2.76Å; D133-I137 VanDerWaalsContact O-N 3.07Å; I137-V139 VanDerWaalsContact C-N 3.31Å; I137-V139 PolarHBondContact O-N 2.94Å; I137-K140 PolarHBondContact O-N 2.82Å; I137-E141 HydrophobicContact CG2-CG 4.43Å; I137-E141 WeakPolarHBondContact O-CB 3.26Å; I137-E141 PolarHBondContact O-N 2.97Å; I137-L143 HydrophobicContact CG2-CD1 4.19Å
138	A	85.4	Confident	86.9	Confident	19 Å²	19	82.7 Å²	82.7	16%	0.157	42%	0.415	C	S	.	.	H	α-helix	trans	-57.4	-42.9	178.3	0	0	0	0	0	112.4	Y134 A135 E136 R142 L143 L148	Y134-A138 VanDerWaalsContact O-CB 3.25Å; Y134-A138 WeakPolarHBondContact O-CB 3.35Å; Y134-A138 PolarHBondContact O-N 2.91Å; A135-A138 PolarHBondContact O-N 2.87Å; E136-A138 PolarHBondContact O-N 3.3Å; A138-R142 VanDerWaalsContact O-CA 3.22Å; A138-R142 WeakPolarHBondContact O-CA 3.17Å; A138-R142 PolarHBondContact O-N 3.41Å; A138-L143 PolarHBondContact O-N 3.2Å; A138-L143 VanDerWaalsContact O-N 3.12Å; A138-L148 HydrophobicContact CB-CD1 3.85Å; A138-L148 HydrophobicContact CB-CD2 3.84Å; A138-L148 HydrophobicContact CB-CG 4.38Å
139	V	88.7	Confident	87.1	Confident	120 Å²	120	90.4 Å²	90.4	73%	0.727	44%	0.442	S	S	*	.	H	α-helix	trans	-70.1	-43.8	178.6	174.3	0	0	0	0	111.3	A135 E136 I137	A135-V139 WeakPolarHBondContact O-CG2 3.49Å; A135-V139 PolarHBondContact O-N 3.45Å; E136-V139 PolarHBondContact O-N 2.74Å; I137-V139 VanDerWaalsContact C-N 3.31Å; I137-V139 PolarHBondContact O-N 2.94Å
140	K	90.1	Very high	87.7	Confident	169 Å²	169	93.7 Å²	93.7	74%	0.735	46%	0.459	S	S	*	.	H	α-helix	trans	-67.1	-43.6	-177.4	-175.5	-179.5	177.9	-175.5	0	112.4	E136 I137	E136-K140 WeakPolarHBondContact O-CB 3.49Å; E136-K140 PolarHBondContact O-N 2.85Å; I137-K140 PolarHBondContact O-N 2.82Å
141	E	89.3	Confident	88.1	Confident	109 Å²	109	91.6 Å²	91.6	51%	0.509	45%	0.445	S	S	.	.	H	α-helix	trans	-92.4	-5.1	-178	-67.4	-176.4	-177.6	0	0	113	I137 L143	I137-E141 HydrophobicContact CG2-CG 4.43Å; I137-E141 WeakPolarHBondContact O-CB 3.26Å; I137-E141 PolarHBondContact O-N 2.97Å; E141-L143 VanDerWaalsContact C-N 3.25Å; E141-L143 HydrophobicContact CB-CD1 4.2Å; E141-L143 HydrophobicContact CB-CD2 3.99Å; E141-L143 HydrophobicContact CB-CG 3.73Å; E141-L143 PolarHBondContact O-N 2.84Å
142	R	87.1	Confident	88.7	Confident	224 Å²	224	94 Å²	94	85%	0.845	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	40.8	-177.6	-56	-179.2	178.1	176.5	-0.5	112.6	A138	A138-R142 VanDerWaalsContact O-CA 3.22Å; A138-R142 WeakPolarHBondContact O-CA 3.17Å; A138-R142 PolarHBondContact O-N 3.41Å
143	L	86.5	Confident	89.3	Confident	42 Å²	42	96 Å²	96	22%	0.22	47%	0.468	C	S	.	.			trans	-71.4	139.6	-179	-59.4	175	0	0	0	110.3	I137 A138 E141 E147 L148	I137-L143 HydrophobicContact CG2-CD1 4.19Å; A138-L143 PolarHBondContact O-N 3.2Å; A138-L143 VanDerWaalsContact O-N 3.12Å; E141-L143 VanDerWaalsContact C-N 3.25Å; E141-L143 HydrophobicContact CB-CD1 4.2Å; E141-L143 HydrophobicContact CB-CD2 3.99Å; E141-L143 HydrophobicContact CB-CG 3.73Å; E141-L143 PolarHBondContact O-N 2.84Å; L143-E147 HydrophobicContact CB-CB 4.2Å; L143-E147 HydrophobicContact CD2-CB 4.28Å; L143-L148 HydrophobicContact CB-CB 4.45Å; L143-L148 HydrophobicContact CD1-CD1 4.18Å
144	N	91.8	Very high	89.7	Confident	109 Å²	109	96.4 Å²	96.4	58%	0.583	47%	0.469	S	S	*	.			trans	-72.5	161.1	168.3	-159.8	-0.2	0	0	0	110.6	L146 E147 L148	N144-L146 PolarHBondContact O-N 2.95Å; N144-L146 VanDerWaalsContact O-N 3.09Å; N144-E147 HydrophobicContact CB-CG 4.33Å; N144-E147 PolarHBondContact N-OE2 3.28Å; N144-E147 PolarHBondContact O-N 3.02Å; N144-L148 PolarHBondContact O-N 3.49Å
145	D	91.2	Very high	90	Very high	124 Å²	124	95.6 Å²	95.6	66%	0.663	47%	0.467	S	S	*	.	H	α-helix	trans	-55.3	-35.4	-177.3	-76	-23.3	0	0	0	112.8	R149	D145-R149 VanDerWaalsContact O-CG 3.31Å; D145-R149 WeakPolarHBondContact O-CG 3.22Å; D145-R149 PolarHBondContact O-N 2.84Å
146	L	92.1	Very high	90.3	Very high	119 Å²	119	95.8 Å²	95.8	62%	0.623	46%	0.456	S	S	*	.	H	α-helix	trans	-72.4	-42.7	177.3	-174.6	65.8	0	0	0	112	N144 L148 R149 I150	N144-L146 PolarHBondContact O-N 2.95Å; N144-L146 VanDerWaalsContact O-N 3.09Å; L146-L148 VanDerWaalsContact C-N 3.33Å; L146-R149 PolarHBondContact O-N 3.37Å; L146-I150 HydrophobicContact CG-CD1 4.14Å; L146-I150 WeakPolarHBondContact O-CG1 3.39Å; L146-I150 PolarHBondContact O-N 3.06Å
147	E	92.1	Very high	90.7	Very high	106 Å²	106	93.7 Å²	93.7	50%	0.495	45%	0.452	S	S	.	.	H	α-helix	trans	-65	-40	178.8	-66.5	172.9	151.4	0	0	110.7	L143 N144 R149 I150 R151	L143-E147 HydrophobicContact CB-CB 4.2Å; L143-E147 HydrophobicContact CD2-CB 4.28Å; N144-E147 HydrophobicContact CB-CG 4.33Å; N144-E147 PolarHBondContact N-OE2 3.28Å; N144-E147 PolarHBondContact O-N 3.02Å; E147-R149 PolarHBondContact O-N 3.3Å; E147-I150 PolarHBondContact O-N 2.81Å; E147-R151 WeakPolarHBondContact O-CB 3.43Å; E147-R151 PolarHBondContact O-N 3.12Å
148	L	91.4	Very high	91	Very high	28 Å²	28	95.8 Å²	95.8	15%	0.147	46%	0.463	C	S	.	.	H	α-helix	trans	-59.7	-45.8	174.7	-175.5	62.8	0	0	0	111.9	Y134 A138 L143 N144 L146 I150 R151 Q152	Y134-L148 HydrophobicContact CD1-CD1 4.4Å; A138-L148 HydrophobicContact CB-CD1 3.85Å; A138-L148 HydrophobicContact CB-CD2 3.84Å; A138-L148 HydrophobicContact CB-CG 4.38Å; L143-L148 HydrophobicContact CB-CB 4.45Å; L143-L148 HydrophobicContact CD1-CD1 4.18Å; N144-L148 PolarHBondContact O-N 3.49Å; L146-L148 VanDerWaalsContact C-N 3.33Å; L148-I150 PolarHBondContact O-N 2.96Å; L148-R151 WeakPolarHBondContact O-CB 3.35Å; L148-R151 PolarHBondContact O-N 3.04Å; L148-Q152 WeakPolarHBondContact O-CG 3.33Å; L148-Q152 PolarHBondContact O-N 2.94Å
