A0A077Z7U7_TRITR Loading...

Signal peptidase complex subunit 3

Essential component of the signal peptidase complex (SPC) which catalyzes the cleavage of N-terminal signal sequences from nascent proteins as they are translocated into the lumen of the endoplasmic reticulum. Essential for the SPC catalytic activity, possibly by stabilizing and positioning the active center of the complex close to the lumenal surface.

AlphaFold DB , UniProt , Accession A0A077Z7U7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 184 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	61.4	Low	88.3	Confident	235 Å²	235	120.2 Å²	120.2	100%	1.158	63%	0.633	S	S	*	*				0	70.3	0	-70.7	168.8	88.2	0	0	110.6
2	H	76.1	Confident	89	Confident	164 Å²	164	121.1 Å²	121.1	76%	0.759	63%	0.628	S	S	*	*			trans	-134.8	110.5	166.2	-65.3	-60.3	0	0	0	107.5
3	N	89.8	Confident	89.5	Confident	99 Å²	99	114.6 Å²	114.6	53%	0.529	61%	0.609	S	S	.	*			trans	-84.1	162.4	172.4	63.8	14.4	0	0	0	109.9	T5 S6 R7	N3-T5 PolarHBondContact O-N 2.82Å; N3-S6 PolarHBondContact N-OG 3.15Å; N3-S6 VanDerWaalsContact N-OG 3.16Å; N3-S6 PolarHBondContact O-N 3.02Å; N3-S6 PolarHBondContact O-OG 2.79Å; N3-S6 VanDerWaalsContact OD1-CB 3.25Å; N3-S6 WeakPolarHBondContact OD1-CB 2.94Å; N3-S6 PolarHBondContact OD1-N 3.1Å; N3-S6 PolarHBondContact OD1-OG 3.35Å; N3-R7 PolarHBondContact O-N 3.37Å
4	T	91.3	Very high	90	Very high	104 Å²	104	116.9 Å²	116.9	64%	0.638	61%	0.611	S	S	*	*	H	α-helix	trans	-54	-38.2	178.7	46.4	0	0	0	0	112.2	S6 R7 L8	T4-S6 PolarHBondContact O-N 3.18Å; T4-R7 PolarHBondContact O-N 2.94Å; T4-L8 PolarHBondContact O-N 3.1Å; T4-L8 VanDerWaalsContact O-N 3.08Å
5	T	90.7	Very high	90.5	Very high	96 Å²	96	117.2 Å²	117.2	59%	0.589	61%	0.61	S	S	*	*	H	α-helix	trans	-58.3	-45	175.4	-46.5	0	0	0	0	112.7	N3 R7 L8 N9	N3-T5 PolarHBondContact O-N 2.82Å; T5-R7 VanDerWaalsContact C-N 3.32Å; T5-R7 PolarHBondContact O-N 3.46Å; T5-L8 PolarHBondContact O-N 3.3Å; T5-N9 WeakPolarHBondContact O-CB 3.36Å; T5-N9 PolarHBondContact O-N 3.08Å
6	S	92.2	Very high	90.9	Very high	42 Å²	42	116.4 Å²	116.4	29%	0.294	61%	0.606	S	S	.	*	H	α-helix	trans	-64.8	-35	179.1	66.9	0	0	0	0	112.7	N3 T4 A10	N3-S6 PolarHBondContact N-OG 3.15Å; N3-S6 VanDerWaalsContact N-OG 3.16Å; N3-S6 PolarHBondContact O-N 3.02Å; N3-S6 PolarHBondContact O-OG 2.79Å; N3-S6 VanDerWaalsContact OD1-CB 3.25Å; N3-S6 WeakPolarHBondContact OD1-CB 2.94Å; N3-S6 PolarHBondContact OD1-N 3.1Å; N3-S6 PolarHBondContact OD1-OG 3.35Å; T4-S6 PolarHBondContact O-N 3.18Å; S6-A10 PolarHBondContact O-N 3.46Å; S6-A10 VanDerWaalsContact O-N 3.09Å
7	R	93.6	Very high	91.2	Very high	169 Å²	169	113.5 Å²	113.5	64%	0.638	60%	0.598	S	S	*	*	H	α-helix	trans	-69.2	-43.7	176.6	-65.1	175.7	65.3	-165.4	-0.1	111.5	N3 T4 T5 A10 I11	N3-R7 PolarHBondContact O-N 3.37Å; T4-R7 PolarHBondContact O-N 2.94Å; T5-R7 VanDerWaalsContact C-N 3.32Å; T5-R7 PolarHBondContact O-N 3.46Å; R7-A10 PolarHBondContact O-N 2.68Å; R7-I11 WeakPolarHBondContact O-CG1 2.87Å; R7-I11 PolarHBondContact O-N 3.03Å; R7-I11 VanDerWaalsContact O-N 3.08Å
8	L	94.3	Very high	91.6	Very high	120 Å²	120	110.8 Å²	110.8	63%	0.628	59%	0.587	S	S	*	*	H	α-helix	trans	-62.5	-43.2	175.9	-72	174	0	0	0	111.7	T4 T5 A10 I11 F12	T4-L8 PolarHBondContact O-N 3.1Å; T4-L8 VanDerWaalsContact O-N 3.08Å; T5-L8 PolarHBondContact O-N 3.3Å; L8-A10 VanDerWaalsContact C-N 3.32Å; L8-A10 PolarHBondContact O-N 3.43Å; L8-I11 PolarHBondContact O-N 3.36Å; L8-F12 WeakPolarHBondContact O-CB 3.45Å; L8-F12 PolarHBondContact O-N 3.11Å
9	N	93.9	Very high	91.8	Very high	116 Å²	116	110.1 Å²	110.1	62%	0.62	58%	0.583	S	S	*	*	H	α-helix	trans	-60.1	-41.5	176.3	-173.8	59.6	0	0	0	112.1	T5 F12 G13	T5-N9 WeakPolarHBondContact O-CB 3.36Å; T5-N9 PolarHBondContact O-N 3.08Å; N9-F12 PolarHBondContact O-N 3.42Å; N9-G13 PolarHBondContact O-N 2.81Å
10	A	93.6	Very high	92	Very high	63 Å²	63	108.4 Å²	108.4	52%	0.521	58%	0.58	S	S	.	*	H	α-helix	trans	-64.4	-43.2	176.8	0	0	0	0	0	112.6	S6 R7 L8 G13 F14	S6-A10 PolarHBondContact O-N 3.46Å; S6-A10 VanDerWaalsContact O-N 3.09Å; R7-A10 PolarHBondContact O-N 2.68Å; L8-A10 VanDerWaalsContact C-N 3.32Å; L8-A10 PolarHBondContact O-N 3.43Å; A10-G13 PolarHBondContact O-N 2.79Å; A10-F14 WeakPolarHBondContact O-CB 3.32Å; A10-F14 PolarHBondContact O-N 3.03Å
11	I	95	Very high	92.2	Very high	114 Å²	114	105.8 Å²	105.8	59%	0.585	57%	0.574	S	S	*	*	H	α-helix	trans	-62.7	-45.3	176.3	-66.5	166.1	0	0	0	110.5	R7 L8 F14 M15	R7-I11 WeakPolarHBondContact O-CG1 2.87Å; R7-I11 PolarHBondContact O-N 3.03Å; R7-I11 VanDerWaalsContact O-N 3.08Å; L8-I11 PolarHBondContact O-N 3.36Å; I11-F14 PolarHBondContact O-N 3.43Å; I11-M15 WeakPolarHBondContact O-CB 2.99Å; I11-M15 PolarHBondContact O-N 2.83Å
12	F	95.9	Very high	93.8	Very high	131 Å²	131	98.1 Å²	98.1	58%	0.575	54%	0.54	S	S	*	.	H	α-helix	trans	-63.8	-44.7	178.3	-176.8	-99.2	0	0	0	112.1	L8 N9 F14 M15 L16	L8-F12 WeakPolarHBondContact O-CB 3.45Å; L8-F12 PolarHBondContact O-N 3.11Å; N9-F12 PolarHBondContact O-N 3.42Å; F12-F14 VanDerWaalsContact C-N 3.33Å; F12-F14 PolarHBondContact O-N 2.84Å; F12-M15 WeakPolarHBondContact O-CB 3.27Å; F12-M15 PolarHBondContact O-N 3.04Å; F12-L16 PolarHBondContact O-N 2.86Å
13	G	95.7	Very high	94.6	Very high	37 Å²	37	93.3 Å²	93.3	38%	0.381	52%	0.522	S	S	.	.	H	α-helix	trans	-60.7	-41.2	175.7	0	0	0	0	0	112.7	N9 A10 L16 S17	N9-G13 PolarHBondContact O-N 2.81Å; A10-G13 PolarHBondContact O-N 2.79Å; G13-L16 PolarHBondContact O-N 3.47Å; G13-S17 PolarHBondContact O-N 2.82Å
14	F	95.9	Very high	94.8	Very high	146 Å²	146	94.3 Å²	94.3	64%	0.64	52%	0.522	S	S	*	.	H	α-helix	trans	-66.1	-42.6	174.1	-179.9	-105.9	0	0	0	112.4	A10 I11 F12 L16 S17 V18	A10-F14 WeakPolarHBondContact O-CB 3.32Å; A10-F14 PolarHBondContact O-N 3.03Å; I11-F14 PolarHBondContact O-N 3.43Å; F12-F14 VanDerWaalsContact C-N 3.33Å; F12-F14 PolarHBondContact O-N 2.84Å; F14-L16 VanDerWaalsContact C-N 3.31Å; F14-L16 PolarHBondContact O-N 3.33Å; F14-S17 PolarHBondContact O-N 2.98Å; F14-S17 PolarHBondContact O-OG 2.94Å; F14-V18 HydrophobicContact CD1-CG2 4.35Å; F14-V18 HydrophobicContact CD2-CG2 4.34Å; F14-V18 HydrophobicContact CE1-CG2 3.91Å; F14-V18 HydrophobicContact CE2-CG2 3.9Å; F14-V18 HydrophobicContact CZ-CG2 3.67Å; F14-V18 WeakPolarHBondContact O-CG2 3.11Å; F14-V18 PolarHBondContact O-N 3.48Å
15	M	97.5	Very high	94.8	Very high	122 Å²	122	94.8 Å²	94.8	60%	0.601	52%	0.52	S	S	*	.	H	α-helix	trans	-58.8	-44.2	175.4	-178.4	-173.2	171.7	0	0	111.4	I11 F12 V18 L19	I11-M15 WeakPolarHBondContact O-CB 2.99Å; I11-M15 PolarHBondContact O-N 2.83Å; F12-M15 WeakPolarHBondContact O-CB 3.27Å; F12-M15 PolarHBondContact O-N 3.04Å; M15-V18 PolarHBondContact O-N 2.76Å; M15-L19 WeakPolarHBondContact O-CB 3.45Å; M15-L19 PolarHBondContact O-N 2.88Å
16	L	97.4	Very high	94.8	Very high	104 Å²	104	91.4 Å²	91.4	55%	0.545	50%	0.5	S	S	.	.	H	α-helix	trans	-66.2	-40.5	179.4	-175.5	62	0	0	0	112.1	F12 G13 F14 L19 S20	F12-L16 PolarHBondContact O-N 2.86Å; G13-L16 PolarHBondContact O-N 3.47Å; F14-L16 VanDerWaalsContact C-N 3.31Å; F14-L16 PolarHBondContact O-N 3.33Å; L16-L19 PolarHBondContact O-N 2.64Å; L16-S20 VanDerWaalsContact O-CB 3.23Å; L16-S20 WeakPolarHBondContact O-CB 3.31Å; L16-S20 PolarHBondContact O-N 3.33Å
17	S	96.7	Very high	94.7	Very high	67 Å²	67	93.1 Å²	93.1	47%	0.469	50%	0.503	S	S	.	.	H	α-helix	trans	-65.8	-41.3	177.8	68.8	0	0	0	0	111.9	G13 F14 S20 A21	G13-S17 PolarHBondContact O-N 2.82Å; F14-S17 PolarHBondContact O-N 2.98Å; F14-S17 PolarHBondContact O-OG 2.94Å; S17-S20 PolarHBondContact O-N 3.41Å; S17-A21 WeakPolarHBondContact O-CB 3.4Å; S17-A21 PolarHBondContact O-N 3.5Å
18	V	97.5	Very high	94.6	Very high	65 Å²	65	88 Å²	88	39%	0.394	49%	0.488	S	S	.	.	H	α-helix	trans	-64.4	-47.6	175	174.2	0	0	0	0	111	F14 M15 S20 A21 V22	F14-V18 HydrophobicContact CD1-CG2 4.35Å; F14-V18 HydrophobicContact CD2-CG2 4.34Å; F14-V18 HydrophobicContact CE1-CG2 3.91Å; F14-V18 HydrophobicContact CE2-CG2 3.9Å; F14-V18 HydrophobicContact CZ-CG2 3.67Å; F14-V18 WeakPolarHBondContact O-CG2 3.11Å; F14-V18 PolarHBondContact O-N 3.48Å; M15-V18 PolarHBondContact O-N 2.76Å; V18-S20 VanDerWaalsContact C-N 3.32Å; V18-S20 PolarHBondContact O-N 2.78Å; V18-A21 PolarHBondContact O-N 2.94Å; V18-V22 HydrophobicContact CG1-CG2 4.49Å; V18-V22 WeakPolarHBondContact O-CG2 3.2Å; V18-V22 PolarHBondContact O-N 3.11Å
19	L	96.4	Very high	94.3	Very high	98 Å²	98	84.2 Å²	84.2	51%	0.513	47%	0.471	S	S	.	.	H	α-helix	trans	-62.4	-40.2	178.8	-176.2	60.5	0	0	0	111.9	M15 L16 V22 T23	M15-L19 WeakPolarHBondContact O-CB 3.45Å; M15-L19 PolarHBondContact O-N 2.88Å; L16-L19 PolarHBondContact O-N 2.64Å; L19-V22 PolarHBondContact O-N 3.33Å; L19-T23 VanDerWaalsContact O-CB 3.31Å; L19-T23 WeakPolarHBondContact O-CB 3.25Å; L19-T23 PolarHBondContact O-N 3.02Å; L19-T23 PolarHBondContact O-OG1 2.78Å