149	R	91.7	Very high	91.2	Very high	170 Å²	170	95.4 Å²	95.4	64%	0.642	46%	0.459	S	S	*	.	H	α-helix	trans	-64.2	-39.6	177.2	-73.1	174.8	-175.6	-133.3	2.7	112.2	D145 L146 E147 Q152 L153	D145-R149 VanDerWaalsContact O-CG 3.31Å; D145-R149 WeakPolarHBondContact O-CG 3.22Å; D145-R149 PolarHBondContact O-N 2.84Å; L146-R149 PolarHBondContact O-N 3.37Å; E147-R149 PolarHBondContact O-N 3.3Å; R149-Q152 PolarHBondContact O-N 3.41Å; R149-L153 WeakPolarHBondContact O-CG 3.42Å; R149-L153 PolarHBondContact O-N 2.91Å
150	I	94	Very high	91.4	Very high	87 Å²	87	94.8 Å²	94.8	45%	0.446	45%	0.449	S	S	.	.	H	α-helix	trans	-64	-43.6	175	-69.2	167.4	0	0	0	110.1	L146 E147 L148 Q152 L153 I154	L146-I150 HydrophobicContact CG-CD1 4.14Å; L146-I150 WeakPolarHBondContact O-CG1 3.39Å; L146-I150 PolarHBondContact O-N 3.06Å; E147-I150 PolarHBondContact O-N 2.81Å; L148-I150 PolarHBondContact O-N 2.96Å; I150-Q152 PolarHBondContact O-N 3.01Å; I150-L153 PolarHBondContact O-N 2.93Å; I150-I154 HydrophobicContact CG2-CD1 3.78Å; I150-I154 HydrophobicContact CG2-CG1 4.41Å; I150-I154 VanDerWaalsContact O-CG1 3.32Å; I150-I154 WeakPolarHBondContact O-CG1 3.34Å; I150-I154 PolarHBondContact O-N 3.29Å
151	R	90.8	Very high	91.6	Very high	83 Å²	83	89.5 Å²	89.5	31%	0.313	43%	0.431	S	S	.	.	H	α-helix	trans	-58.9	-47.1	176.4	-174.6	75.6	-172.5	98.4	18.9	111.6	E147 L148 L153 I154 D155	E147-R151 WeakPolarHBondContact O-CB 3.43Å; E147-R151 PolarHBondContact O-N 3.12Å; L148-R151 WeakPolarHBondContact O-CB 3.35Å; L148-R151 PolarHBondContact O-N 3.04Å; R151-L153 VanDerWaalsContact C-N 3.35Å; R151-L153 PolarHBondContact O-N 2.95Å; R151-I154 PolarHBondContact O-N 3.04Å; R151-D155 IonicContact CZ-OD1 2.88Å; R151-D155 IonicContact CZ-OD2 3.55Å; R151-D155 IonicContact NE-OD2 3.92Å; R151-D155 IonicContact NH1-OD1 3.51Å; R151-D155 PolarHBondContact NH1-OD1 3.31Å; R151-D155 IonicContact NH1-OD2 2.65Å; R151-D155 IonicContact NH2-OD1 3.87Å; R151-D155 PolarHBondContact NH2-OD1 2.82Å; R151-D155 IonicContact NH2-OD2 3.05Å; R151-D155 PolarHBondContact NH2-OD2 2.97Å; R151-D155 VanDerWaalsContact NH2-OD2 3.11Å; R151-D155 PolarHBondContact O-N 2.86Å
152	Q	91.7	Very high	91.6	Very high	58 Å²	58	87 Å²	87	27%	0.271	42%	0.418	S	S	.	.	H	α-helix	trans	-55.9	-46.6	175	-76.6	173.3	-18	0	0	112.2	Y134 L148 R149 I150 D155 Q156	Y134-Q152 HydrophobicContact CD1-CG 3.35Å; Y134-Q152 HydrophobicContact CD2-CG 3.95Å; Y134-Q152 HydrophobicContact CE1-CB 4.16Å; Y134-Q152 HydrophobicContact CE1-CG 3.4Å; Y134-Q152 VanDerWaalsContact CE1-CG 3.4Å; Y134-Q152 HydrophobicContact CE2-CG 3.99Å; Y134-Q152 HydrophobicContact CG-CG 3.63Å; L148-Q152 WeakPolarHBondContact O-CG 3.33Å; L148-Q152 PolarHBondContact O-N 2.94Å; R149-Q152 PolarHBondContact O-N 3.41Å; I150-Q152 PolarHBondContact O-N 3.01Å; Q152-D155 PolarHBondContact O-N 3.19Å; Q152-Q156 WeakPolarHBondContact O-CB 3.2Å; Q152-Q156 WeakPolarHBondContact O-CG 3.2Å; Q152-Q156 PolarHBondContact O-N 2.78Å
153	L	93.7	Very high	91.8	Very high	104 Å²	104	80.6 Å²	80.6	55%	0.545	40%	0.398	S	S	.	.	H	α-helix	trans	-65.3	-38.9	178.3	-72.7	169.2	0	0	0	112.3	R149 I150 R151 Q156 V157	R149-L153 WeakPolarHBondContact O-CG 3.42Å; R149-L153 PolarHBondContact O-N 2.91Å; I150-L153 PolarHBondContact O-N 2.93Å; R151-L153 VanDerWaalsContact C-N 3.35Å; R151-L153 PolarHBondContact O-N 2.95Å; L153-Q156 PolarHBondContact O-N 2.9Å; L153-V157 WeakPolarHBondContact O-CB 3.3Å; L153-V157 VanDerWaalsContact O-CG2 3.26Å; L153-V157 WeakPolarHBondContact O-CG2 3.28Å; L153-V157 PolarHBondContact O-N 3.01Å
154	I	93.2	Very high	92.1	Very high	94 Å²	94	83.6 Å²	83.6	48%	0.482	41%	0.411	S	S	.	.	H	α-helix	trans	-63.6	-46.4	176.6	-70.2	167.3	0	0	0	110.4	I150 R151 Q156 V157 D158	I150-I154 HydrophobicContact CG2-CD1 3.78Å; I150-I154 HydrophobicContact CG2-CG1 4.41Å; I150-I154 VanDerWaalsContact O-CG1 3.32Å; I150-I154 WeakPolarHBondContact O-CG1 3.34Å; I150-I154 PolarHBondContact O-N 3.29Å; R151-I154 PolarHBondContact O-N 3.04Å; I154-Q156 VanDerWaalsContact C-N 3.35Å; I154-Q156 PolarHBondContact O-N 2.82Å; I154-V157 PolarHBondContact O-N 2.92Å; I154-D158 WeakPolarHBondContact O-CB 3.47Å; I154-D158 PolarHBondContact O-N 3.15Å
155	D	91.3	Very high	92.1	Very high	16 Å²	16	82.3 Å²	82.3	9%	0.086	40%	0.404	C	S	.	.	H	α-helix	trans	-64.9	-39	178.9	-75.3	-20.4	0	0	0	112	Q132 R151 Q152 D158 Q159	Q132-D155 VanDerWaalsContact NE2-CG 3.29Å; Q132-D155 PolarHBondContact NE2-OD2 2.77Å; R151-D155 IonicContact CZ-OD1 2.88Å; R151-D155 IonicContact CZ-OD2 3.55Å; R151-D155 IonicContact NE-OD2 3.92Å; R151-D155 IonicContact NH1-OD1 3.51Å; R151-D155 PolarHBondContact NH1-OD1 3.31Å; R151-D155 IonicContact NH1-OD2 2.65Å; R151-D155 IonicContact NH2-OD1 3.87Å; R151-D155 PolarHBondContact NH2-OD1 2.82Å; R151-D155 IonicContact NH2-OD2 3.05Å; R151-D155 PolarHBondContact NH2-OD2 2.97Å; R151-D155 VanDerWaalsContact NH2-OD2 3.11Å; R151-D155 PolarHBondContact O-N 2.86Å; Q152-D155 PolarHBondContact O-N 3.19Å; D155-D158 PolarHBondContact O-N 2.88Å; D155-Q159 WeakPolarHBondContact O-CB 3.06Å; D155-Q159 PolarHBondContact O-N 3.05Å