20	S	96.2	Very high	93.9	Very high	75 Å²	75	79 Å²	79	52%	0.524	44%	0.444	S	S	.	.	H	α-helix	trans	-61.3	-46.8	174.5	-179.7	0	0	0	0	111.4	L16 S17 V18 V22 T23 F24	L16-S20 VanDerWaalsContact O-CB 3.23Å; L16-S20 WeakPolarHBondContact O-CB 3.31Å; L16-S20 PolarHBondContact O-N 3.33Å; S17-S20 PolarHBondContact O-N 3.41Å; V18-S20 VanDerWaalsContact C-N 3.32Å; V18-S20 PolarHBondContact O-N 2.78Å; S20-V22 PolarHBondContact O-N 2.93Å; S20-T23 PolarHBondContact O-N 2.93Å; S20-F24 WeakPolarHBondContact O-CB 3.08Å; S20-F24 PolarHBondContact O-N 3.2Å
21	A	96.3	Very high	93.5	Very high	54 Å²	54	78.3 Å²	78.3	45%	0.446	44%	0.437	S	S	.	.	H	α-helix	trans	-61.3	-45.9	177.7	0	0	0	0	0	112	S17 V18 F24 L25	S17-A21 WeakPolarHBondContact O-CB 3.4Å; S17-A21 PolarHBondContact O-N 3.5Å; V18-A21 PolarHBondContact O-N 2.94Å; A21-F24 PolarHBondContact O-N 2.81Å; A21-L25 WeakPolarHBondContact O-CG 3.3Å; A21-L25 PolarHBondContact O-N 2.76Å
22	V	93.9	Very high	92.9	Very high	75 Å²	75	81.2 Å²	81.2	46%	0.455	45%	0.446	S	S	.	.	H	α-helix	trans	-62.6	-43.4	176.2	173.1	0	0	0	0	111.3	V18 L19 S20 F24 L25 C26	V18-V22 HydrophobicContact CG1-CG2 4.49Å; V18-V22 WeakPolarHBondContact O-CG2 3.2Å; V18-V22 PolarHBondContact O-N 3.11Å; L19-V22 PolarHBondContact O-N 3.33Å; S20-V22 PolarHBondContact O-N 2.93Å; V22-F24 VanDerWaalsContact C-N 3.29Å; V22-F24 PolarHBondContact O-N 2.91Å; V22-L25 PolarHBondContact O-N 3.04Å; V22-L25 VanDerWaalsContact O-N 3.16Å; V22-C26 PolarHBondContact O-N 2.94Å; V22-C26 PolarHBondContact O-SG 2.62Å; V22-C26 VanDerWaalsContact O-SG 3.34Å
23	T	93.8	Very high	92.4	Very high	63 Å²	63	79.4 Å²	79.4	39%	0.387	44%	0.436	S	S	.	.	H	α-helix	trans	-61.9	-39.3	177.6	-56.6	0	0	0	0	111.3	L19 S20 C26 F27 A157	L19-T23 VanDerWaalsContact O-CB 3.31Å; L19-T23 WeakPolarHBondContact O-CB 3.25Å; L19-T23 PolarHBondContact O-N 3.02Å; L19-T23 PolarHBondContact O-OG1 2.78Å; S20-T23 PolarHBondContact O-N 2.93Å; T23-C26 WeakPolarHBondContact O-CB 3.13Å; T23-C26 PolarHBondContact O-N 2.81Å; T23-F27 PolarHBondContact O-N 3.02Å; T23-A157 HydrophobicContact CG2-CB 3.96Å
24	F	93.8	Very high	91.9	Very high	120 Å²	120	81.9 Å²	81.9	53%	0.526	45%	0.447	S	S	.	.	H	α-helix	trans	-65.6	-39.4	174.9	-176.9	-107.2	0	0	0	112.2	S20 A21 V22 F27 L28	S20-F24 WeakPolarHBondContact O-CB 3.08Å; S20-F24 PolarHBondContact O-N 3.2Å; A21-F24 PolarHBondContact O-N 2.81Å; V22-F24 VanDerWaalsContact C-N 3.29Å; V22-F24 PolarHBondContact O-N 2.91Å; F24-F27 WeakPolarHBondContact O-CB 3.16Å; F24-F27 PolarHBondContact O-N 2.8Å; F24-L28 HydrophobicContact CD1-CD1 4.04Å; F24-L28 HydrophobicContact CD1-CG 4.47Å; F24-L28 HydrophobicContact CE1-CD1 3.58Å; F24-L28 HydrophobicContact CE1-CG 4.12Å; F24-L28 HydrophobicContact CZ-CD1 4.07Å; F24-L28 HydrophobicContact CZ-CD2 4.26Å; F24-L28 HydrophobicContact CZ-CG 4.22Å; F24-L28 WeakPolarHBondContact O-CG 3.43Å; F24-L28 PolarHBondContact O-N 2.9Å
25	L	91.7	Very high	91.7	Very high	113 Å²	113	75 Å²	75	59%	0.592	42%	0.417	S	S	*	.	H	α-helix	trans	-64.8	-39.9	172.9	-67.2	173.8	0	0	0	112.1	A21 V22 F27 L28 S29	A21-L25 WeakPolarHBondContact O-CG 3.3Å; A21-L25 PolarHBondContact O-N 2.76Å; V22-L25 PolarHBondContact O-N 3.04Å; V22-L25 VanDerWaalsContact O-N 3.16Å; L25-F27 VanDerWaalsContact C-N 3.3Å; L25-F27 PolarHBondContact O-N 2.78Å; L25-L28 PolarHBondContact O-N 3.25Å; L25-S29 PolarHBondContact O-N 2.84Å
26	C	89.9	Confident	91.5	Very high	25 Å²	25	72 Å²	72	17%	0.169	41%	0.405	C	S	.	.	H	α-helix	trans	-62.8	-37.4	171.6	-65.8	0	0	0	0	112.2	V22 T23 S29 W81 N82 A157	V22-C26 PolarHBondContact O-N 2.94Å; V22-C26 PolarHBondContact O-SG 2.62Å; V22-C26 VanDerWaalsContact O-SG 3.34Å; T23-C26 WeakPolarHBondContact O-CB 3.13Å; T23-C26 PolarHBondContact O-N 2.81Å; C26-S29 PolarHBondContact O-N 2.78Å; C26-S29 PolarHBondContact O-OG 2.91Å; C26-W81 HydrophobicContact CB-CH2 4.06Å; C26-W81 HydrophobicContact CB-CZ3 4.31Å; C26-N82 PolarHBondContact O-ND2 2.87Å; C26-A157 HydrophobicContact CB-CB 4.08Å
27	F	90.5	Very high	91.4	Very high	79 Å²	79	67.2 Å²	67.2	35%	0.346	38%	0.38	S	S	.	.	H	α-helix	trans	-62.5	-46.7	173.7	174	-82.9	0	0	0	111.4	T23 F24 L25 S29 T30 R159	T23-F27 PolarHBondContact O-N 3.02Å; F24-F27 WeakPolarHBondContact O-CB 3.16Å; F24-F27 PolarHBondContact O-N 2.8Å; L25-F27 VanDerWaalsContact C-N 3.3Å; L25-F27 PolarHBondContact O-N 2.78Å; F27-S29 VanDerWaalsContact C-N 3.28Å; F27-S29 PolarHBondContact O-N 3.24Å; F27-T30 PolarHBondContact O-N 3.26Å; F27-T30 PolarHBondContact O-OG1 3.44Å; F27-R159 HydrophobicContact CD2-CG 4.24Å; F27-R159 HydrophobicContact CE1-CG 4.3Å; F27-R159 HydrophobicContact CE2-CB 4.49Å; F27-R159 HydrophobicContact CE2-CG 3.35Å; F27-R159 HydrophobicContact CZ-CG 3.39Å
28	L	90.5	Very high	91.4	Very high	62 Å²	62	68.5 Å²	68.5	33%	0.325	39%	0.387	S	S	.	.	H	α-helix	trans	-62.8	-32.5	179.1	-71.4	178.1	0	0	0	112.9	F24 L25 T30 A31 F32	F24-L28 HydrophobicContact CD1-CD1 4.04Å; F24-L28 HydrophobicContact CD1-CG 4.47Å; F24-L28 HydrophobicContact CE1-CD1 3.58Å; F24-L28 HydrophobicContact CE1-CG 4.12Å; F24-L28 HydrophobicContact CZ-CD1 4.07Å; F24-L28 HydrophobicContact CZ-CD2 4.26Å; F24-L28 HydrophobicContact CZ-CG 4.22Å; F24-L28 WeakPolarHBondContact O-CG 3.43Å; F24-L28 PolarHBondContact O-N 2.9Å; L25-L28 PolarHBondContact O-N 3.25Å; L28-T30 PolarHBondContact O-N 3.34Å; L28-A31 PolarHBondContact O-N 3.4Å; L28-A31 VanDerWaalsContact O-N 3.13Å; L28-F32 WeakPolarHBondContact O-CD2 3.21Å
29	S	87.4	Confident	91.4	Very high	40 Å²	40	66.2 Å²	66.2	28%	0.28	37%	0.371	S	S	.	.	H	α-helix	trans	-61.2	-31.1	178.2	78.7	0	0	0	0	112.8	L25 C26 F27 A31 W81	L25-S29 PolarHBondContact O-N 2.84Å; C26-S29 PolarHBondContact O-N 2.78Å; C26-S29 PolarHBondContact O-OG 2.91Å; F27-S29 VanDerWaalsContact C-N 3.28Å; F27-S29 PolarHBondContact O-N 3.24Å; S29-A31 VanDerWaalsContact C-N 3.34Å; S29-W81 WeakPolarHBondContact OG-CH2 3.4Å; S29-W81 VanDerWaalsContact OG-CZ2 3.26Å; S29-W81 WeakPolarHBondContact OG-CZ2 3.1Å
30	T	86.4	Confident	91.5	Very high	7 Å²	7	64.6 Å²	64.6	4%	0.043	37%	0.369	C	S	.	.	H	α-helix	trans	-73.6	-23	178.2	66	0	0	0	0	113.7	F27 L28 F32 N82 P155 R159	F27-T30 PolarHBondContact O-N 3.26Å; F27-T30 PolarHBondContact O-OG1 3.44Å; L28-T30 PolarHBondContact O-N 3.34Å; T30-F32 PolarHBondContact O-N 2.81Å; T30-N82 WeakPolarHBondContact CG2-ND2 3.36Å; T30-P155 HydrophobicContact CG2-CB 3.95Å; T30-P155 HydrophobicContact CG2-CG 4.11Å; T30-R159 PolarHBondContact OG1-N 2.96Å
31	A	84.9	Confident	91.5	Very high	47 Å²	47	61.5 Å²	61.5	39%	0.388	35%	0.346	S	S	.	.	H	α-helix	trans	-75.6	-24.9	-173	0	0	0	0	0	113.8	L28 S29	L28-A31 PolarHBondContact O-N 3.4Å; L28-A31 VanDerWaalsContact O-N 3.13Å; S29-A31 VanDerWaalsContact C-N 3.34Å
32	F	82.7	Confident	91.5	Very high	176 Å²	176	62 Å²	62	77%	0.772	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-1.9	-172.7	-58.2	-72.6	0	0	0	113.9	L28 T30	L28-F32 WeakPolarHBondContact O-CD2 3.21Å; T30-F32 PolarHBondContact O-N 2.81Å
33	R	84.7	Confident	91.5	Very high	93 Å²	93	59.8 Å²	59.8	35%	0.351	33%	0.332	S	S	.	.			trans	-96.2	132.4	-176.4	-178.7	166.7	-179.2	143.3	3.8	111.3	Y35 S77 D80	R33-Y35 HydrophobicContact CB-CD2 4.3Å; R33-Y35 HydrophobicContact CB-CE2 3.64Å; R33-Y35 VanDerWaalsContact CD-CZ 3.5Å; R33-Y35 HydrophobicContact CG-CD1 4.41Å; R33-Y35 HydrophobicContact CG-CD2 4.06Å; R33-Y35 HydrophobicContact CG-CE1 4.06Å; R33-Y35 HydrophobicContact CG-CE2 3.7Å; R33-Y35 HydrophobicContact CG-CG 4.42Å; R33-Y35 VanDerWaalsContact O-CD2 3.31Å; R33-Y35 WeakPolarHBondContact O-CD2 3.5Å; R33-Y35 WeakPolarHBondContact O-CE2 3.49Å; R33-S77 PolarHBondContact NH2-O 3.33Å; R33-D80 WeakPolarHBondContact CD-OD2 3.27Å; R33-D80 IonicContact CZ-OD2 3.34Å; R33-D80 IonicContact NE-OD2 3.54Å; R33-D80 IonicContact NH1-OD2 2.8Å; R33-D80 PolarHBondContact NH1-OD2 3.13Å
34	S	86.5	Confident	91.5	Very high	88 Å²	88	59 Å²	59	62%	0.615	33%	0.329	S	S	*	.			trans	-83	130.7	166	-176.7	0	0	0	0	109.5