156	Q	91.9	Very high	92.1	Very high	70 Å²	70	78.3 Å²	78.3	33%	0.327	38%	0.38	S	S	.	.	H	α-helix	trans	-60.7	-46	172.5	-81.2	177.2	-5.1	0	0	112.6	D129 Q152 L153 I154 Q159 M160	D129-Q156 HydrophobicContact CB-CG 4.31Å; D129-Q156 WeakPolarHBondContact OD2-CG 3.28Å; Q152-Q156 WeakPolarHBondContact O-CB 3.2Å; Q152-Q156 WeakPolarHBondContact O-CG 3.2Å; Q152-Q156 PolarHBondContact O-N 2.78Å; L153-Q156 PolarHBondContact O-N 2.9Å; I154-Q156 VanDerWaalsContact C-N 3.35Å; I154-Q156 PolarHBondContact O-N 2.82Å; Q156-Q159 PolarHBondContact O-N 3.25Å; Q156-M160 WeakPolarHBondContact O-CB 3.3Å; Q156-M160 VanDerWaalsContact O-CG 3.3Å; Q156-M160 WeakPolarHBondContact O-CG 3.44Å; Q156-M160 PolarHBondContact O-N 2.65Å
157	V	94.5	Very high	92.1	Very high	87 Å²	87	77.3 Å²	77.3	53%	0.527	37%	0.372	S	S	.	.	H	α-helix	trans	-67.4	-38.1	178.9	170.9	0	0	0	0	111.4	L153 I154 M160 T161	L153-V157 WeakPolarHBondContact O-CB 3.3Å; L153-V157 VanDerWaalsContact O-CG2 3.26Å; L153-V157 WeakPolarHBondContact O-CG2 3.28Å; L153-V157 PolarHBondContact O-N 3.01Å; I154-V157 PolarHBondContact O-N 2.92Å; V157-M160 PolarHBondContact O-N 3.02Å; V157-T161 WeakPolarHBondContact O-CB 3.25Å; V157-T161 PolarHBondContact O-N 2.88Å; V157-T161 PolarHBondContact O-OG1 2.77Å
158	D	92.4	Very high	92.3	Very high	73 Å²	73	79.3 Å²	79.3	39%	0.39	38%	0.375	S	S	.	.	H	α-helix	trans	-62.1	-47.1	174.6	-175.2	66.7	0	0	0	111	I154 D155 M160 T161 K162	I154-D158 WeakPolarHBondContact O-CB 3.47Å; I154-D158 PolarHBondContact O-N 3.15Å; D155-D158 PolarHBondContact O-N 2.88Å; D158-M160 PolarHBondContact O-N 2.85Å; D158-T161 WeakPolarHBondContact O-CB 3.39Å; D158-T161 PolarHBondContact O-N 2.95Å; D158-T161 VanDerWaalsContact O-N 3.14Å; D158-K162 PolarHBondContact O-N 3.08Å; D158-K162 VanDerWaalsContact OD2-CE 3.24Å; D158-K162 WeakPolarHBondContact OD2-CE 3.4Å; D158-K162 IonicContact OD2-NZ 2.81Å; D158-K162 PolarHBondContact OD2-NZ 3Å
159	Q	89.5	Confident	92.3	Very high	12 Å²	12	84 Å²	84	6%	0.056	40%	0.396	C	S	.	.	H	α-helix	trans	-60.3	-47.6	176.5	-177	61.6	15.3	0	0	111.8	D155 Q156 T161 K162 E163	D155-Q159 WeakPolarHBondContact O-CB 3.06Å; D155-Q159 PolarHBondContact O-N 3.05Å; Q156-Q159 PolarHBondContact O-N 3.25Å; Q159-T161 VanDerWaalsContact C-N 3.25Å; Q159-T161 PolarHBondContact O-N 3.37Å; Q159-K162 PolarHBondContact O-N 2.81Å; Q159-E163 PolarHBondContact NE2-OE1 3.02Å; Q159-E163 PolarHBondContact O-N 3.35Å
160	M	92.6	Very high	92.3	Very high	107 Å²	107	80.6 Å²	80.6	53%	0.527	38%	0.383	S	S	.	.	H	α-helix	trans	-59.7	-37.2	175.2	-72.9	-176	-170.9	0	0	112.1	Q156 V157 D158 Q164	Q156-M160 WeakPolarHBondContact O-CB 3.3Å; Q156-M160 VanDerWaalsContact O-CG 3.3Å; Q156-M160 WeakPolarHBondContact O-CG 3.44Å; Q156-M160 PolarHBondContact O-N 2.65Å; V157-M160 PolarHBondContact O-N 3.02Å; D158-M160 PolarHBondContact O-N 2.85Å; M160-Q164 WeakPolarHBondContact O-CB 3.1Å; M160-Q164 VanDerWaalsContact O-CG 3.25Å; M160-Q164 WeakPolarHBondContact O-CG 3.39Å; M160-Q164 PolarHBondContact O-N 3.38Å
161	T	94.2	Very high	92.3	Very high	58 Å²	58	82.7 Å²	82.7	36%	0.356	39%	0.391	S	S	.	.	H	α-helix	trans	-67.9	-41.4	178.5	-59	0	0	0	0	111.2	V157 D158 Q159 Q164 N165	V157-T161 WeakPolarHBondContact O-CB 3.25Å; V157-T161 PolarHBondContact O-N 2.88Å; V157-T161 PolarHBondContact O-OG1 2.77Å; D158-T161 WeakPolarHBondContact O-CB 3.39Å; D158-T161 PolarHBondContact O-N 2.95Å; D158-T161 VanDerWaalsContact O-N 3.14Å; Q159-T161 VanDerWaalsContact C-N 3.25Å; Q159-T161 PolarHBondContact O-N 3.37Å; T161-Q164 PolarHBondContact O-N 3.42Å; T161-N165 WeakPolarHBondContact O-CB 3.35Å; T161-N165 VanDerWaalsContact O-CG 3.22Å; T161-N165 PolarHBondContact O-N 3.47Å; T161-N165 PolarHBondContact O-ND2 3.17Å
162	K	90.7	Very high	92.6	Very high	55 Å²	55	83.1 Å²	83.1	24%	0.239	40%	0.397	C	S	.	.	H	α-helix	trans	-61.4	-47.5	174.3	-74.4	172.1	175	156	0	111.6	P40 D158 Q159 N165 Y166	P40-K162 HydrophobicContact CB-CB 4.14Å; D158-K162 PolarHBondContact O-N 3.08Å; D158-K162 VanDerWaalsContact OD2-CE 3.24Å; D158-K162 WeakPolarHBondContact OD2-CE 3.4Å; D158-K162 IonicContact OD2-NZ 2.81Å; D158-K162 PolarHBondContact OD2-NZ 3Å; Q159-K162 PolarHBondContact O-N 2.81Å; K162-N165 PolarHBondContact O-N 2.04Å; K162-Y166 WeakPolarHBondContact O-CB 3.33Å; K162-Y166 PolarHBondContact O-N 2.96Å
163	E	89.6	Confident	92.7	Very high	90 Å²	90	83.9 Å²	83.9	42%	0.421	41%	0.405	S	S	.	.	H	α-helix	trans	-62	-45.1	177.2	-73.2	175.8	-165.8	0	0	111.9	P40 Q159 N165 Y166 Q167	P40-E163 HydrophobicContact CG-CG 3.85Å; Q159-E163 PolarHBondContact NE2-OE1 3.02Å; Q159-E163 PolarHBondContact O-N 3.35Å; E163-N165 PolarHBondContact O-N 2.83Å; E163-Y166 PolarHBondContact O-N 2.85Å; E163-Q167 WeakPolarHBondContact O-CG 3.4Å; E163-Q167 PolarHBondContact O-N 2.85Å
164	Q	93.9	Very high	92.8	Very high	105 Å²	105	85.9 Å²	85.9	49%	0.491	41%	0.41	S	S	.	.	H	α-helix	trans	-61.4	-43.3	175.8	-76.6	-179.5	10.5	0	0	112.5	M160 T161 Y166 Q167 R168	M160-Q164 WeakPolarHBondContact O-CB 3.1Å; M160-Q164 VanDerWaalsContact O-CG 3.25Å; M160-Q164 WeakPolarHBondContact O-CG 3.39Å; M160-Q164 PolarHBondContact O-N 3.38Å; T161-Q164 PolarHBondContact O-N 3.42Å; Q164-Y166 VanDerWaalsContact C-N 3.34Å; Q164-Q167 PolarHBondContact O-N 2.95Å; Q164-R168 WeakPolarHBondContact O-CB 3.43Å; Q164-R168 VanDerWaalsContact O-CG 3.31Å; Q164-R168 WeakPolarHBondContact O-CG 3.47Å; Q164-R168 PolarHBondContact O-N 3.16Å
165	N	92.6	Very high	93	Very high	83 Å²	83	86.5 Å²	86.5	44%	0.444	41%	0.406	S	S	.	.	H	α-helix	trans	-64.3	-41	177.9	-74.6	-23.4	0	0	0	111.4	T161 K162 E163 R168 H169	T161-N165 WeakPolarHBondContact O-CB 3.35Å; T161-N165 VanDerWaalsContact O-CG 3.22Å; T161-N165 PolarHBondContact O-N 3.47Å; T161-N165 PolarHBondContact O-ND2 3.17Å; K162-N165 PolarHBondContact O-N 2.04Å; E163-N165 PolarHBondContact O-N 2.83Å; N165-R168 PolarHBondContact O-N 3.32Å; N165-H169 PolarHBondContact O-N 2.67Å