35	Y	91.4	Very high	91.4	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.008	34%	0.34	C	S	.	.			trans	-116.3	40.9	176.5	-59.7	-98.6	0	0	0	110.8	R33 L78 W151 V153 F163	R33-Y35 HydrophobicContact CB-CD2 4.3Å; R33-Y35 HydrophobicContact CB-CE2 3.64Å; R33-Y35 VanDerWaalsContact CD-CZ 3.5Å; R33-Y35 HydrophobicContact CG-CD1 4.41Å; R33-Y35 HydrophobicContact CG-CD2 4.06Å; R33-Y35 HydrophobicContact CG-CE1 4.06Å; R33-Y35 HydrophobicContact CG-CE2 3.7Å; R33-Y35 HydrophobicContact CG-CG 4.42Å; R33-Y35 VanDerWaalsContact O-CD2 3.31Å; R33-Y35 WeakPolarHBondContact O-CD2 3.5Å; R33-Y35 WeakPolarHBondContact O-CE2 3.49Å; Y35-L78 HydrophobicContact CD1-CB 4.35Å; Y35-L78 HydrophobicContact CD1-CD2 4.16Å; Y35-L78 HydrophobicContact CG-CD2 4.46Å; Y35-W151 VanDerWaalsContact O-CE2 3.31Å; Y35-W151 WeakPolarHBondContact O-CZ2 3.45Å; Y35-W151 PolarHBondContact O-NE1 3.03Å; Y35-V153 HydrophobicContact CD1-CG1 4.05Å; Y35-V153 HydrophobicContact CD1-CG2 3.95Å; Y35-V153 HydrophobicContact CD2-CG2 4.39Å; Y35-V153 HydrophobicContact CE1-CG1 3.87Å; Y35-V153 HydrophobicContact CG-CG2 3.85Å; Y35-F163 HydrophobicContact CD2-CD2 4.39Å; Y35-F163 AromaticContact CD2-CE2 3.43Å; Y35-F163 HydrophobicContact CD2-CE2 3.43Å; Y35-F163 VanDerWaalsContact CD2-CE2 3.43Å; Y35-F163 AromaticContact CD2-CZ 3.64Å; Y35-F163 HydrophobicContact CD2-CZ 3.64Å; Y35-F163 HydrophobicContact CE2-CE2 4.44Å; Y35-F163 HydrophobicContact CG-CD2 4.41Å; Y35-F163 AromaticContact CG-CE2 3.86Å; Y35-F163 HydrophobicContact CG-CE2 3.86Å; Y35-F163 HydrophobicContact CG-CZ 4.32Å
36	V	93.7	Very high	91.4	Very high	58 Å²	58	52.7 Å²	52.7	35%	0.352	32%	0.315	S	S	.	.			trans	-94	129.7	179.3	-178.6	0	0	0	0	109.8	F163 I166	V36-F163 HydrophobicContact CG2-CD1 3.86Å; V36-F163 HydrophobicContact CG2-CE1 4.48Å; V36-I166 HydrophobicContact CG1-CD1 3.53Å; V36-I166 HydrophobicContact CG1-CG1 3.53Å
37	V	95.1	Very high	91.5	Very high	5 Å²	5	53.9 Å²	53.9	3%	0.03	32%	0.322	C	S	.	.			trans	-127.7	148.7	173	-63.7	0	0	0	0	110.8	F75 S77 L78 W151 G165 I166	V37-F75 HydrophobicContact CG2-CD1 3.78Å; V37-F75 HydrophobicContact CG2-CE1 3.57Å; V37-F75 HydrophobicContact CG2-CZ 4.36Å; V37-S77 WeakPolarHBondContact CG1-OG 3.36Å; V37-L78 HydrophobicContact CG1-CD1 4.36Å; V37-L78 HydrophobicContact CG1-CD2 3.72Å; V37-L78 HydrophobicContact CG1-CG 3.94Å; V37-W151 HydrophobicContact CB-CH2 4.32Å; V37-W151 HydrophobicContact CB-CZ2 4.44Å; V37-W151 HydrophobicContact CG2-CH2 3.28Å; V37-W151 HydrophobicContact CG2-CZ2 3.54Å; V37-W151 HydrophobicContact CG2-CZ3 4.03Å; V37-G165 WeakPolarHBondContact O-CA 3.39Å; V37-I166 PolarHBondContact O-N 3.43Å; V37-I166 VanDerWaalsContact O-N 3.1Å
38	P	97	Very high	91.7	Very high	93 Å²	93	50.1 Å²	50.1	60%	0.604	31%	0.306	S	S	*	.	B	Isolated β-bridge	trans	-72.5	151	170.1	31.7	-34.4	0	0	0	110.8	I166	P38-I166 WeakPolarHBondContact CA-O 3.15Å
39	F	97.1	Very high	91.7	Very high	17 Å²	17	49.4 Å²	49.4	8%	0.075	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	156.5	172	72.1	-79.3	0	0	0	110.7	V41 L71 Q72 A73 L149 I166 G167	F39-V41 HydrophobicContact CD2-CB 4.15Å; F39-V41 HydrophobicContact CD2-CG1 3.98Å; F39-V41 HydrophobicContact CE2-CB 4.09Å; F39-V41 HydrophobicContact CE2-CG1 3.47Å; F39-V41 VanDerWaalsContact CE2-CG1 3.47Å; F39-L71 HydrophobicContact CD2-CD1 4.15Å; F39-Q72 WeakPolarHBondContact CA-O 3.4Å; F39-A73 HydrophobicContact CB-CB 3.93Å; F39-L149 HydrophobicContact CB-CD2 3.73Å; F39-L149 HydrophobicContact CD1-CB 3.87Å; F39-L149 HydrophobicContact CD1-CD2 4.44Å; F39-L149 HydrophobicContact CD2-CB 3.6Å; F39-L149 HydrophobicContact CD2-CD2 4.19Å; F39-L149 HydrophobicContact CE1-CB 3.88Å; F39-L149 HydrophobicContact CE2-CB 3.6Å; F39-L149 HydrophobicContact CG-CB 3.73Å; F39-L149 HydrophobicContact CG-CD2 3.88Å; F39-L149 HydrophobicContact CG-CG 4.49Å; F39-L149 HydrophobicContact CZ-CB 3.75Å; F39-L149 VanDerWaalsContact CZ-N 3.26Å; F39-I166 PolarHBondContact N-O 2.92Å; F39-I166 VanDerWaalsContact N-O 3.09Å; F39-G167 WeakPolarHBondContact CE1-O 3.38Å; F39-G167 WeakPolarHBondContact CZ-O 3.5Å
40	S	97.1	Very high	91.8	Very high	65 Å²	65	49.6 Å²	49.6	46%	0.455	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	125.6	171.5	-179.5	0	0	0	0	108.3	Q72	S40-Q72 PolarHBondContact N-O 3.34Å; S40-Q72 PolarHBondContact O-N 2.89Å
41	V	96.8	Very high	91.8	Very high	9 Å²	9	52.3 Å²	52.3	6%	0.055	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	140.8	174.3	61.5	0	0	0	0	109	F39 D70 L71 L90 L147 H169	F39-V41 HydrophobicContact CD2-CB 4.15Å; F39-V41 HydrophobicContact CD2-CG1 3.98Å; F39-V41 HydrophobicContact CE2-CB 4.09Å; F39-V41 HydrophobicContact CE2-CG1 3.47Å; F39-V41 VanDerWaalsContact CE2-CG1 3.47Å; V41-D70 VanDerWaalsContact CA-O 3.27Å; V41-D70 WeakPolarHBondContact CA-O 3.27Å; V41-L71 HydrophobicContact CB-CD1 4.07Å; V41-L71 HydrophobicContact CG2-CD1 4.39Å; V41-L90 HydrophobicContact CG2-CD1 4.32Å; V41-L90 HydrophobicContact CG2-CD2 4.35Å; V41-L147 HydrophobicContact CG1-CB 4.29Å; V41-L147 HydrophobicContact CG2-CB 4.4Å; V41-L147 HydrophobicContact CG2-CD1 4.2Å; V41-H169 HydrophobicContact CG1-CB 3.55Å; V41-H169 VanDerWaalsContact O-CB 3.31Å; V41-H169 WeakPolarHBondContact O-CB 3.45Å
42	T	96.2	Very high	91.7	Very high	64 Å²	64	53.7 Å²	53.7	39%	0.393	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	149.4	171.7	56.4	0	0	0	0	108.7	F69 D70	T42-F69 CarbonylContact O-C 3.57Å; T42-F69 VanDerWaalsContact O-CA 3.27Å; T42-F69 WeakPolarHBondContact O-CA 3.41Å; T42-D70 PolarHBondContact N-O 3.46Å; T42-D70 PolarHBondContact O-N 2.76Å; T42-D70 WeakPolarHBondContact OG1-CB 3.43Å
43	S	94.2	Very high	91.5	Very high	29 Å²	29	46.1 Å²	46.1	20%	0.203	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	155.2	-179.9	61.5	0	0	0	0	112.6	T68 H169 L171	S43-T68 CarbonylContact C-O 3.48Å; S43-T68 WeakPolarHBondContact CA-O 3.49Å; S43-H169 PolarHBondContact N-NE2 3.32Å; S43-H169 PolarHBondContact OG-CD2 3.42Å; S43-H169 PolarHBondContact OG-NE2 3.09Å; S43-L171 VanDerWaalsContact OG-CD1 3.27Å; S43-L171 WeakPolarHBondContact OG-CD1 3.49Å
44	S	93.6	Very high	90.9	Very high	46 Å²	46	50.6 Å²	50.6	32%	0.322	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-72	173.6	162.5	74.9	0	0	0	0	111	A46 T68	S44-A46 PolarHBondContact O-N 2.85Å; S44-T68 WeakPolarHBondContact CB-OG1 3.28Å; S44-T68 PolarHBondContact N-O 3.41Å; S44-T68 PolarHBondContact OG-N 3.41Å; S44-T68 PolarHBondContact OG-O 3.09Å; S44-T68 PolarHBondContact OG-OG1 3Å
45	A	91.6	Very high	90	Very high	92 Å²	92	51.6 Å²	51.6	76%	0.76	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-56.5	134.5	165.5	0	0	0	0	0	110.3
46	A	92.2	Very high	88.8	Confident	9 Å²	9	55.9 Å²	55.9	7%	0.074	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-84	150.7	178.1	0	0	0	0	0	111.9	S44 A66 F67 L171 I173 P174	S44-A46 PolarHBondContact O-N 2.85Å; A46-A66 WeakPolarHBondContact CA-O 3.37Å; A46-F67 HydrophobicContact CB-CB 4.21Å; A46-F67 HydrophobicContact CB-CD1 4.27Å; A46-L171 HydrophobicContact CB-CD1 3.96Å; A46-L171 HydrophobicContact CB-CD2 4.1Å; A46-L171 HydrophobicContact CB-CG 4.32Å; A46-I173 HydrophobicContact CB-CD1 3.53Å; A46-P174 VanDerWaalsContact O-CD 3.25Å; A46-P174 WeakPolarHBondContact O-CD 3.37Å; A46-P174 VanDerWaalsContact O-CG 3.3Å; A46-P174 WeakPolarHBondContact O-CG 3.33Å
47	T	92.5	Very high	87.5	Confident	51 Å²	51	55 Å²	55	31%	0.313	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	130.9	172.5	-62.3	0	0	0	0	108.4	A65 A66	T47-A65 CarbonylContact O-C 3.48Å; T47-A65 VanDerWaalsContact O-CA 3.29Å; T47-A65 WeakPolarHBondContact O-CA 3.38Å; T47-A66 PolarHBondContact N-O 2.8Å; T47-A66 PolarHBondContact O-N 3.27Å
48	V	93.1	Very high	86.1	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	144.8	177.7	67.7	0	0	0	0	111.3	D63 L64 L139 I173 P174 Y177 S178	V48-D63 HydrophobicContact CG2-CB 4.17Å; V48-L64 CarbonylContact C-O 3.57Å; V48-L64 WeakPolarHBondContact CA-O 3.29Å; V48-L139 HydrophobicContact CG2-CB 4.42Å; V48-I173 HydrophobicContact CB-CG2 3.71Å; V48-I173 HydrophobicContact CG1-CG2 4.07Å; V48-I173 HydrophobicContact CG2-CG2 4.16Å; V48-P174 HydrophobicContact CG1-CG 4.22Å; V48-Y177 HydrophobicContact CB-CD1 4.48Å; V48-Y177 HydrophobicContact CG1-CD1 3.89Å; V48-Y177 HydrophobicContact CG1-CE1 4.32Å; V48-Y177 HydrophobicContact CG2-CD1 4.15Å; V48-Y177 HydrophobicContact CG2-CE1 3.96Å; V48-Y177 WeakPolarHBondContact O-CA 3.44Å; V48-S178 PolarHBondContact O-N 2.74Å
49	K	90.8	Very high	84.9	Confident	46 Å²	46	64.3 Å²	64.3	20%	0.2	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	144.1	176.1	-75	-165.1	172	-176.3	0	111.4	D63 L64 G180 V182	K49-D63 CarbonylContact O-C 3.59Å; K49-D63 WeakPolarHBondContact O-CA 3.31Å; K49-L64 PolarHBondContact N-O 3.1Å; K49-L64 PolarHBondContact O-N 2.95Å; K49-G180 WeakPolarHBondContact CE-O 3.25Å; K49-G180 PolarHBondContact NZ-O 3.16Å; K49-V182 HydrophobicContact CD-CG2 3.46Å; K49-V182 VanDerWaalsContact CD-CG2 3.46Å; K49-V182 HydrophobicContact CG-CG2 4.13Å; K49-V182 VanDerWaalsContact NZ-N 3.17Å
50	S	89.5	Confident	84	Confident	45 Å²	45	64.3 Å²	64.3	32%	0.315	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	127.3	169.4	-169	0	0	0	0	109.8
51	L	86.9	Confident	83.4	Confident	64 Å²	64	66.1 Å²	66.1	34%	0.335	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	145.1	173.8	-64.6	-178.8	0	0	0	110.3	A53 K61 A62 L64 L133	L51-A53 PolarHBondContact O-N 2.89Å; L51-K61 CarbonylContact O-C 3.58Å; L51-K61 VanDerWaalsContact O-CA 3.31Å; L51-K61 WeakPolarHBondContact O-CA 2.93Å; L51-A62 PolarHBondContact N-O 2.83Å; L51-A62 PolarHBondContact O-N 2.87Å; L51-L64 HydrophobicContact CD1-CB 3.77Å; L51-L64 HydrophobicContact CD1-CD1 3.66Å; L51-L64 HydrophobicContact CD1-CG 4.36Å; L51-L64 HydrophobicContact CG-CB 4.13Å; L51-L133 HydrophobicContact CD1-CD1 4.18Å
52	P	83.9	Confident	83	Confident	76 Å²	76	66 Å²	66	49%	0.494	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	120.7	169.2	29.4	-32.3	0	0	0	109.7	Y54	P52-Y54 HydrophobicContact CB-CE1 4.29Å; P52-Y54 HydrophobicContact CB-CE2 3.98Å; P52-Y54 HydrophobicContact CG-CE2 3.87Å; P52-Y54 PolarHBondContact O-N 2.97Å
53	A	77.2	Confident	82.8	Confident	16 Å²	16	63 Å²	63	13%	0.132	38%	0.384	C	S	.	.			trans	-100	79.6	178.2	0	0	0	0	0	110	L51 A55 M56 G60 A62	L51-A53 PolarHBondContact O-N 2.89Å; A53-A55 PolarHBondContact O-N 2.92Å; A53-A55 VanDerWaalsContact O-N 3.11Å; A53-M56 HydrophobicContact CB-CB 4.26Å; A53-M56 HydrophobicContact CB-CE 3.35Å; A53-M56 HydrophobicContact CB-CG 4.18Å; A53-M56 PolarHBondContact O-N 2.97Å; A53-G60 PolarHBondContact N-O 2.67Å; A53-A62 HydrophobicContact CB-CB 3.89Å
54	Y	71.9	Confident	82.7	Confident	187 Å²	187	62.6 Å²	62.6	73%	0.733	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-59	-26.8	-177.3	-60.3	-72.1	0	0	0	113.7	P52 M56 G57	P52-Y54 HydrophobicContact CB-CE1 4.29Å; P52-Y54 HydrophobicContact CB-CE2 3.98Å; P52-Y54 HydrophobicContact CG-CE2 3.87Å; P52-Y54 PolarHBondContact O-N 2.97Å; Y54-M56 VanDerWaalsContact C-N 3.25Å; Y54-M56 PolarHBondContact O-N 3.31Å; Y54-G57 PolarHBondContact O-N 2.9Å
55	A	68.8	Low	82.7	Confident	109 Å²	109	60.4 Å²	60.4	90%	0.901	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-67.9	-23.1	175.5	0	0	0	0	0	113.3	A53 G57	A53-A55 PolarHBondContact O-N 2.92Å; A53-A55 VanDerWaalsContact O-N 3.11Å; A55-G57 VanDerWaalsContact C-N 3.34Å
56	M	64.6	Low	82.7	Confident	93 Å²	93	56.5 Å²	56.5	46%	0.458	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-94	11	179.1	-60.6	-160.9	-74.7	0	0	112.9	A53 Y54 K61 A62 D135	A53-M56 HydrophobicContact CB-CB 4.26Å; A53-M56 HydrophobicContact CB-CE 3.35Å; A53-M56 HydrophobicContact CB-CG 4.18Å; A53-M56 PolarHBondContact O-N 2.97Å; Y54-M56 VanDerWaalsContact C-N 3.25Å; Y54-M56 PolarHBondContact O-N 3.31Å; M56-K61 WeakPolarHBondContact CE-O 3.44Å; M56-A62 HydrophobicContact CE-CB 4.2Å; M56-D135 HydrophobicContact SD-CB 4.13Å
57	G	67.9	Low	82.8	Confident	38 Å²	38	56.6 Å²	56.6	39%	0.392	33%	0.331	S	S	.	.			trans	104.8	173.1	-177.6	0	0	0	0	0	113.3	Y54 A55 Q59 G60	Y54-G57 PolarHBondContact O-N 2.9Å; A55-G57 VanDerWaalsContact C-N 3.34Å; G57-Q59 PolarHBondContact O-N 2.84Å; G57-G60 PolarHBondContact O-N 2.82Å
58	A	66.1	Low	82.9	Confident	109 Å²	109	55.8 Å²	55.8	90%	0.901	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-20.7	-172.3	0	0	0	0	0	114.6
59	Q	71.1	Confident	83.1	Confident	186 Å²	186	55.9 Å²	55.9	87%	0.869	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.8	8.5	179.4	-63.5	-174.2	-12.3	0	0	113	G57 K61	G57-Q59 PolarHBondContact O-N 2.84Å; Q59-K61 PolarHBondContact O-N 3.11Å
60	G	77	Confident	83.4	Confident	16 Å²	16	55.7 Å²	55.7	17%	0.165	33%	0.328	C	S	.	.			trans	-60.8	134.6	178.5	0	0	0	0	0	110.6	A53 G57	A53-G60 PolarHBondContact N-O 2.67Å; G57-G60 PolarHBondContact O-N 2.82Å
61	K	84.6	Confident	83.8	Confident	104 Å²	104	53.5 Å²	53.5	45%	0.452	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	144.5	172.2	-64.9	178.1	-175.1	179.1	0	109.3	L51 M56 Q59 G136 E137	L51-K61 CarbonylContact O-C 3.58Å; L51-K61 VanDerWaalsContact O-CA 3.31Å; L51-K61 WeakPolarHBondContact O-CA 2.93Å; M56-K61 WeakPolarHBondContact CE-O 3.44Å; Q59-K61 PolarHBondContact O-N 3.11Å; K61-G136 WeakPolarHBondContact O-CA 3.45Å; K61-E137 HydrophobicContact CB-CG 4.29Å; K61-E137 HydrophobicContact CD-CG 4.37Å; K61-E137 WeakPolarHBondContact CD-OE1 3.24Å; K61-E137 IonicContact NZ-OE1 2.82Å; K61-E137 PolarHBondContact NZ-OE1 2.83Å
62	A	89.9	Confident	84.3	Confident	6 Å²	6	54.2 Å²	54.2	5%	0.05	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	135.7	175.1	0	0	0	0	0	109.1	L51 A53 M56 L133 D134 G136	L51-A62 PolarHBondContact N-O 2.83Å; L51-A62 PolarHBondContact O-N 2.87Å; A53-A62 HydrophobicContact CB-CB 3.89Å; M56-A62 HydrophobicContact CE-CB 4.2Å; A62-L133 HydrophobicContact CB-CD1 4.31Å; A62-L133 HydrophobicContact CB-CG 4.45Å; A62-D134 WeakPolarHBondContact CA-O 3.39Å; A62-D134 VanDerWaalsContact CB-O 3.27Å; A62-D134 WeakPolarHBondContact CB-O 3.21Å; A62-G136 CarbonylContact C-O 3.57Å; A62-G136 WeakPolarHBondContact CA-O 3.37Å
63	D	92.1	Very high	84.9	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	134.7	172.3	-78.7	-9.2	0	0	0	110.3	V48 K49 L133 D134 G136 E137 L139 K140 Y177	V48-D63 HydrophobicContact CG2-CB 4.17Å; K49-D63 CarbonylContact O-C 3.59Å; K49-D63 WeakPolarHBondContact O-CA 3.31Å; D63-L133 WeakPolarHBondContact O-CA 3.27Å; D63-D134 HydrophobicContact CB-CB 4.44Å; D63-D134 PolarHBondContact N-O 2.83Å; D63-D134 PolarHBondContact O-N 3Å; D63-G136 PolarHBondContact N-O 3.11Å; D63-E137 VanDerWaalsContact OD2-CA 3.32Å; D63-E137 WeakPolarHBondContact OD2-CA 2.97Å; D63-L139 HydrophobicContact CB-CB 3.84Å; D63-L139 HydrophobicContact CB-CD1 4.04Å; D63-L139 HydrophobicContact CB-CG 4.29Å; D63-L139 PolarHBondContact OD2-N 3.32Å; D63-K140 PolarHBondContact OD2-N 2.89Å; D63-Y177 WeakPolarHBondContact OD1-CE1 3.42Å; D63-Y177 VanDerWaalsContact OD1-CZ 3.28Å; D63-Y177 PolarHBondContact OD1-OH 2.67Å; D63-Y177 PolarHBondContact OD2-OH 3.24Å
64	L	92.1	Very high	85.9	Confident	21 Å²	21	53 Å²	53	11%	0.11	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	114.5	169.2	-176.6	152.4	0	0	0	108.2	V48 K49 L51 A66 Y131 L132	V48-L64 CarbonylContact C-O 3.57Å; V48-L64 WeakPolarHBondContact CA-O 3.29Å; K49-L64 PolarHBondContact N-O 3.1Å; K49-L64 PolarHBondContact O-N 2.95Å; L51-L64 HydrophobicContact CD1-CB 3.77Å; L51-L64 HydrophobicContact CD1-CD1 3.66Å; L51-L64 HydrophobicContact CD1-CG 4.36Å; L51-L64 HydrophobicContact CG-CB 4.13Å; L64-A66 HydrophobicContact CD2-CB 4.36Å; L64-Y131 HydrophobicContact CD1-CD1 4.46Å; L64-Y131 HydrophobicContact CD1-CD2 4.31Å; L64-Y131 HydrophobicContact CD1-CG 3.93Å; L64-Y131 HydrophobicContact CD2-CD1 4.11Å; L64-Y131 HydrophobicContact CD2-CG 4.32Å; L64-Y131 HydrophobicContact CG-CG 4.3Å; L64-L132 WeakPolarHBondContact CA-O 3.47Å
65	A	92.7	Very high	87.1	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	142.2	170.9	0	0	0	0	0	111	T47 M128 L132 L139 I173	T47-A65 CarbonylContact O-C 3.48Å; T47-A65 VanDerWaalsContact O-CA 3.29Å; T47-A65 WeakPolarHBondContact O-CA 3.38Å; A65-M128 WeakPolarHBondContact O-CE 3.22Å; A65-L132 HydrophobicContact CB-CB 4.12Å; A65-L132 HydrophobicContact CB-CD2 4.04Å; A65-L132 HydrophobicContact CB-CG 4.28Å; A65-L132 PolarHBondContact N-O 2.76Å; A65-L132 PolarHBondContact O-N 2.84Å; A65-L139 HydrophobicContact CB-CD1 4.01Å; A65-I173 HydrophobicContact CB-CD1 4.23Å
66	A	92.3	Very high	88.4	Confident	10 Å²	10	46.1 Å²	46.1	8%	0.083	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	139	175.5	0	0	0	0	0	112.9	A46 T47 L64 M128 Y131 V182	A46-A66 WeakPolarHBondContact CA-O 3.37Å; T47-A66 PolarHBondContact N-O 2.8Å; T47-A66 PolarHBondContact O-N 3.27Å; L64-A66 HydrophobicContact CD2-CB 4.36Å; A66-M128 HydrophobicContact CB-CE 3.64Å; A66-Y131 HydrophobicContact CB-CD1 4.28Å; A66-V182 HydrophobicContact CB-CG1 3.85Å
67	F	93.7	Very high	89.8	Confident	11 Å²	11	45.1 Å²	45.1	5%	0.048	25%	0.254	C	S	.	.			trans	-153.7	166.3	177	52.6	-87.3	0	0	0	109	A46 I106 M128 L132 L147 L171	A46-F67 HydrophobicContact CB-CB 4.21Å; A46-F67 HydrophobicContact CB-CD1 4.27Å; F67-I106 HydrophobicContact CE2-CD1 3.73Å; F67-I106 HydrophobicContact CZ-CD1 3.58Å; F67-M128 HydrophobicContact CD1-SD 4Å; F67-M128 HydrophobicContact CE1-SD 3.8Å; F67-M128 HydrophobicContact CE2-SD 4.37Å; F67-M128 HydrophobicContact CG-SD 4.37Å; F67-M128 HydrophobicContact CZ-SD 4Å; F67-M128 WeakPolarHBondContact O-CG 3.36Å; F67-L132 HydrophobicContact CE1-CD2 4.44Å; F67-L147 HydrophobicContact CE2-CD1 3.66Å; F67-L147 HydrophobicContact CE2-CD2 4.13Å; F67-L147 HydrophobicContact CZ-CD1 4.1Å; F67-L147 HydrophobicContact CZ-CD2 3.7Å; F67-L171 HydrophobicContact CD1-CD2 3.44Å; F67-L171 VanDerWaalsContact CD1-CD2 3.44Å; F67-L171 HydrophobicContact CD2-CD2 4.23Å; F67-L171 HydrophobicContact CE1-CD2 3.41Å; F67-L171 VanDerWaalsContact CE1-CD2 3.41Å; F67-L171 HydrophobicContact CE2-CD2 4.21Å; F67-L171 HydrophobicContact CG-CD2 3.87Å; F67-L171 HydrophobicContact CZ-CD2 3.82Å