166	Y	90.3	Very high	93.2	Very high	39 Å²	39	90.5 Å²	90.5	15%	0.153	42%	0.424	C	S	.	.	H	α-helix	trans	-59.4	-47.9	173.4	178.4	-107.1	0	0	0	111.6	E38 P99 K162 E163 Q164 R168 H169 R170	E38-Y166 HydrophobicContact CB-CE1 4.36Å; P99-Y166 HydrophobicContact CB-CD2 3.81Å; P99-Y166 HydrophobicContact CB-CE2 3.89Å; K162-Y166 WeakPolarHBondContact O-CB 3.33Å; K162-Y166 PolarHBondContact O-N 2.96Å; E163-Y166 PolarHBondContact O-N 2.85Å; Q164-Y166 VanDerWaalsContact C-N 3.34Å; Y166-R168 PolarHBondContact O-N 2.98Å; Y166-H169 PolarHBondContact O-N 2.87Å; Y166-R170 VanDerWaalsContact CE1-CD 3.49Å; Y166-R170 HydrophobicContact CE1-CG 4.31Å; Y166-R170 HydrophobicContact CE2-CG 4.44Å; Y166-R170 PolarHBondContact O-N 2.86Å
167	Q	92.7	Very high	93.5	Very high	98 Å²	98	92.1 Å²	92.1	46%	0.458	43%	0.434	S	S	.	.	H	α-helix	trans	-65.5	-39.5	179.2	-65.6	-63.4	10.9	0	0	112.9	E163 Q164 H169 R170 E171	E163-Q167 WeakPolarHBondContact O-CG 3.4Å; E163-Q167 PolarHBondContact O-N 2.85Å; Q164-Q167 PolarHBondContact O-N 2.95Å; Q167-H169 VanDerWaalsContact C-N 3.33Å; Q167-H169 PolarHBondContact O-N 3.19Å; Q167-R170 PolarHBondContact O-N 3.49Å; Q167-E171 WeakPolarHBondContact O-CB 3.14Å; Q167-E171 PolarHBondContact O-N 3.2Å
168	R	95.3	Very high	93.6	Very high	149 Å²	149	91 Å²	91	56%	0.562	43%	0.431	S	S	*	.	H	α-helix	trans	-60.2	-43	174.1	-75.9	175.4	-175.3	163.2	4.7	112	Q164 N165 Y166 E171 E172	Q164-R168 WeakPolarHBondContact O-CB 3.43Å; Q164-R168 VanDerWaalsContact O-CG 3.31Å; Q164-R168 WeakPolarHBondContact O-CG 3.47Å; Q164-R168 PolarHBondContact O-N 3.16Å; N165-R168 PolarHBondContact O-N 3.32Å; Y166-R168 PolarHBondContact O-N 2.98Å; R168-E171 PolarHBondContact O-N 2.78Å; R168-E172 PolarHBondContact O-N 3.09Å
169	H	91.9	Very high	93.8	Very high	125 Å²	125	92.4 Å²	92.4	58%	0.579	44%	0.435	S	S	*	.	H	α-helix	trans	-63.5	-44	178	-173.9	64.7	0	0	0	111.5	N165 Y166 Q167 E172 V173	N165-H169 PolarHBondContact O-N 2.67Å; Y166-H169 PolarHBondContact O-N 2.87Å; Q167-H169 VanDerWaalsContact C-N 3.33Å; Q167-H169 PolarHBondContact O-N 3.19Å; H169-E172 PolarHBondContact O-N 3.28Å; H169-V173 WeakPolarHBondContact O-CG2 3.1Å; H169-V173 PolarHBondContact O-N 2.62Å
170	R	91	Very high	94.1	Very high	100 Å²	100	94 Å²	94	38%	0.377	45%	0.448	S	S	.	.	H	α-helix	trans	-61.4	-44.2	174.8	-72.8	-172.8	70.4	-169.7	17.7	112.5	E38 Y166 Q167 E172 V173 F174	E38-R170 IonicContact OE1-CZ 3.66Å; E38-R170 VanDerWaalsContact OE1-CZ 3.27Å; E38-R170 IonicContact OE1-NH1 3.08Å; E38-R170 PolarHBondContact OE1-NH1 3.47Å; E38-R170 IonicContact OE1-NH2 3.72Å; E38-R170 PolarHBondContact OE1-NH2 2.91Å; E38-R170 VanDerWaalsContact OE1-NH2 3.08Å; E38-R170 IonicContact OE2-CZ 3.78Å; E38-R170 IonicContact OE2-NH1 3.09Å; E38-R170 PolarHBondContact OE2-NH1 3.33Å; Y166-R170 VanDerWaalsContact CE1-CD 3.49Å; Y166-R170 HydrophobicContact CE1-CG 4.31Å; Y166-R170 HydrophobicContact CE2-CG 4.44Å; Y166-R170 PolarHBondContact O-N 2.86Å; Q167-R170 PolarHBondContact O-N 3.49Å; R170-E172 VanDerWaalsContact C-N 3.32Å; R170-E172 PolarHBondContact O-N 3.04Å; R170-V173 PolarHBondContact O-N 2.95Å; R170-F174 VanDerWaalsContact O-CB 3.28Å; R170-F174 WeakPolarHBondContact O-CB 3.3Å; R170-F174 PolarHBondContact O-N 2.94Å
171	E	95.4	Very high	94.3	Very high	130 Å²	130	92.3 Å²	92.3	61%	0.607	44%	0.443	S	S	*	.	H	α-helix	trans	-58.8	-44.8	176.3	-175	-170.8	167.3	0	0	110.8	Q167 R168 F174 R175	Q167-E171 WeakPolarHBondContact O-CB 3.14Å; Q167-E171 PolarHBondContact O-N 3.2Å; R168-E171 PolarHBondContact O-N 2.78Å; E171-F174 PolarHBondContact O-N 3.28Å; E171-R175 WeakPolarHBondContact O-CB 3.36Å; E171-R175 PolarHBondContact O-N 2.78Å
172	E	95.7	Very high	94.4	Very high	92 Å²	92	94.8 Å²	94.8	43%	0.43	45%	0.454	S	S	.	.	H	α-helix	trans	-63.5	-44.8	179	179	151.6	-151.8	0	0	112.3	R168 H169 R170 R175 Q176	R168-E172 PolarHBondContact O-N 3.09Å; H169-E172 PolarHBondContact O-N 3.28Å; R170-E172 VanDerWaalsContact C-N 3.32Å; R170-E172 PolarHBondContact O-N 3.04Å; E172-R175 PolarHBondContact O-N 3.5Å; E172-R175 IonicContact OE1-NH2 2.62Å; E172-Q176 VanDerWaalsContact O-CG 3.3Å; E172-Q176 WeakPolarHBondContact O-CG 3.22Å; E172-Q176 PolarHBondContact O-N 2.86Å
173	V	94.3	Very high	94.7	Very high	74 Å²	74	98 Å²	98	45%	0.448	47%	0.47	S	S	.	.	H	α-helix	trans	-62.7	-45.4	175.5	173.2	0	0	0	0	110.9	H169 R170 R175 Q176 L177	H169-V173 WeakPolarHBondContact O-CG2 3.1Å; H169-V173 PolarHBondContact O-N 2.62Å; R170-V173 PolarHBondContact O-N 2.95Å; V173-R175 VanDerWaalsContact C-N 3.34Å; V173-R175 PolarHBondContact O-N 3.49Å; V173-Q176 PolarHBondContact O-N 3.34Å; V173-L177 WeakPolarHBondContact O-CB 3.45Å; V173-L177 PolarHBondContact O-N 2.97Å
174	F	95.7	Very high	95	Very high	147 Å²	147	102.5 Å²	102.5	65%	0.645	48%	0.483	S	S	*	.	H	α-helix	trans	-62.7	-41.8	177.7	-177.6	-98.4	0	0	0	111.7	R170 E171 L177 S178	R170-F174 VanDerWaalsContact O-CB 3.28Å; R170-F174 WeakPolarHBondContact O-CB 3.3Å; R170-F174 PolarHBondContact O-N 2.94Å; E171-F174 PolarHBondContact O-N 3.28Å; F174-L177 PolarHBondContact O-N 3.38Å; F174-S178 VanDerWaalsContact O-CB 3.3Å; F174-S178 WeakPolarHBondContact O-CB 3.44Å; F174-S178 PolarHBondContact O-N 3.06Å