68	T	95.2	Very high	91.1	Very high	34 Å²	34	43.5 Å²	43.5	21%	0.209	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	157.8	166.8	62.8	0	0	0	0	110.2	S43 S44 N125 G126	S43-T68 CarbonylContact C-O 3.48Å; S43-T68 WeakPolarHBondContact CA-O 3.49Å; S44-T68 WeakPolarHBondContact CB-OG1 3.28Å; S44-T68 PolarHBondContact N-O 3.41Å; S44-T68 PolarHBondContact OG-N 3.41Å; S44-T68 PolarHBondContact OG-O 3.09Å; S44-T68 PolarHBondContact OG-OG1 3Å; T68-N125 WeakPolarHBondContact CB-OD1 3.39Å; T68-N125 WeakPolarHBondContact CG2-OD1 3.12Å; T68-N125 PolarHBondContact OG1-OD1 3.27Å; T68-G126 CarbonylContact C-O 3.51Å; T68-G126 WeakPolarHBondContact CA-O 3.46Å; T68-G126 WeakPolarHBondContact CB-O 3.43Å
69	F	96.1	Very high	92.4	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.009	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	148.8	-178.4	63.7	-89.5	0	0	0	111.9	T42 L71 L90 I106 W107 I123 G126 M128	T42-F69 CarbonylContact O-C 3.57Å; T42-F69 VanDerWaalsContact O-CA 3.27Å; T42-F69 WeakPolarHBondContact O-CA 3.41Å; F69-L71 HydrophobicContact CD2-CB 3.93Å; F69-L71 HydrophobicContact CE2-CB 4.01Å; F69-L71 HydrophobicContact CE2-CD2 4.48Å; F69-L90 HydrophobicContact CD1-CD2 4.32Å; F69-L90 HydrophobicContact CD2-CD2 3.71Å; F69-L90 HydrophobicContact CE1-CD2 4.41Å; F69-L90 HydrophobicContact CE2-CD2 3.8Å; F69-L90 HydrophobicContact CG-CD2 3.99Å; F69-L90 HydrophobicContact CZ-CD2 4.17Å; F69-I106 HydrophobicContact CD1-CD1 4.49Å; F69-W107 HydrophobicContact CE1-CB 4.13Å; F69-W107 HydrophobicContact CE1-CG 4.48Å; F69-W107 HydrophobicContact CE2-CG 4.43Å; F69-W107 HydrophobicContact CZ-CB 3.67Å; F69-W107 AromaticContact CZ-CD1 3.87Å; F69-W107 HydrophobicContact CZ-CD2 4.25Å; F69-W107 AromaticContact CZ-CG 3.65Å; F69-W107 HydrophobicContact CZ-CG 3.65Å; F69-I123 HydrophobicContact CE2-CD1 4.34Å; F69-I123 HydrophobicContact CE2-CG2 4.22Å; F69-G126 WeakPolarHBondContact CD1-O 3.47Å; F69-G126 PolarHBondContact N-O 2.79Å; F69-G126 WeakPolarHBondContact O-CA 3.36Å; F69-G126 PolarHBondContact O-N 2.82Å; F69-M128 HydrophobicContact CE1-CG 4.46Å
70	D	97.5	Very high	93.3	Very high	42 Å²	42	31.9 Å²	31.9	23%	0.225	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	130.8	164.9	-73.1	4.7	0	0	0	107.8	V41 T42 I123 K124 N125	V41-D70 VanDerWaalsContact CA-O 3.27Å; V41-D70 WeakPolarHBondContact CA-O 3.27Å; T42-D70 PolarHBondContact N-O 3.46Å; T42-D70 PolarHBondContact O-N 2.76Å; T42-D70 WeakPolarHBondContact OG1-CB 3.43Å; D70-I123 CarbonylContact C-O 3.54Å; D70-I123 VanDerWaalsContact CA-O 3.22Å; D70-I123 WeakPolarHBondContact CA-O 3.35Å; D70-K124 HydrophobicContact CB-CD 4.16Å; D70-K124 VanDerWaalsContact CG-CD 3.47Å; D70-K124 WeakPolarHBondContact OD1-CA 3.39Å; D70-K124 WeakPolarHBondContact OD2-CD 3.49Å; D70-K124 IonicContact OD2-NZ 2.83Å; D70-K124 PolarHBondContact OD2-NZ 3.39Å; D70-N125 PolarHBondContact OD1-N 2.96Å
71	L	97.7	Very high	94	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	126.9	-179.8	178.2	64.4	0	0	0	110	F39 V41 F69 W107 I121 N122 I123 L149	F39-L71 HydrophobicContact CD2-CD1 4.15Å; V41-L71 HydrophobicContact CB-CD1 4.07Å; V41-L71 HydrophobicContact CG2-CD1 4.39Å; F69-L71 HydrophobicContact CD2-CB 3.93Å; F69-L71 HydrophobicContact CE2-CB 4.01Å; F69-L71 HydrophobicContact CE2-CD2 4.48Å; L71-W107 HydrophobicContact CD2-CE3 4.04Å; L71-W107 HydrophobicContact CD2-CH2 4.33Å; L71-W107 HydrophobicContact CD2-CZ3 3.71Å; L71-I121 HydrophobicContact CB-CG2 4.5Å; L71-I121 HydrophobicContact CD2-CG2 3.96Å; L71-I121 HydrophobicContact CG-CG2 4.02Å; L71-N122 CarbonylContact O-C 3.51Å; L71-N122 WeakPolarHBondContact O-CA 3.35Å; L71-I123 HydrophobicContact CB-CB 4.3Å; L71-I123 HydrophobicContact CD2-CD1 4.47Å; L71-I123 PolarHBondContact N-O 3.01Å; L71-I123 PolarHBondContact O-N 2.95Å; L71-L149 HydrophobicContact CD1-CD1 4.18Å; L71-L149 HydrophobicContact CD1-CD2 4.09Å; L71-L149 HydrophobicContact CD2-CD1 3.79Å
72	Q	97.6	Very high	94.4	Very high	79 Å²	79	33.7 Å²	33.7	37%	0.369	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	123.9	175.8	-65.6	-175	-2.7	0	0	110.7	F39 S40 I121 N122	F39-Q72 WeakPolarHBondContact CA-O 3.4Å; S40-Q72 PolarHBondContact N-O 3.34Å; S40-Q72 PolarHBondContact O-N 2.89Å; Q72-I121 VanDerWaalsContact CA-O 3.27Å; Q72-I121 WeakPolarHBondContact CA-O 3.39Å; Q72-N122 PolarHBondContact NE2-OD1 3.37Å
73	A	97.2	Very high	94.6	Very high	8 Å²	8	33.4 Å²	33.4	7%	0.066	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	144.9	176.5	0	0	0	0	0	110.4	F39 F75 I121 L149	F39-A73 HydrophobicContact CB-CB 3.93Å; A73-F75 HydrophobicContact CB-CD2 4.2Å; A73-F75 HydrophobicContact CB-CE2 3.45Å; A73-F75 VanDerWaalsContact CB-CE2 3.45Å; A73-F75 HydrophobicContact CB-CZ 3.82Å; A73-I121 PolarHBondContact N-O 3.24Å; A73-I121 PolarHBondContact O-N 3.35Å; A73-L149 HydrophobicContact CB-CD2 3.83Å
74	D	97.1	Very high	94.8	Very high	59 Å²	59	37.8 Å²	37.8	32%	0.316	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	109.9	177.7	-175.3	-3.4	0	0	0	110.2	R76	D74-R76 VanDerWaalsContact OD1-CB 3.3Å; D74-R76 WeakPolarHBondContact OD1-CB 3.41Å; D74-R76 VanDerWaalsContact OD1-CG 3.24Å; D74-R76 WeakPolarHBondContact OD1-CG 3.39Å; D74-R76 IonicContact OD1-CZ 3.28Å; D74-R76 PolarHBondContact OD1-N 2.98Å; D74-R76 IonicContact OD1-NE 3.11Å; D74-R76 PolarHBondContact OD1-NE 2.91Å; D74-R76 IonicContact OD1-NH2 2.66Å; D74-R76 IonicContact OD2-CZ 2.89Å; D74-R76 VanDerWaalsContact OD2-CZ 3.28Å; D74-R76 IonicContact OD2-NE 3.95Å; D74-R76 PolarHBondContact OD2-NE 2.82Å; D74-R76 VanDerWaalsContact OD2-NE 3.11Å; D74-R76 IonicContact OD2-NH2 3.86Å; D74-R76 PolarHBondContact OD2-NH2 2.65Å
75	F	97.2	Very high	95.1	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.185	C	C	.	.			trans	-99.8	2.5	-177.8	-65	-76.2	0	0	0	113.5	V37 A73 S77 L78 L86 I88 I111 H119 I121 L149 W151	V37-F75 HydrophobicContact CG2-CD1 3.78Å; V37-F75 HydrophobicContact CG2-CE1 3.57Å; V37-F75 HydrophobicContact CG2-CZ 4.36Å; A73-F75 HydrophobicContact CB-CD2 4.2Å; A73-F75 HydrophobicContact CB-CE2 3.45Å; A73-F75 VanDerWaalsContact CB-CE2 3.45Å; A73-F75 HydrophobicContact CB-CZ 3.82Å; F75-S77 PolarHBondContact O-N 2.98Å; F75-S77 VanDerWaalsContact O-N 3.13Å; F75-L78 HydrophobicContact CD1-CD1 3.64Å; F75-L78 HydrophobicContact CD1-CG 4.31Å; F75-L78 HydrophobicContact CE1-CD1 4.29Å; F75-L78 WeakPolarHBondContact O-CB 3.33Å; F75-L78 PolarHBondContact O-N 2.89Å; F75-L86 HydrophobicContact CB-CD1 3.86Å; F75-L86 HydrophobicContact CD1-CD1 4.15Å; F75-L86 HydrophobicContact CG-CD1 4.21Å; F75-I88 HydrophobicContact CD1-CD1 4.2Å; F75-I88 HydrophobicContact CD2-CD1 3.72Å; F75-I88 HydrophobicContact CE1-CD1 4.1Å; F75-I88 HydrophobicContact CE1-CG1 4.2Å; F75-I88 HydrophobicContact CE2-CD1 3.63Å; F75-I88 HydrophobicContact CE2-CG1 4.28Å; F75-I88 HydrophobicContact CE2-CG2 4.33Å; F75-I88 HydrophobicContact CG-CD1 4Å; F75-I88 HydrophobicContact CZ-CD1 3.8Å; F75-I88 HydrophobicContact CZ-CG1 3.98Å; F75-I88 HydrophobicContact CZ-CG2 4.02Å; F75-I111 HydrophobicContact CD2-CD1 4.03Å; F75-H119 WeakPolarHBondContact CA-O 3.21Å; F75-H119 WeakPolarHBondContact CB-O 3.22Å; F75-H119 PolarHBondContact N-O 2.89Å; F75-I121 HydrophobicContact CD2-CD1 3.94Å; F75-I121 HydrophobicContact CD2-CG1 4.22Å; F75-I121 HydrophobicContact CE2-CD1 3.49Å; F75-I121 VanDerWaalsContact CE2-CD1 3.49Å; F75-I121 HydrophobicContact CE2-CG1 4.12Å; F75-L149 HydrophobicContact CE2-CD2 4.34Å; F75-L149 HydrophobicContact CZ-CD2 3.73Å; F75-W151 AromaticContact CE1-CD2 3.69Å; F75-W151 HydrophobicContact CE1-CD2 3.69Å; F75-W151 AromaticContact CE1-CE3 3.55Å; F75-W151 HydrophobicContact CE1-CE3 3.55Å; F75-W151 HydrophobicContact CE1-CG 4.27Å; F75-W151 HydrophobicContact CE1-CH2 4.14Å; F75-W151 HydrophobicContact CE1-CZ2 4.27Å; F75-W151 AromaticContact CE1-CZ3 3.79Å; F75-W151 HydrophobicContact CE1-CZ3 3.79Å; F75-W151 HydrophobicContact CZ-CD2 4.46Å; F75-W151 AromaticContact CZ-CE3 3.94Å; F75-W151 HydrophobicContact CZ-CE3 3.94Å; F75-W151 HydrophobicContact CZ-CZ3 4.15Å
76	R	96.2	Very high	95.3	Very high	150 Å²	150	39 Å²	39	57%	0.566	19%	0.185	S	C	*	.	G	3₁₀ helix	trans	-55.8	-35.3	-178.5	-68.2	177.6	-66	174.7	0.6	112.3	D74 L78 F79 H119 V120	D74-R76 VanDerWaalsContact OD1-CB 3.3Å; D74-R76 WeakPolarHBondContact OD1-CB 3.41Å; D74-R76 VanDerWaalsContact OD1-CG 3.24Å; D74-R76 WeakPolarHBondContact OD1-CG 3.39Å; D74-R76 IonicContact OD1-CZ 3.28Å; D74-R76 PolarHBondContact OD1-N 2.98Å; D74-R76 IonicContact OD1-NE 3.11Å; D74-R76 PolarHBondContact OD1-NE 2.91Å; D74-R76 IonicContact OD1-NH2 2.66Å; D74-R76 IonicContact OD2-CZ 2.89Å; D74-R76 VanDerWaalsContact OD2-CZ 3.28Å; D74-R76 IonicContact OD2-NE 3.95Å; D74-R76 PolarHBondContact OD2-NE 2.82Å; D74-R76 VanDerWaalsContact OD2-NE 3.11Å; D74-R76 IonicContact OD2-NH2 3.86Å; D74-R76 PolarHBondContact OD2-NH2 2.65Å; R76-L78 PolarHBondContact O-N 2.88Å; R76-F79 PolarHBondContact O-N 2.82Å; R76-H119 HydrophobicContact CG-CB 3.58Å; R76-V120 HydrophobicContact CG-CG2 4.04Å
77	S	94.3	Very high	95.6	Very high	72 Å²	72	41.5 Å²	41.5	50%	0.503	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-68	-18.6	178.5	60.5	0	0	0	0	114	R33 V37 F75	R33-S77 PolarHBondContact NH2-O 3.33Å; V37-S77 WeakPolarHBondContact CG1-OG 3.36Å; F75-S77 PolarHBondContact O-N 2.98Å; F75-S77 VanDerWaalsContact O-N 3.13Å
78	L	94.8	Very high	95.8	Very high	4 Å²	4	41 Å²	41	2%	0.021	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-85.1	-26.6	179.5	-58.2	-162.8	0	0	0	112.6	Y35 V37 F75 R76 D80 T83 L86 W151	Y35-L78 HydrophobicContact CD1-CB 4.35Å; Y35-L78 HydrophobicContact CD1-CD2 4.16Å; Y35-L78 HydrophobicContact CG-CD2 4.46Å; V37-L78 HydrophobicContact CG1-CD1 4.36Å; V37-L78 HydrophobicContact CG1-CD2 3.72Å; V37-L78 HydrophobicContact CG1-CG 3.94Å; F75-L78 HydrophobicContact CD1-CD1 3.64Å; F75-L78 HydrophobicContact CD1-CG 4.31Å; F75-L78 HydrophobicContact CE1-CD1 4.29Å; F75-L78 WeakPolarHBondContact O-CB 3.33Å; F75-L78 PolarHBondContact O-N 2.89Å; R76-L78 PolarHBondContact O-N 2.88Å; L78-D80 PolarHBondContact O-N 2.85Å; L78-D80 VanDerWaalsContact O-N 3.08Å; L78-T83 PolarHBondContact O-OG1 3.06Å; L78-L86 HydrophobicContact CB-CD1 4.06Å; L78-L86 HydrophobicContact CD1-CD1 4.13Å; L78-W151 HydrophobicContact CD1-CZ2 4.22Å; L78-W151 VanDerWaalsContact CD1-NE1 3.31Å
79	F	94.7	Very high	95.9	Very high	30 Å²	30	41.1 Å²	41.1	13%	0.132	19%	0.189	C	C	.	.			trans	-77.9	93.6	177	-74.7	-78	0	0	0	111.3	R76 T83 L86 I111 R113 H119	R76-F79 PolarHBondContact O-N 2.82Å; F79-T83 HydrophobicContact CD1-CG2 3.94Å; F79-T83 HydrophobicContact CE1-CG2 4.19Å; F79-L86 HydrophobicContact CD2-CD1 4.23Å; F79-L86 HydrophobicContact CE1-CG 4.22Å; F79-L86 HydrophobicContact CE2-CD1 3.53Å; F79-L86 HydrophobicContact CE2-CG 4Å; F79-L86 HydrophobicContact CZ-CB 4.34Å; F79-L86 HydrophobicContact CZ-CD1 3.74Å; F79-L86 HydrophobicContact CZ-CG 3.66Å; F79-I111 HydrophobicContact CE2-CB 4.43Å; F79-I111 HydrophobicContact CE2-CG2 3.65Å; F79-I111 HydrophobicContact CZ-CB 4.13Å; F79-I111 HydrophobicContact CZ-CG2 3.58Å; F79-R113 HydrophobicContact CD1-CB 3.83Å; F79-R113 HydrophobicContact CD1-CG 4.19Å; F79-R113 HydrophobicContact CE1-CB 3.98Å; F79-H119 HydrophobicContact CD2-CB 4.49Å; F79-H119 AromaticContact CD2-CD2 3.89Å; F79-H119 AromaticContact CD2-CE1 3.45Å; F79-H119 VanDerWaalsContact CD2-CE1 3.45Å; F79-H119 WeakPolarHBondContact CD2-CE1 3.22Å; F79-H119 AromaticContact CD2-CG 3.71Å; F79-H119 AromaticContact CD2-ND1 3.45Å; F79-H119 WeakPolarHBondContact CD2-ND1 3.46Å; F79-H119 AromaticContact CD2-NE2 3.73Å; F79-H119 HydrophobicContact CE2-CB 4.47Å; F79-H119 AromaticContact CE2-CD2 3.55Å; F79-H119 AromaticContact CE2-CE1 3.84Å; F79-H119 AromaticContact CE2-CG 3.75Å; F79-H119 AromaticContact CE2-ND1 3.95Å; F79-H119 AromaticContact CE2-NE2 3.6Å; F79-H119 AromaticContact CG-CE1 3.69Å; F79-H119 AromaticContact CZ-NE2 3.91Å
80	D	90	Very high	96	Very high	22 Å²	22	41 Å²	41	12%	0.118	19%	0.188	C	C	.	.			trans	-96.6	-167.1	170.9	67.6	10.1	0	0	0	112.9	R33 L78 N82 T83 R113	R33-D80 WeakPolarHBondContact CD-OD2 3.27Å; R33-D80 IonicContact CZ-OD2 3.34Å; R33-D80 IonicContact NE-OD2 3.54Å; R33-D80 IonicContact NH1-OD2 2.8Å; R33-D80 PolarHBondContact NH1-OD2 3.13Å; L78-D80 PolarHBondContact O-N 2.85Å; L78-D80 VanDerWaalsContact O-N 3.08Å; D80-N82 PolarHBondContact O-N 2.87Å; D80-N82 PolarHBondContact OD1-N 3.25Å; D80-T83 WeakPolarHBondContact OD1-CB 3.36Å; D80-T83 PolarHBondContact OD1-N 2.69Å; D80-T83 PolarHBondContact OD1-OG1 3.34Å; D80-R113 PolarHBondContact O-NH1 3.02Å; D80-R113 PolarHBondContact O-NH2 2.83Å
81	W	91.2	Very high	96	Very high	153 Å²	153	39.9 Å²	39.9	58%	0.58	18%	0.181	S	C	*	.	S	Bend	trans	-64.6	-22.2	179.2	63.8	-96.8	0	0	0	113	C26 S29 R113	C26-W81 HydrophobicContact CB-CH2 4.06Å; C26-W81 HydrophobicContact CB-CZ3 4.31Å; S29-W81 WeakPolarHBondContact OG-CH2 3.4Å; S29-W81 VanDerWaalsContact OG-CZ2 3.26Å; S29-W81 WeakPolarHBondContact OG-CZ2 3.1Å; W81-R113 PolarHBondContact O-NH1 3.5Å; W81-R113 PolarHBondContact O-NH2 2.99Å
82	N	93.2	Very high	96	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.021	18%	0.181	C	C	.	.	S	Bend	trans	-103.8	-29.5	-176.8	-162.2	18.6	0	0	0	114.1	C26 T30 D80 K84 R113 P155 N156 A157	C26-N82 PolarHBondContact O-ND2 2.87Å; T30-N82 WeakPolarHBondContact CG2-ND2 3.36Å; D80-N82 PolarHBondContact O-N 2.87Å; D80-N82 PolarHBondContact OD1-N 3.25Å; N82-K84 PolarHBondContact O-N 3.34Å; N82-R113 PolarHBondContact O-NH2 3.21Å; N82-P155 CarbonylContact O-C 3.54Å; N82-P155 WeakPolarHBondContact O-CA 3.38Å; N82-N156 PolarHBondContact O-N 3.04Å; N82-N156 PolarHBondContact O-ND2 2.86Å; N82-N156 VanDerWaalsContact O-ND2 3.14Å; N82-N156 PolarHBondContact OD1-N 3.46Å; N82-A157 PolarHBondContact ND2-O 3.44Å; N82-A157 PolarHBondContact OD1-N 2.94Å
83	T	94.9	Very high	95.9	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	111	-176.2	-57.2	0	0	0	0	112.5	L78 F79 D80 L86 R113 V153	L78-T83 PolarHBondContact O-OG1 3.06Å; F79-T83 HydrophobicContact CD1-CG2 3.94Å; F79-T83 HydrophobicContact CE1-CG2 4.19Å; D80-T83 WeakPolarHBondContact OD1-CB 3.36Å; D80-T83 PolarHBondContact OD1-N 2.69Å; D80-T83 PolarHBondContact OD1-OG1 3.34Å; T83-L86 HydrophobicContact CG2-CD2 3.91Å; T83-L86 HydrophobicContact CG2-CG 4.48Å; T83-R113 PolarHBondContact O-NE 3.48Å; T83-R113 PolarHBondContact O-NH2 2.86Å; T83-V153 HydrophobicContact CG2-CG1 3.8Å
84	K	96	Very high	95.8	Very high	92 Å²	92	39 Å²	39	40%	0.4	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-50.6	-175.7	-177.7	-171.8	167.9	-161.4	0	111.5	N82 R113 I154 N156	N82-K84 PolarHBondContact O-N 3.34Å; K84-R113 VanDerWaalsContact O-CB 3.31Å; K84-R113 WeakPolarHBondContact O-CB 3.27Å; K84-R113 PolarHBondContact O-N 3.11Å; K84-I154 WeakPolarHBondContact CB-O 3.26Å; K84-I154 PolarHBondContact N-O 2.66Å; K84-N156 WeakPolarHBondContact CB-OD1 3.48Å
85	E	97	Very high	95.7	Very high	47 Å²	47	42.7 Å²	42.7	22%	0.22	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	157.1	-175.3	65.3	-170.7	-170.2	0	0	110.6	I111 L112 I154	E85-I111 CarbonylContact C-O 3.57Å; E85-I111 VanDerWaalsContact CA-O 3.29Å; E85-I111 WeakPolarHBondContact CA-O 3.43Å; E85-L112 HydrophobicContact CB-CD2 3.82Å; E85-I154 HydrophobicContact CG-CB 3.52Å; E85-I154 HydrophobicContact CG-CD1 3.85Å; E85-I154 HydrophobicContact CG-CG1 4.18Å; E85-I154 HydrophobicContact CG-CG2 3.79Å; E85-I154 PolarHBondContact N-O 2.92Å; E85-I154 PolarHBondContact O-N 2.87Å; E85-I154 VanDerWaalsContact OE1-CD1 3.25Å; E85-I154 WeakPolarHBondContact OE1-CD1 3.48Å
86	L	97.8	Very high	95.5	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	128.9	173	-60.4	177.6	0	0	0	108.6	F75 L78 F79 T83 I88 I110 I111 N152 V153	F75-L86 HydrophobicContact CB-CD1 3.86Å; F75-L86 HydrophobicContact CD1-CD1 4.15Å; F75-L86 HydrophobicContact CG-CD1 4.21Å; L78-L86 HydrophobicContact CB-CD1 4.06Å; L78-L86 HydrophobicContact CD1-CD1 4.13Å; F79-L86 HydrophobicContact CD2-CD1 4.23Å; F79-L86 HydrophobicContact CE1-CG 4.22Å; F79-L86 HydrophobicContact CE2-CD1 3.53Å; F79-L86 HydrophobicContact CE2-CG 4Å; F79-L86 HydrophobicContact CZ-CB 4.34Å; F79-L86 HydrophobicContact CZ-CD1 3.74Å; F79-L86 HydrophobicContact CZ-CG 3.66Å; T83-L86 HydrophobicContact CG2-CD2 3.91Å; T83-L86 HydrophobicContact CG2-CG 4.48Å; L86-I88 HydrophobicContact CB-CD1 4.02Å; L86-I88 HydrophobicContact CB-CG1 4.17Å; L86-I88 HydrophobicContact CD1-CD1 4.38Å; L86-I110 CarbonylContact O-C 3.55Å; L86-I110 WeakPolarHBondContact O-CA 3.37Å; L86-I111 HydrophobicContact CB-CB 4.46Å; L86-I111 PolarHBondContact N-O 3.13Å; L86-I111 PolarHBondContact O-N 3.41Å; L86-N152 WeakPolarHBondContact CA-O 3.49Å; L86-V153 HydrophobicContact CD2-CB 4.11Å; L86-V153 HydrophobicContact CD2-CG1 4.03Å; L86-V153 HydrophobicContact CD2-CG2 3.86Å
87	F	98.1	Very high	95.1	Very high	63 Å²	63	42.3 Å²	42.3	28%	0.276	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	105.6	166.3	175.4	-110.7	0	0	0	108.5	Y89 D108 I110 W151 N152	F87-Y89 AromaticContact CD1-CD1 3.75Å; F87-Y89 HydrophobicContact CD1-CD1 3.75Å; F87-Y89 HydrophobicContact CD1-CE1 4.22Å; F87-Y89 AromaticContact CE1-CD1 3.57Å; F87-Y89 HydrophobicContact CE1-CD1 3.57Å; F87-Y89 HydrophobicContact CE1-CE1 4.23Å; F87-Y89 HydrophobicContact CE1-CG 4.21Å; F87-Y89 HydrophobicContact CZ-CD1 4.44Å; F87-D108 HydrophobicContact CE2-CB 3.84Å; F87-D108 HydrophobicContact CZ-CB 4.03Å; F87-I110 HydrophobicContact CD2-CG1 3.86Å; F87-W151 CarbonylContact O-C 3.52Å; F87-W151 WeakPolarHBondContact O-CA 3.39Å; F87-W151 WeakPolarHBondContact O-CB 3.45Å; F87-N152 HydrophobicContact CB-CB 4.3Å; F87-N152 PolarHBondContact N-O 3.41Å; F87-N152 PolarHBondContact O-N 3.33Å