175	R	97.2	Very high	95.2	Very high	107 Å²	107	101.9 Å²	101.9	40%	0.404	49%	0.486	S	S	.	.	H	α-helix	trans	-60.3	-48.2	175.7	-177.2	178.4	65.1	79.5	-0.7	111	E171 E172 V173 L177 S178 E179	E171-R175 WeakPolarHBondContact O-CB 3.36Å; E171-R175 PolarHBondContact O-N 2.78Å; E172-R175 PolarHBondContact O-N 3.5Å; E172-R175 IonicContact OE1-NH2 2.62Å; V173-R175 VanDerWaalsContact C-N 3.34Å; V173-R175 PolarHBondContact O-N 3.49Å; R175-L177 PolarHBondContact O-N 2.86Å; R175-S178 PolarHBondContact O-N 3.35Å; R175-E179 WeakPolarHBondContact CG-OE1 3.44Å; R175-E179 IonicContact CZ-OE1 2.9Å; R175-E179 IonicContact NH1-OE1 2.73Å; R175-E179 PolarHBondContact NH1-OE1 2.93Å; R175-E179 IonicContact NH1-OE2 2.64Å; R175-E179 WeakPolarHBondContact O-CB 3.48Å; R175-E179 WeakPolarHBondContact O-CG 3.32Å; R175-E179 PolarHBondContact O-N 3.47Å
176	Q	96.9	Very high	95.4	Very high	99 Å²	99	104.2 Å²	104.2	46%	0.463	49%	0.493	S	S	.	.	H	α-helix	trans	-63	-41	177.3	-70.5	176.1	9.2	0	0	112.5	E172 V173 S178 E179 S180	E172-Q176 VanDerWaalsContact O-CG 3.3Å; E172-Q176 WeakPolarHBondContact O-CG 3.22Å; E172-Q176 PolarHBondContact O-N 2.86Å; V173-Q176 PolarHBondContact O-N 3.34Å; Q176-S178 VanDerWaalsContact C-N 3.35Å; Q176-E179 PolarHBondContact O-N 2.91Å; Q176-S180 WeakPolarHBondContact O-CB 3.36Å; Q176-S180 PolarHBondContact O-N 3.47Å; Q176-S180 PolarHBondContact O-OG 3.21Å
177	L	96.3	Very high	95.7	Very high	104 Å²	104	110.2 Å²	110.2	55%	0.545	52%	0.515	S	S	.	.	H	α-helix	trans	-63.9	-42.2	175.9	-177.6	61.1	0	0	0	111.2	V173 F174 R175 S180 T181	V173-L177 WeakPolarHBondContact O-CB 3.45Å; V173-L177 PolarHBondContact O-N 2.97Å; F174-L177 PolarHBondContact O-N 3.38Å; R175-L177 PolarHBondContact O-N 2.86Å; L177-S180 PolarHBondContact O-OG 3.18Å; L177-S180 VanDerWaalsContact O-OG 3.05Å; L177-T181 WeakPolarHBondContact O-CB 3.4Å; L177-T181 PolarHBondContact O-N 3.41Å; L177-T181 PolarHBondContact O-OG1 3.38Å
178	S	96.8	Very high	95.9	Very high	64 Å²	64	115.1 Å²	115.1	45%	0.448	53%	0.53	S	S	.	.	H	α-helix	trans	-64.5	-47.6	176.8	-173	0	0	0	0	111.8	F174 R175 Q176 T181 N182	F174-S178 VanDerWaalsContact O-CB 3.3Å; F174-S178 WeakPolarHBondContact O-CB 3.44Å; F174-S178 PolarHBondContact O-N 3.06Å; R175-S178 PolarHBondContact O-N 3.35Å; Q176-S178 VanDerWaalsContact C-N 3.35Å; S178-T181 PolarHBondContact O-N 2.83Å; S178-N182 WeakPolarHBondContact O-CB 3.21Å; S178-N182 PolarHBondContact O-N 2.94Å
179	E	96.9	Very high	96	Very high	102 Å²	102	110.1 Å²	110.1	48%	0.477	52%	0.521	S	S	.	.	H	α-helix	trans	-60.2	-48	177.5	-75.8	173.4	-167	0	0	111.7	R175 Q176 N182 Q183	R175-E179 WeakPolarHBondContact CG-OE1 3.44Å; R175-E179 IonicContact CZ-OE1 2.9Å; R175-E179 IonicContact NH1-OE1 2.73Å; R175-E179 PolarHBondContact NH1-OE1 2.93Å; R175-E179 IonicContact NH1-OE2 2.64Å; R175-E179 WeakPolarHBondContact O-CB 3.48Å; R175-E179 WeakPolarHBondContact O-CG 3.32Å; R175-E179 PolarHBondContact O-N 3.47Å; Q176-E179 PolarHBondContact O-N 2.91Å; E179-N182 PolarHBondContact O-N 3.15Å; E179-Q183 WeakPolarHBondContact O-CB 3.27Å; E179-Q183 PolarHBondContact O-N 2.71Å
180	S	96	Very high	96.3	Very high	47 Å²	47	106 Å²	106	33%	0.329	51%	0.508	S	S	.	.	H	α-helix	trans	-67.1	-37.8	179.4	63	0	0	0	0	112.8	Q176 L177 R184	Q176-S180 WeakPolarHBondContact O-CB 3.36Å; Q176-S180 PolarHBondContact O-N 3.47Å; Q176-S180 PolarHBondContact O-OG 3.21Å; L177-S180 PolarHBondContact O-OG 3.18Å; L177-S180 VanDerWaalsContact O-OG 3.05Å; S180-R184 VanDerWaalsContact O-CG 3.32Å; S180-R184 WeakPolarHBondContact O-CG 3.21Å; S180-R184 PolarHBondContact O-N 3.41Å; S180-R184 VanDerWaalsContact O-N 3.15Å
181	T	96.9	Very high	96.6	Very high	71 Å²	71	103.6 Å²	103.6	44%	0.436	51%	0.51	S	S	.	.	H	α-helix	trans	-65.4	-48.6	174.5	-60	0	0	0	0	110.5	L177 S178 Q183 R184 V185	L177-T181 WeakPolarHBondContact O-CB 3.4Å; L177-T181 PolarHBondContact O-N 3.41Å; L177-T181 PolarHBondContact O-OG1 3.38Å; S178-T181 PolarHBondContact O-N 2.83Å; T181-Q183 VanDerWaalsContact C-N 3.34Å; T181-Q183 PolarHBondContact O-N 3.05Å; T181-R184 PolarHBondContact O-N 2.85Å; T181-V185 HydrophobicContact CG2-CG2 4.38Å; T181-V185 VanDerWaalsContact O-CG2 3.32Å; T181-V185 WeakPolarHBondContact O-CG2 3.32Å; T181-V185 PolarHBondContact O-N 3.37Å
182	N	96.5	Very high	96.7	Very high	110 Å²	110	103.6 Å²	103.6	59%	0.588	51%	0.509	S	S	*	.	H	α-helix	trans	-59.7	-43.4	178.5	-175.9	49.5	0	0	0	111.7	S178 E179 R184 V185 F186	S178-N182 WeakPolarHBondContact O-CB 3.21Å; S178-N182 PolarHBondContact O-N 2.94Å; E179-N182 PolarHBondContact O-N 3.15Å; N182-R184 PolarHBondContact O-N 3.48Å; N182-V185 PolarHBondContact O-N 2.96Å; N182-F186 VanDerWaalsContact O-CB 3.27Å; N182-F186 WeakPolarHBondContact O-CB 3.32Å; N182-F186 PolarHBondContact O-N 3.45Å
183	Q	96.3	Very high	96.8	Very high	122 Å²	122	103.2 Å²	103.2	57%	0.57	51%	0.514	S	S	*	.	H	α-helix	trans	-61.4	-43	177	-177.8	178.5	-9	0	0	112.3	E179 T181 F186 W187	E179-Q183 WeakPolarHBondContact O-CB 3.27Å; E179-Q183 PolarHBondContact O-N 2.71Å; T181-Q183 VanDerWaalsContact C-N 3.34Å; T181-Q183 PolarHBondContact O-N 3.05Å; Q183-F186 PolarHBondContact O-N 3.1Å; Q183-W187 VanDerWaalsContact O-CD1 3.27Å; Q183-W187 PolarHBondContact O-N 3.48Å; Q183-W187 VanDerWaalsContact O-N 3.1Å
184	R	96.6	Very high	97	Very high	185 Å²	185	102 Å²	102	70%	0.698	51%	0.512	S	S	*	.	H	α-helix	trans	-64.9	-46.3	177.5	-71.6	174.2	-175.6	-143.9	2.8	111.4	S180 T181 N182 F186 W187 W188	S180-R184 VanDerWaalsContact O-CG 3.32Å; S180-R184 WeakPolarHBondContact O-CG 3.21Å; S180-R184 PolarHBondContact O-N 3.41Å; S180-R184 VanDerWaalsContact O-N 3.15Å; T181-R184 PolarHBondContact O-N 2.85Å; N182-R184 PolarHBondContact O-N 3.48Å; R184-F186 VanDerWaalsContact C-N 3.32Å; R184-F186 PolarHBondContact O-N 3.23Å; R184-W187 PolarHBondContact O-N 3.41Å; R184-W188 VanDerWaalsContact O-CD1 3.25Å; R184-W188 PolarHBondContact O-N 2.9Å
185	V	97	Very high	97.1	Very high	91 Å²	91	99.2 Å²	99.2	55%	0.552	51%	0.506	S	S	*	.	H	α-helix	trans	-61.3	-43	177.9	172.2	0	0	0	0	110.7	T181 N182 W187 W188 A189	T181-V185 HydrophobicContact CG2-CG2 4.38Å; T181-V185 VanDerWaalsContact O-CG2 3.32Å; T181-V185 WeakPolarHBondContact O-CG2 3.32Å; T181-V185 PolarHBondContact O-N 3.37Å; N182-V185 PolarHBondContact O-N 2.96Å; V185-W187 PolarHBondContact O-N 2.84Å; V185-W188 PolarHBondContact O-N 3.5Å; V185-A189 WeakPolarHBondContact O-CB 3.38Å; V185-A189 PolarHBondContact O-N 3.07Å
186	F	96.8	Very high	97.1	Very high	132 Å²	132	99.2 Å²	99.2	58%	0.579	51%	0.514	S	S	*	.	H	α-helix	trans	-59.1	-47.3	176.8	175.5	-95.3	0	0	0	112.4	N182 Q183 R184 W188 A189 A190	N182-F186 VanDerWaalsContact O-CB 3.27Å; N182-F186 WeakPolarHBondContact O-CB 3.32Å; N182-F186 PolarHBondContact O-N 3.45Å; Q183-F186 PolarHBondContact O-N 3.1Å; R184-F186 VanDerWaalsContact C-N 3.32Å; R184-F186 PolarHBondContact O-N 3.23Å; F186-W188 PolarHBondContact O-N 3.34Å; F186-A189 PolarHBondContact O-N 2.94Å; F186-A190 WeakPolarHBondContact O-CB 3.38Å; F186-A190 PolarHBondContact O-N 2.98Å
187	W	96.8	Very high	97.1	Very high	166 Å²	166	100.4 Å²	100.4	63%	0.629	52%	0.521	S	S	*	.	H	α-helix	trans	-64.8	-39.5	178	-84.1	111.8	0	0	0	112.9	Q183 R184 V185 A190 A191	Q183-W187 VanDerWaalsContact O-CD1 3.27Å; Q183-W187 PolarHBondContact O-N 3.48Å; Q183-W187 VanDerWaalsContact O-N 3.1Å; R184-W187 PolarHBondContact O-N 3.41Å; V185-W187 PolarHBondContact O-N 2.84Å; W187-A190 PolarHBondContact O-N 3.43Å; W187-A191 WeakPolarHBondContact O-CB 3.42Å; W187-A191 PolarHBondContact O-N 3.28Å
188	W	97.3	Very high	97.2	Very high	200 Å²	200	101.1 Å²	101.1	76%	0.758	53%	0.525	S	S	*	.	H	α-helix	trans	-61.4	-44.4	173.1	-84.7	115.8	0	0	0	112	R184 V185 F186 A191 Q192	R184-W188 VanDerWaalsContact O-CD1 3.25Å; R184-W188 PolarHBondContact O-N 2.9Å; V185-W188 PolarHBondContact O-N 3.5Å; F186-W188 PolarHBondContact O-N 3.34Å; W188-A191 PolarHBondContact O-N 3.31Å; W188-Q192 WeakPolarHBondContact O-CB 3.48Å; W188-Q192 PolarHBondContact O-N 2.9Å
189	A	97.5	Very high	97.2	Very high	45 Å²	45	100.9 Å²	100.9	37%	0.372	52%	0.52	S	S	.	.	H	α-helix	trans	-63.4	-45.2	176	0	0	0	0	0	111.9	V185 F186 A191 Q192 T193	V185-A189 WeakPolarHBondContact O-CB 3.38Å; V185-A189 PolarHBondContact O-N 3.07Å; F186-A189 PolarHBondContact O-N 2.94Å; A189-A191 PolarHBondContact O-N 3.49Å; A189-Q192 PolarHBondContact O-N 3.35Å; A189-T193 PolarHBondContact O-N 3.24Å; A189-T193 PolarHBondContact O-OG1 3.02Å; A189-T193 VanDerWaalsContact O-OG1 3.08Å
190	A	97.8	Very high	97.2	Very high	38 Å²	38	97.2 Å²	97.2	31%	0.314	51%	0.51	S	S	.	.	H	α-helix	trans	-61.3	-43.1	177.9	0	0	0	0	0	112.2	F186 W187 T193 A194	F186-A190 WeakPolarHBondContact O-CB 3.38Å; F186-A190 PolarHBondContact O-N 2.98Å; W187-A190 PolarHBondContact O-N 3.43Å; A190-T193 PolarHBondContact O-N 3.46Å; A190-A194 WeakPolarHBondContact O-CB 3.4Å; A190-A194 PolarHBondContact O-N 3.46Å
191	A	97.7	Very high	97.2	Very high	50 Å²	50	98.6 Å²	98.6	41%	0.413	51%	0.513	S	S	.	.	H	α-helix	trans	-62.2	-44.2	175.3	0	0	0	0	0	111.6	W187 W188 A189 A194 V195	W187-A191 WeakPolarHBondContact O-CB 3.42Å; W187-A191 PolarHBondContact O-N 3.28Å; W188-A191 PolarHBondContact O-N 3.31Å; A189-A191 PolarHBondContact O-N 3.49Å; A191-A194 PolarHBondContact O-N 3.3Å; A191-V195 WeakPolarHBondContact O-CG2 3.48Å; A191-V195 PolarHBondContact O-N 3.08Å
192	Q	97.9	Very high	97.2	Very high	129 Å²	129	103.6 Å²	103.6	60%	0.603	52%	0.524	S	S	*	.	H	α-helix	trans	-61.3	-45.9	176.2	-177.4	-179.3	-13.8	0	0	111.9	W188 A189 A194 V195 L196	W188-Q192 WeakPolarHBondContact O-CB 3.48Å; W188-Q192 PolarHBondContact O-N 2.9Å; A189-Q192 PolarHBondContact O-N 3.35Å; Q192-A194 VanDerWaalsContact C-N 3.32Å; Q192-A194 PolarHBondContact O-N 2.97Å; Q192-V195 PolarHBondContact O-N 3.4Å; Q192-L196 HydrophobicContact CG-CD1 4.4Å; Q192-L196 WeakPolarHBondContact O-CG 3.43Å; Q192-L196 PolarHBondContact O-N 2.97Å
193	T	97.7	Very high	97.2	Very high	85 Å²	85	103.9 Å²	103.9	52%	0.521	52%	0.522	S	S	.	.	H	α-helix	trans	-60.6	-41.5	176.5	-57	0	0	0	0	111.6	A189 A190 L196 M197	A189-T193 PolarHBondContact O-N 3.24Å; A189-T193 PolarHBondContact O-OG1 3.02Å; A189-T193 VanDerWaalsContact O-OG1 3.08Å; A190-T193 PolarHBondContact O-N 3.46Å; T193-L196 PolarHBondContact O-N 3.02Å; T193-M197 VanDerWaalsContact O-CG 3.32Å; T193-M197 WeakPolarHBondContact O-CG 3.33Å; T193-M197 PolarHBondContact O-N 3.46Å
194	A	97.9	Very high	97.1	Very high	49 Å²	49	104 Å²	104	41%	0.405	53%	0.525	S	S	.	.	H	α-helix	trans	-62.5	-43.2	176.8	0	0	0	0	0	112.2	A190 A191 Q192 M197 L198	A190-A194 WeakPolarHBondContact O-CB 3.4Å; A190-A194 PolarHBondContact O-N 3.46Å; A191-A194 PolarHBondContact O-N 3.3Å; Q192-A194 VanDerWaalsContact C-N 3.32Å; Q192-A194 PolarHBondContact O-N 2.97Å; A194-M197 PolarHBondContact O-N 3.32Å; A194-L198 WeakPolarHBondContact O-CG 3.3Å; A194-L198 PolarHBondContact O-N 3.28Å
195	V	97.8	Very high	96.9	Very high	87 Å²	87	104 Å²	104	53%	0.527	53%	0.525	S	S	.	.	H	α-helix	trans	-61.3	-45.1	175.9	172.1	0	0	0	0	111.1	A191 Q192 M197 L198 T199	A191-V195 WeakPolarHBondContact O-CG2 3.48Å; A191-V195 PolarHBondContact O-N 3.08Å; Q192-V195 PolarHBondContact O-N 3.4Å; V195-M197 VanDerWaalsContact C-N 3.35Å; V195-M197 PolarHBondContact O-N 3.34Å; V195-L198 PolarHBondContact O-N 3.44Å; V195-T199 HydrophobicContact CG1-CG2 4.38Å; V195-T199 WeakPolarHBondContact O-CG2 3.32Å; V195-T199 PolarHBondContact O-N 2.97Å; V195-T199 PolarHBondContact O-OG1 3.43Å