88	I	97.9	Very high	94.8	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	137.7	-176.9	-65.3	148.6	0	0	0	108.7	F75 L86 W107 D108 K109 I111 I121 L149 W151	F75-I88 HydrophobicContact CD1-CD1 4.2Å; F75-I88 HydrophobicContact CD2-CD1 3.72Å; F75-I88 HydrophobicContact CE1-CD1 4.1Å; F75-I88 HydrophobicContact CE1-CG1 4.2Å; F75-I88 HydrophobicContact CE2-CD1 3.63Å; F75-I88 HydrophobicContact CE2-CG1 4.28Å; F75-I88 HydrophobicContact CE2-CG2 4.33Å; F75-I88 HydrophobicContact CG-CD1 4Å; F75-I88 HydrophobicContact CZ-CD1 3.8Å; F75-I88 HydrophobicContact CZ-CG1 3.98Å; F75-I88 HydrophobicContact CZ-CG2 4.02Å; L86-I88 HydrophobicContact CB-CD1 4.02Å; L86-I88 HydrophobicContact CB-CG1 4.17Å; L86-I88 HydrophobicContact CD1-CD1 4.38Å; I88-W107 HydrophobicContact CG2-CZ3 4.16Å; I88-D108 CarbonylContact O-C 3.53Å; I88-D108 VanDerWaalsContact O-CA 3.22Å; I88-D108 WeakPolarHBondContact O-CA 3.16Å; I88-K109 PolarHBondContact N-O 3.32Å; I88-K109 PolarHBondContact O-N 3.41Å; I88-I111 HydrophobicContact CD1-CB 4.41Å; I88-I111 HydrophobicContact CD1-CD1 3.16Å; I88-I111 HydrophobicContact CD1-CG1 3.74Å; I88-I121 HydrophobicContact CD1-CD1 4.07Å; I88-I121 HydrophobicContact CG2-CD1 4.24Å; I88-L149 HydrophobicContact CG2-CD1 3.66Å; I88-L149 HydrophobicContact CG2-CG 4.16Å; I88-W151 HydrophobicContact CB-CB 4.28Å; I88-W151 HydrophobicContact CG1-CB 3.59Å; I88-W151 HydrophobicContact CG1-CG 4.44Å
89	Y	98.1	Very high	94.6	Very high	36 Å²	36	48.6 Å²	48.6	14%	0.141	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	136.8	179.3	57.5	-83.6	0	0	0	110.7	F87 Y91 I105 W107 A150 F162	F87-Y89 AromaticContact CD1-CD1 3.75Å; F87-Y89 HydrophobicContact CD1-CD1 3.75Å; F87-Y89 HydrophobicContact CD1-CE1 4.22Å; F87-Y89 AromaticContact CE1-CD1 3.57Å; F87-Y89 HydrophobicContact CE1-CD1 3.57Å; F87-Y89 HydrophobicContact CE1-CE1 4.23Å; F87-Y89 HydrophobicContact CE1-CG 4.21Å; F87-Y89 HydrophobicContact CZ-CD1 4.44Å; Y89-Y91 AromaticContact CD2-CD1 3.85Å; Y89-Y91 HydrophobicContact CD2-CD1 3.85Å; Y89-Y91 AromaticContact CE2-CD1 3.76Å; Y89-Y91 HydrophobicContact CE2-CD1 3.76Å; Y89-Y91 HydrophobicContact CE2-CE1 4.12Å; Y89-I105 HydrophobicContact CD2-CD1 4.06Å; Y89-I105 HydrophobicContact CD2-CG1 4.02Å; Y89-I105 HydrophobicContact CG-CD1 4.37Å; Y89-W107 CarbonylContact C-O 3.56Å; Y89-W107 VanDerWaalsContact CA-O 3.27Å; Y89-W107 WeakPolarHBondContact CA-O 3.36Å; Y89-A150 HydrophobicContact CD2-CB 4.42Å; Y89-A150 HydrophobicContact CE1-CB 4.22Å; Y89-A150 HydrophobicContact CE2-CB 3.73Å; Y89-A150 PolarHBondContact N-O 3.47Å; Y89-A150 PolarHBondContact O-N 2.93Å; Y89-A150 VanDerWaalsContact O-O 3.05Å; Y89-F162 HydrophobicContact CE1-CD1 4.34Å; Y89-F162 HydrophobicContact CE1-CE1 4.46Å
90	L	97.9	Very high	94.5	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	125.5	171.9	-178.5	68.9	0	0	0	107.1	V41 F69 I106 W107 L147 L149	V41-L90 HydrophobicContact CG2-CD1 4.32Å; V41-L90 HydrophobicContact CG2-CD2 4.35Å; F69-L90 HydrophobicContact CD1-CD2 4.32Å; F69-L90 HydrophobicContact CD2-CD2 3.71Å; F69-L90 HydrophobicContact CE1-CD2 4.41Å; F69-L90 HydrophobicContact CE2-CD2 3.8Å; F69-L90 HydrophobicContact CG-CD2 3.99Å; F69-L90 HydrophobicContact CZ-CD2 4.17Å; L90-I106 HydrophobicContact CB-CG1 4.27Å; L90-I106 HydrophobicContact CD2-CD1 3.73Å; L90-I106 HydrophobicContact CD2-CG1 4.06Å; L90-I106 HydrophobicContact CG-CD1 3.96Å; L90-I106 HydrophobicContact CG-CG1 3.97Å; L90-I106 WeakPolarHBondContact O-CG1 3.4Å; L90-I106 PolarHBondContact O-N 3.2Å; L90-W107 HydrophobicContact CB-CB 4.29Å; L90-W107 HydrophobicContact CB-CE3 4.19Å; L90-W107 PolarHBondContact N-O 3.05Å; L90-W107 PolarHBondContact O-N 2.8Å; L90-L147 HydrophobicContact CD1-CB 4.37Å; L90-L149 HydrophobicContact CB-CD1 4.1Å; L90-L149 HydrophobicContact CD1-CB 4.37Å; L90-L149 HydrophobicContact CD1-CD1 4.27Å
91	Y	97.4	Very high	94.7	Very high	19 Å²	19	56.3 Å²	56.3	8%	0.075	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	151.7	178.2	66.3	-84	0	0	0	111.2	Y89 E93 Q103 V104 L147 I148 A150	Y89-Y91 AromaticContact CD2-CD1 3.85Å; Y89-Y91 HydrophobicContact CD2-CD1 3.85Å; Y89-Y91 AromaticContact CE2-CD1 3.76Å; Y89-Y91 HydrophobicContact CE2-CD1 3.76Å; Y89-Y91 HydrophobicContact CE2-CE1 4.12Å; Y91-E93 HydrophobicContact CD2-CB 4.42Å; Y91-E93 HydrophobicContact CE2-CB 4.22Å; Y91-Q103 HydrophobicContact CD2-CB 4.22Å; Y91-Q103 HydrophobicContact CD2-CG 4.13Å; Y91-Q103 HydrophobicContact CE2-CG 4.12Å; Y91-V104 CarbonylContact C-O 3.59Å; Y91-V104 WeakPolarHBondContact CA-O 3.01Å; Y91-V104 WeakPolarHBondContact CB-O 3.23Å; Y91-L147 WeakPolarHBondContact O-CA 3.3Å; Y91-I148 HydrophobicContact CD1-CB 4.45Å; Y91-I148 VanDerWaalsContact CD1-O 3.23Å; Y91-I148 WeakPolarHBondContact CD1-O 3.16Å; Y91-I148 HydrophobicContact CE1-CB 3.86Å; Y91-I148 HydrophobicContact CE1-CG2 3.85Å; Y91-I148 HydrophobicContact CE2-CB 3.95Å; Y91-I148 HydrophobicContact CE2-CD1 4.1Å; Y91-I148 HydrophobicContact CE2-CG1 4.45Å; Y91-I148 HydrophobicContact CE2-CG2 4.48Å; Y91-I148 PolarHBondContact N-O 2.91Å; Y91-I148 PolarHBondContact O-N 3.42Å; Y91-I148 WeakPolarHBondContact OH-CG2 3.39Å; Y91-A150 HydrophobicContact CD1-CB 4.37Å; Y91-A150 HydrophobicContact CE1-CB 3.7Å
92	A	96.9	Very high	94.9	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	130	171.1	0	0	0	0	0	108.8	Q103 V104 I106 L132 V145 T146 L147	A92-Q103 WeakPolarHBondContact O-CA 3.4Å; A92-V104 PolarHBondContact N-O 3.08Å; A92-V104 PolarHBondContact O-N 3.19Å; A92-I106 HydrophobicContact CB-CG2 4.37Å; A92-L132 HydrophobicContact CB-CD1 3.89Å; A92-L132 HydrophobicContact CB-CD2 4.16Å; A92-V145 HydrophobicContact CB-CG1 3.75Å; A92-T146 CarbonylContact C-O 3.49Å; A92-T146 WeakPolarHBondContact CA-O 3.24Å; A92-L147 HydrophobicContact CB-CD2 3.85Å
93	E	96.3	Very high	95.1	Very high	59 Å²	59	54.8 Å²	54.8	28%	0.276	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	129	176.3	-174.5	172.3	113.6	0	0	110.1	Y91 L101 N102 Q103 T146 I148	Y91-E93 HydrophobicContact CD2-CB 4.42Å; Y91-E93 HydrophobicContact CE2-CB 4.22Å; E93-L101 VanDerWaalsContact CD-CD1 3.45Å; E93-L101 HydrophobicContact CG-CD1 3.52Å; E93-N102 VanDerWaalsContact CA-O 3.28Å; E93-N102 WeakPolarHBondContact CA-O 3.35Å; E93-Q103 HydrophobicContact CB-CG 4.42Å; E93-Q103 HydrophobicContact CG-CG 4.15Å; E93-Q103 PolarHBondContact OE2-NE2 3.13Å; E93-T146 PolarHBondContact N-O 2.92Å; E93-T146 PolarHBondContact O-N 3.45Å; E93-I148 HydrophobicContact CB-CD1 4.26Å
94	Y	95.6	Very high	95.1	Very high	10 Å²	10	56.4 Å²	56.4	4%	0.039	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	166.6	179.6	63.6	-78.6	0	0	0	110.7	T96 N102 V104 L132 D134 L139	Y94-T96 HydrophobicContact CD2-CG2 3.9Å; Y94-T96 HydrophobicContact CE2-CG2 3.69Å; Y94-N102 HydrophobicContact CD1-CB 3.93Å; Y94-N102 HydrophobicContact CD2-CB 4.05Å; Y94-N102 HydrophobicContact CE1-CB 3.53Å; Y94-N102 HydrophobicContact CE2-CB 3.68Å; Y94-N102 WeakPolarHBondContact CE2-ND2 3.39Å; Y94-N102 HydrophobicContact CG-CB 4.16Å; Y94-N102 PolarHBondContact N-O 2.73Å; Y94-N102 PolarHBondContact O-N 3.21Å; Y94-V104 HydrophobicContact CE1-CG2 4.22Å; Y94-L132 HydrophobicContact CD1-CD1 4.49Å; Y94-L132 HydrophobicContact CE1-CD1 3.82Å; Y94-D134 WeakPolarHBondContact CE2-OD1 3.21Å; Y94-D134 WeakPolarHBondContact OH-CB 3.31Å; Y94-D134 PolarHBondContact OH-OD1 2.82Å; Y94-L139 HydrophobicContact CD1-CD2 4.43Å; Y94-L139 HydrophobicContact CD2-CD2 3.92Å; Y94-L139 HydrophobicContact CE1-CD2 4.22Å; Y94-L139 HydrophobicContact CE2-CD2 3.66Å; Y94-L139 HydrophobicContact CE2-CG 4.4Å; Y94-L139 HydrophobicContact CG-CD2 4.3Å
95	K	94.7	Very high	95.2	Very high	136 Å²	136	55.2 Å²	55.2	59%	0.591	28%	0.284	S	S	*	.			trans	-122.2	134.5	-179.8	175.9	175	178.1	-176.7	0	110	H142	K95-H142 PolarHBondContact O-NE2 2.82Å
96	T	92	Very high	95.1	Very high	18 Å²	18	53 Å²	53	11%	0.11	27%	0.274	C	S	.	.			trans	-112.6	176.4	173.2	60.1	0	0	0	0	110.3	Y94 N99 N102	Y94-T96 HydrophobicContact CD2-CG2 3.9Å; Y94-T96 HydrophobicContact CE2-CG2 3.69Å; T96-N99 PolarHBondContact N-O 2.94Å; T96-N99 VanDerWaalsContact O-O 3.09Å; T96-N99 PolarHBondContact OG1-N 2.76Å; T96-N99 VanDerWaalsContact OG1-N 3.1Å; T96-N102 WeakPolarHBondContact CG2-ND2 3.19Å; T96-N102 PolarHBondContact OG1-ND2 2.75Å
97	S	89.2	Confident	95.1	Very high	124 Å²	124	54.5 Å²	54.5	87%	0.867	28%	0.28	S	S	*	.	S	Bend	trans	-65.3	-31.6	173.6	47.1	0	0	0	0	112.5