196	L	97.5	Very high	96.7	Very high	107 Å²	107	105.5 Å²	105.5	56%	0.56	53%	0.526	S	S	*	.	H	α-helix	trans	-62.5	-39.1	177.2	-70	174.6	0	0	0	112.6	Q192 T193 T199 G200	Q192-L196 HydrophobicContact CG-CD1 4.4Å; Q192-L196 WeakPolarHBondContact O-CG 3.43Å; Q192-L196 PolarHBondContact O-N 2.97Å; T193-L196 PolarHBondContact O-N 3.02Å; L196-T199 PolarHBondContact O-OG1 2.97Å; L196-T199 VanDerWaalsContact O-OG1 3.09Å; L196-G200 PolarHBondContact O-N 3.09Å
197	M	97.7	Very high	96.4	Very high	124 Å²	124	103.6 Å²	103.6	61%	0.611	52%	0.522	S	S	*	.	H	α-helix	trans	-65.5	-43.3	175.5	-72.5	-69.7	-76.6	0	0	111.7	T193 A194 V195 G200 I201	T193-M197 VanDerWaalsContact O-CG 3.32Å; T193-M197 WeakPolarHBondContact O-CG 3.33Å; T193-M197 PolarHBondContact O-N 3.46Å; A194-M197 PolarHBondContact O-N 3.32Å; V195-M197 VanDerWaalsContact C-N 3.35Å; V195-M197 PolarHBondContact O-N 3.34Å; M197-G200 PolarHBondContact O-N 3.02Å; M197-I201 VanDerWaalsContact O-CG1 3.3Å; M197-I201 WeakPolarHBondContact O-CG1 3.38Å; M197-I201 PolarHBondContact O-N 2.95Å
198	L	97.4	Very high	96.1	Very high	120 Å²	120	102 Å²	102	63%	0.628	52%	0.519	S	S	*	.	H	α-helix	trans	-65.3	-45.2	178.8	-72.5	173.1	0	0	0	112.1	A194 V195 G200 I201 W202	A194-L198 WeakPolarHBondContact O-CG 3.3Å; A194-L198 PolarHBondContact O-N 3.28Å; V195-L198 PolarHBondContact O-N 3.44Å; L198-G200 VanDerWaalsContact C-N 3.35Å; L198-I201 PolarHBondContact O-N 2.98Å; L198-W202 WeakPolarHBondContact O-CB 3.39Å; L198-W202 PolarHBondContact O-N 2.97Å
199	T	97.4	Very high	95.6	Very high	58 Å²	58	94.1 Å²	94.1	36%	0.356	50%	0.5	S	S	.	.	H	α-helix	trans	-65.6	-38.9	176.9	57	0	0	0	0	111.2	V195 L196 W202 Q203	V195-T199 HydrophobicContact CG1-CG2 4.38Å; V195-T199 WeakPolarHBondContact O-CG2 3.32Å; V195-T199 PolarHBondContact O-N 2.97Å; V195-T199 PolarHBondContact O-OG1 3.43Å; L196-T199 PolarHBondContact O-OG1 2.97Å; L196-T199 VanDerWaalsContact O-OG1 3.09Å; T199-W202 PolarHBondContact O-N 3.47Å; T199-Q203 WeakPolarHBondContact O-CB 3.42Å; T199-Q203 VanDerWaalsContact O-CG 3.27Å; T199-Q203 WeakPolarHBondContact O-CG 3.44Å; T199-Q203 PolarHBondContact O-N 3.29Å
200	G	97	Very high	95.1	Very high	25 Å²	25	96.7 Å²	96.7	26%	0.258	50%	0.503	S	S	.	.	H	α-helix	trans	-61	-47	174.2	0	0	0	0	0	113.2	L196 M197 L198 W202 Q203 L204	L196-G200 PolarHBondContact O-N 3.09Å; M197-G200 PolarHBondContact O-N 3.02Å; L198-G200 VanDerWaalsContact C-N 3.35Å; G200-W202 VanDerWaalsContact C-N 3.34Å; G200-W202 PolarHBondContact O-N 3.41Å; G200-Q203 PolarHBondContact O-N 3.14Å; G200-L204 WeakPolarHBondContact O-CG 3.27Å; G200-L204 PolarHBondContact O-N 2.99Å
201	I	96.5	Very high	94.5	Very high	77 Å²	77	100 Å²	100	40%	0.395	51%	0.511	S	S	.	.	H	α-helix	trans	-62.8	-42.5	176	-68.4	165.7	0	0	0	111	M197 L198 L204 R205	M197-I201 VanDerWaalsContact O-CG1 3.3Å; M197-I201 WeakPolarHBondContact O-CG1 3.38Å; M197-I201 PolarHBondContact O-N 2.95Å; L198-I201 PolarHBondContact O-N 2.98Å; I201-L204 PolarHBondContact O-N 3.46Å; I201-R205 WeakPolarHBondContact O-CG 3.39Å; I201-R205 PolarHBondContact O-N 3.35Å
202	W	96.3	Very high	93.8	Very high	176 Å²	176	103.8 Å²	103.8	67%	0.667	52%	0.52	S	S	*	.	H	α-helix	trans	-62.9	-45.7	177.9	178.7	67.2	0	0	0	111.7	L198 T199 G200 L204 R205 H206	L198-W202 WeakPolarHBondContact O-CB 3.39Å; L198-W202 PolarHBondContact O-N 2.97Å; T199-W202 PolarHBondContact O-N 3.47Å; G200-W202 VanDerWaalsContact C-N 3.34Å; G200-W202 PolarHBondContact O-N 3.41Å; W202-L204 PolarHBondContact O-N 2.89Å; W202-R205 PolarHBondContact O-N 3.38Å; W202-H206 WeakPolarHBondContact O-CB 3.34Å; W202-H206 PolarHBondContact O-N 2.99Å
203	Q	95.8	Very high	93.1	Very high	115 Å²	115	101.8 Å²	101.8	54%	0.537	53%	0.526	S	S	.	.	H	α-helix	trans	-58.3	-46.5	175.1	-76.8	177	-13.8	0	0	111.7	T199 G200 R205 H206 L207	T199-Q203 WeakPolarHBondContact O-CB 3.42Å; T199-Q203 VanDerWaalsContact O-CG 3.27Å; T199-Q203 WeakPolarHBondContact O-CG 3.44Å; T199-Q203 PolarHBondContact O-N 3.29Å; G200-Q203 PolarHBondContact O-N 3.14Å; Q203-R205 PolarHBondContact O-N 2.86Å; Q203-H206 PolarHBondContact O-N 3.48Å; Q203-L207 WeakPolarHBondContact O-CB 3.16Å; Q203-L207 PolarHBondContact O-N 3.28Å
204	L	94.7	Very high	92.3	Very high	124 Å²	124	103.6 Å²	103.6	65%	0.649	53%	0.526	S	S	*	.	H	α-helix	trans	-62.5	-41.1	177.8	-71.6	173.1	0	0	0	112.5	G200 I201 W202 K208	G200-L204 WeakPolarHBondContact O-CG 3.27Å; G200-L204 PolarHBondContact O-N 2.99Å; I201-L204 PolarHBondContact O-N 3.46Å; W202-L204 PolarHBondContact O-N 2.89Å; L204-K208 WeakPolarHBondContact O-CB 3.42Å; L204-K208 PolarHBondContact O-N 3.47Å
205	R	93.2	Very high	90.7	Very high	185 Å²	185	110.4 Å²	110.4	70%	0.698	55%	0.547	S	S	*	.	H	α-helix	trans	-67.5	-40.7	176.2	-75.8	-176.9	179.4	156	0.9	112.4	I201 W202 Q203 K208 G209	I201-R205 WeakPolarHBondContact O-CG 3.39Å; I201-R205 PolarHBondContact O-N 3.35Å; W202-R205 PolarHBondContact O-N 3.38Å; Q203-R205 PolarHBondContact O-N 2.86Å; R205-K208 PolarHBondContact O-N 3.32Å; R205-G209 PolarHBondContact O-N 3.32Å
206	H	91.8	Very high	89	Confident	124 Å²	124	111.1 Å²	111.1	57%	0.574	55%	0.547	S	S	*	.	H	α-helix	trans	-63.4	-45.8	177.2	-174.7	75.5	0	0	0	111.3	W202 Q203 K208 G209 F210	W202-H206 WeakPolarHBondContact O-CB 3.34Å; W202-H206 PolarHBondContact O-N 2.99Å; Q203-H206 PolarHBondContact O-N 3.48Å; H206-K208 PolarHBondContact O-N 2.95Å; H206-G209 PolarHBondContact O-N 2.98Å; H206-F210 WeakPolarHBondContact O-CB 3.09Å; H206-F210 PolarHBondContact O-N 3.34Å
207	L	90.7	Very high	87.1	Confident	91 Å²	91	116.1 Å²	116.1	48%	0.476	58%	0.582	S	S	.	*	H	α-helix	trans	-58.3	-45.4	173.3	-87.4	153.4	0	0	0	111.8	Q203 F210 F211	Q203-L207 WeakPolarHBondContact O-CB 3.16Å; Q203-L207 PolarHBondContact O-N 3.28Å; L207-F210 WeakPolarHBondContact O-CB 3.49Å; L207-F210 PolarHBondContact O-N 3.05Å; L207-F211 HydrophobicContact CD2-CE2 4.28Å; L207-F211 WeakPolarHBondContact O-CD2 3.45Å; L207-F211 PolarHBondContact O-N 2.9Å
208	K	90.1	Very high	86.6	Confident	132 Å²	132	115.8 Å²	115.8	57%	0.574	58%	0.58	S	S	*	*	H	α-helix	trans	-61.5	-46.1	176.7	-172.9	177.1	174.1	-179	0	112.2	L204 R205 H206 F210 F211 E212	L204-K208 WeakPolarHBondContact O-CB 3.42Å; L204-K208 PolarHBondContact O-N 3.47Å; R205-K208 PolarHBondContact O-N 3.32Å; H206-K208 PolarHBondContact O-N 2.95Å; K208-F210 VanDerWaalsContact C-N 3.28Å; K208-F210 PolarHBondContact O-N 2.94Å; K208-F211 PolarHBondContact O-N 3.4Å; K208-E212 WeakPolarHBondContact CE-OE1 3.31Å; K208-E212 IonicContact NZ-OE1 3.69Å; K208-E212 PolarHBondContact O-N 3.38Å
209	G	87.7	Confident	86	Confident	36 Å²	36	115.5 Å²	115.5	37%	0.371	58%	0.578	S	S	.	*	H	α-helix	trans	-62.6	-34.2	176.9	0	0	0	0	0	113	R205 H206 A213	R205-G209 PolarHBondContact O-N 3.32Å; H206-G209 PolarHBondContact O-N 2.98Å; G209-A213 VanDerWaalsContact O-CB 3.31Å; G209-A213 WeakPolarHBondContact O-CB 3.47Å; G209-A213 PolarHBondContact O-N 3.12Å
210	F	86.3	Confident	85.4	Confident	98 Å²	98	118.7 Å²	118.7	43%	0.43	59%	0.59	S	S	.	*	H	α-helix	trans	-66.6	-41.9	174	-177.1	-95.6	0	0	0	112.5	H206 L207 K208 K214	H206-F210 WeakPolarHBondContact O-CB 3.09Å; H206-F210 PolarHBondContact O-N 3.34Å; L207-F210 WeakPolarHBondContact O-CB 3.49Å; L207-F210 PolarHBondContact O-N 3.05Å; K208-F210 VanDerWaalsContact C-N 3.28Å; K208-F210 PolarHBondContact O-N 2.94Å; F210-K214 HydrophobicContact CD1-CD 4.47Å; F210-K214 HydrophobicContact CE1-CD 3.83Å; F210-K214 HydrophobicContact CE2-CD 4.14Å; F210-K214 HydrophobicContact CZ-CD 3.67Å; F210-K214 VanDerWaalsContact CZ-NZ 3.33Å; F210-K214 PolarHBondContact O-N 3.25Å
211	F	85.8	Confident	84.7	Confident	107 Å²	107	124.2 Å²	124.2	47%	0.469	61%	0.61	S	S	.	*	H	α-helix	trans	-67.5	-41.7	175.9	-75.1	-59.7	0	0	0	112.6	L207 K208 K214 K215 L216	L207-F211 HydrophobicContact CD2-CE2 4.28Å; L207-F211 WeakPolarHBondContact O-CD2 3.45Å; L207-F211 PolarHBondContact O-N 2.9Å; K208-F211 PolarHBondContact O-N 3.4Å; F211-K214 PolarHBondContact O-N 3.22Å; F211-K215 PolarHBondContact O-N 3.19Å; F211-L216 HydrophobicContact CD1-CB 4.16Å; F211-L216 PolarHBondContact O-N 3.35Å
212	E	82.8	Confident	83.9	Confident	131 Å²	131	127.2 Å²	127.2	61%	0.612	62%	0.623	S	S	*	*	H	α-helix	trans	-62.6	-45.9	176.3	-76	178	-177.1	0	0	111.7	K208 K214 K215	K208-E212 WeakPolarHBondContact CE-OE1 3.31Å; K208-E212 IonicContact NZ-OE1 3.69Å; K208-E212 PolarHBondContact O-N 3.38Å; E212-K214 VanDerWaalsContact C-N 3.3Å; E212-K214 PolarHBondContact O-N 3.02Å; E212-K215 PolarHBondContact O-N 3.15Å
213	A	82.5	Confident	83.1	Confident	87 Å²	87	123.9 Å²	123.9	72%	0.719	62%	0.62	S	S	*	*	H	α-helix	trans	-64.4	-33.5	179.7	0	0	0	0	0	113	G209	G209-A213 VanDerWaalsContact O-CB 3.31Å; G209-A213 WeakPolarHBondContact O-CB 3.47Å; G209-A213 PolarHBondContact O-N 3.12Å
214	K	81.3	Confident	82.2	Confident	122 Å²	122	124.6 Å²	124.6	53%	0.53	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.2	-0.6	180	-72.3	-161.5	172.9	-168	0	114.4	F210 F211 E212 L216	F210-K214 HydrophobicContact CD1-CD 4.47Å; F210-K214 HydrophobicContact CE1-CD 3.83Å; F210-K214 HydrophobicContact CE2-CD 4.14Å; F210-K214 HydrophobicContact CZ-CD 3.67Å; F210-K214 VanDerWaalsContact CZ-NZ 3.33Å; F210-K214 PolarHBondContact O-N 3.25Å; F211-K214 PolarHBondContact O-N 3.22Å; E212-K214 VanDerWaalsContact C-N 3.3Å; E212-K214 PolarHBondContact O-N 3.02Å; K214-L216 HydrophobicContact CB-CD1 3.51Å; K214-L216 HydrophobicContact CB-CG 3.8Å; K214-L216 HydrophobicContact CD-CD1 3.83Å; K214-L216 HydrophobicContact CG-CD1 4.31Å; K214-L216 PolarHBondContact O-N 3.26Å; K214-L216 VanDerWaalsContact O-N 3.12Å
215	K	63.5	Low	81.2	Confident	192 Å²	192	124.6 Å²	124.6	84%	0.835	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	48.7	34.2	-173.5	-79.3	-173.6	172.9	-177.1	0	112.7	F211 E212 V217	F211-K215 PolarHBondContact O-N 3.19Å; E212-K215 PolarHBondContact O-N 3.15Å; K215-V217 PolarHBondContact O-N 3.37Å; K215-V217 VanDerWaalsContact O-N 3.15Å
216	L	63.1	Low	80.2	Confident	102 Å²	102	119.6 Å²	119.6	53%	0.534	62%	0.618	S	S	.	*			trans	-87.9	81.6	177.6	-71.8	162.6	0	0	0	108.1	F211 K214	F211-L216 HydrophobicContact CD1-CB 4.16Å; F211-L216 PolarHBondContact O-N 3.35Å; K214-L216 HydrophobicContact CB-CD1 3.51Å; K214-L216 HydrophobicContact CB-CG 3.8Å; K214-L216 HydrophobicContact CD-CD1 3.83Å; K214-L216 HydrophobicContact CG-CD1 4.31Å; K214-L216 PolarHBondContact O-N 3.26Å; K214-L216 VanDerWaalsContact O-N 3.12Å
217	V	57.4	Low	79.2	Confident	213 Å²	213	119.2 Å²	119.2	100%	1.291	62%	0.622	S	S	*	*			trans	-94.5	0	145.8	-86.7	0	0	0	0	108.2	K215	K215-V217 PolarHBondContact O-N 3.37Å; K215-V217 VanDerWaalsContact O-N 3.15Å

Retrieved 217 of 217 residues in 178.7 ms (Link to these results)

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