98	E	87.2	Confident	95.1	Very high	154 Å²	154	53 Å²	53	72%	0.72	28%	0.275	S	S	*	.	S	Bend	trans	-89.2	-37.7	-176.7	-59.2	-172.7	179	0	0	111.8
99	N	91	Very high	95.1	Very high	54 Å²	54	55.9 Å²	55.9	29%	0.289	29%	0.287	S	S	.	.			trans	-119.8	124.6	-176	-66.7	-46.9	0	0	0	111.4	T96 L101 N102	T96-N99 PolarHBondContact N-O 2.94Å; T96-N99 VanDerWaalsContact O-O 3.09Å; T96-N99 PolarHBondContact OG1-N 2.76Å; T96-N99 VanDerWaalsContact OG1-N 3.1Å; N99-L101 VanDerWaalsContact C-N 3.26Å; N99-L101 PolarHBondContact O-N 2.95Å; N99-N102 WeakPolarHBondContact CB-OD1 3.28Å; N99-N102 PolarHBondContact ND2-OD1 2.87Å
100	T	92.7	Very high	95.1	Very high	120 Å²	120	58.9 Å²	58.9	74%	0.736	31%	0.305	S	S	*	.	S	Bend	trans	-70.1	-23.5	179.8	52.5	0	0	0	0	113.6
101	L	94.6	Very high	95.1	Very high	94 Å²	94	58.9 Å²	58.9	49%	0.492	31%	0.305	S	S	.	.			trans	-149.6	115	-178.3	175.6	66	0	0	0	109	E93 N99 Q103	E93-L101 VanDerWaalsContact CD-CD1 3.45Å; E93-L101 HydrophobicContact CG-CD1 3.52Å; N99-L101 VanDerWaalsContact C-N 3.26Å; N99-L101 PolarHBondContact O-N 2.95Å; L101-Q103 HydrophobicContact CD1-CG 3.95Å; L101-Q103 HydrophobicContact CG-CG 4.18Å
102	N	95	Very high	95.1	Very high	19 Å²	19	60.2 Å²	60.2	10%	0.102	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	129.7	168.9	-61.7	-51.7	0	0	0	108.6	E93 Y94 T96 N99	E93-N102 VanDerWaalsContact CA-O 3.28Å; E93-N102 WeakPolarHBondContact CA-O 3.35Å; Y94-N102 HydrophobicContact CD1-CB 3.93Å; Y94-N102 HydrophobicContact CD2-CB 4.05Å; Y94-N102 HydrophobicContact CE1-CB 3.53Å; Y94-N102 HydrophobicContact CE2-CB 3.68Å; Y94-N102 WeakPolarHBondContact CE2-ND2 3.39Å; Y94-N102 HydrophobicContact CG-CB 4.16Å; Y94-N102 PolarHBondContact N-O 2.73Å; Y94-N102 PolarHBondContact O-N 3.21Å; T96-N102 WeakPolarHBondContact CG2-ND2 3.19Å; T96-N102 PolarHBondContact OG1-ND2 2.75Å; N99-N102 WeakPolarHBondContact CB-OD1 3.28Å; N99-N102 PolarHBondContact ND2-OD1 2.87Å
103	Q	96.1	Very high	95	Very high	106 Å²	106	64 Å²	64	50%	0.495	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	117.2	177.6	-71.1	-177.4	-32.5	0	0	109.5	Y91 A92 E93 L101	Y91-Q103 HydrophobicContact CD2-CB 4.22Å; Y91-Q103 HydrophobicContact CD2-CG 4.13Å; Y91-Q103 HydrophobicContact CE2-CG 4.12Å; A92-Q103 WeakPolarHBondContact O-CA 3.4Å; E93-Q103 HydrophobicContact CB-CG 4.42Å; E93-Q103 HydrophobicContact CG-CG 4.15Å; E93-Q103 PolarHBondContact OE2-NE2 3.13Å; L101-Q103 HydrophobicContact CD1-CG 3.95Å; L101-Q103 HydrophobicContact CG-CG 4.18Å
104	V	95.8	Very high	95	Very high	34 Å²	34	67 Å²	67	21%	0.206	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	120.8	-178.1	-178.4	0	0	0	0	109.5	Y91 A92 Y94 I106 L132	Y91-V104 CarbonylContact C-O 3.59Å; Y91-V104 WeakPolarHBondContact CA-O 3.01Å; Y91-V104 WeakPolarHBondContact CB-O 3.23Å; A92-V104 PolarHBondContact N-O 3.08Å; A92-V104 PolarHBondContact O-N 3.19Å; Y94-V104 HydrophobicContact CE1-CG2 4.22Å; V104-I106 PolarHBondContact O-N 3.24Å; V104-L132 HydrophobicContact CB-CD1 3.53Å; V104-L132 HydrophobicContact CG1-CD1 3.9Å; V104-L132 HydrophobicContact CG2-CD1 3.83Å
105	I	97.2	Very high	95.1	Very high	66 Å²	66	69.9 Å²	69.9	34%	0.338	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	124.6	175.1	-62.2	171.3	0	0	0	108.4	Y89 W107 Y130	Y89-I105 HydrophobicContact CD2-CD1 4.06Å; Y89-I105 HydrophobicContact CD2-CG1 4.02Å; Y89-I105 HydrophobicContact CG-CD1 4.37Å; I105-W107 WeakPolarHBondContact CG2-O 3.47Å; I105-Y130 HydrophobicContact CG2-CD2 4.28Å; I105-Y130 WeakPolarHBondContact O-CB 3.23Å
106	I	96.3	Very high	95.1	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	-22.5	178.2	60.6	174.4	0	0	0	112.2	F67 F69 L90 A92 V104 M128 K129 Y130 L132 L147	F67-I106 HydrophobicContact CE2-CD1 3.73Å; F67-I106 HydrophobicContact CZ-CD1 3.58Å; F69-I106 HydrophobicContact CD1-CD1 4.49Å; L90-I106 HydrophobicContact CB-CG1 4.27Å; L90-I106 HydrophobicContact CD2-CD1 3.73Å; L90-I106 HydrophobicContact CD2-CG1 4.06Å; L90-I106 HydrophobicContact CG-CD1 3.96Å; L90-I106 HydrophobicContact CG-CG1 3.97Å; L90-I106 WeakPolarHBondContact O-CG1 3.4Å; L90-I106 PolarHBondContact O-N 3.2Å; A92-I106 HydrophobicContact CB-CG2 4.37Å; V104-I106 PolarHBondContact O-N 3.24Å; I106-M128 HydrophobicContact CB-CB 4.42Å; I106-M128 HydrophobicContact CB-CG 4.19Å; I106-M128 HydrophobicContact CB-SD 4.22Å; I106-M128 HydrophobicContact CG2-SD 4.15Å; I106-M128 CarbonylContact O-C 3.56Å; I106-K129 PolarHBondContact O-N 3.18Å; I106-Y130 WeakPolarHBondContact CA-O 3.48Å; I106-Y130 PolarHBondContact O-N 3.01Å; I106-Y130 VanDerWaalsContact O-N 3.11Å; I106-L132 HydrophobicContact CG2-CB 4.46Å; I106-L147 HydrophobicContact CD1-CD2 4Å
107	W	97.5	Very high	95.3	Very high	32 Å²	32	74.7 Å²	74.7	12%	0.121	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	146.6	-179.4	178.5	85.2	0	0	0	111.2	F69 L71 I88 Y89 L90 I105 K109 I121 I123	F69-W107 HydrophobicContact CE1-CB 4.13Å; F69-W107 HydrophobicContact CE1-CG 4.48Å; F69-W107 HydrophobicContact CE2-CG 4.43Å; F69-W107 HydrophobicContact CZ-CB 3.67Å; F69-W107 AromaticContact CZ-CD1 3.87Å; F69-W107 HydrophobicContact CZ-CD2 4.25Å; F69-W107 AromaticContact CZ-CG 3.65Å; F69-W107 HydrophobicContact CZ-CG 3.65Å; L71-W107 HydrophobicContact CD2-CE3 4.04Å; L71-W107 HydrophobicContact CD2-CH2 4.33Å; L71-W107 HydrophobicContact CD2-CZ3 3.71Å; I88-W107 HydrophobicContact CG2-CZ3 4.16Å; Y89-W107 CarbonylContact C-O 3.56Å; Y89-W107 VanDerWaalsContact CA-O 3.27Å; Y89-W107 WeakPolarHBondContact CA-O 3.36Å; L90-W107 HydrophobicContact CB-CB 4.29Å; L90-W107 HydrophobicContact CB-CE3 4.19Å; L90-W107 PolarHBondContact N-O 3.05Å; L90-W107 PolarHBondContact O-N 2.8Å; I105-W107 WeakPolarHBondContact CG2-O 3.47Å; W107-K109 HydrophobicContact CH2-CB 3.37Å; W107-K109 HydrophobicContact CH2-CD 4.11Å; W107-K109 HydrophobicContact CH2-CG 4.35Å; W107-K109 HydrophobicContact CZ2-CB 3.45Å; W107-K109 VanDerWaalsContact CZ2-CB 3.45Å; W107-K109 HydrophobicContact CZ2-CD 4.01Å; W107-K109 HydrophobicContact CZ2-CG 4.31Å; W107-K109 HydrophobicContact CZ3-CB 4.15Å; W107-I121 HydrophobicContact CH2-CD1 3.84Å; W107-I121 HydrophobicContact CH2-CG2 4.41Å; W107-I121 HydrophobicContact CZ3-CD1 4.28Å; W107-I123 HydrophobicContact CD2-CD1 4.45Å; W107-I123 HydrophobicContact CH2-CD1 3.82Å; W107-I123 HydrophobicContact CZ2-CD1 3.37Å
108	D	97.8	Very high	95.6	Very high	31 Å²	31	71.2 Å²	71.2	17%	0.166	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	159.7	173	68.2	40.9	0	0	0	111.2	F87 I88 K129 Y130	F87-D108 HydrophobicContact CE2-CB 3.84Å; F87-D108 HydrophobicContact CZ-CB 4.03Å; I88-D108 CarbonylContact O-C 3.53Å; I88-D108 VanDerWaalsContact O-CA 3.22Å; I88-D108 WeakPolarHBondContact O-CA 3.16Å; D108-K129 IonicContact OD1-NZ 2.92Å; D108-K129 PolarHBondContact OD1-NZ 3.06Å; D108-K129 IonicContact OD2-NZ 2.65Å; D108-K129 PolarHBondContact OD2-NZ 3.5Å; D108-Y130 VanDerWaalsContact OD2-CE2 3.31Å; D108-Y130 WeakPolarHBondContact OD2-CE2 3.45Å; D108-Y130 PolarHBondContact OD2-OH 2.71Å
109	K	97.2	Very high	96.1	Very high	61 Å²	61	64.5 Å²	64.5	27%	0.265	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	136.3	167.4	-176.4	174.1	-178.7	-176	0	110.2	I88 W107 I111 D118	I88-K109 PolarHBondContact N-O 3.32Å; I88-K109 PolarHBondContact O-N 3.41Å; W107-K109 HydrophobicContact CH2-CB 3.37Å; W107-K109 HydrophobicContact CH2-CD 4.11Å; W107-K109 HydrophobicContact CH2-CG 4.35Å; W107-K109 HydrophobicContact CZ2-CB 3.45Å; W107-K109 VanDerWaalsContact CZ2-CB 3.45Å; W107-K109 HydrophobicContact CZ2-CD 4.01Å; W107-K109 HydrophobicContact CZ2-CG 4.31Å; W107-K109 HydrophobicContact CZ3-CB 4.15Å; K109-I111 HydrophobicContact CD-CG1 4.42Å; K109-I111 HydrophobicContact CG-CG1 4.36Å; K109-D118 IonicContact NZ-OD1 2.73Å; K109-D118 PolarHBondContact NZ-OD1 3.14Å
110	I	98	Very high	96.4	Very high	100 Å²	100	65 Å²	65	51%	0.513	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	124.5	166.5	-61	167.1	0	0	0	107.7	L86 F87 L112	L86-I110 CarbonylContact O-C 3.55Å; L86-I110 WeakPolarHBondContact O-CA 3.37Å; F87-I110 HydrophobicContact CD2-CG1 3.86Å; I110-L112 HydrophobicContact CG2-CD2 3.89Å; I110-L112 HydrophobicContact CG2-CG 4.42Å
111	I	97.7	Very high	96.6	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	126.2	171.5	-58.7	178.3	0	0	0	108.2	F75 F79 E85 L86 I88 K109 D118 H119 I121	F75-I111 HydrophobicContact CD2-CD1 4.03Å; F79-I111 HydrophobicContact CE2-CB 4.43Å; F79-I111 HydrophobicContact CE2-CG2 3.65Å; F79-I111 HydrophobicContact CZ-CB 4.13Å; F79-I111 HydrophobicContact CZ-CG2 3.58Å; E85-I111 CarbonylContact C-O 3.57Å; E85-I111 VanDerWaalsContact CA-O 3.29Å; E85-I111 WeakPolarHBondContact CA-O 3.43Å; L86-I111 HydrophobicContact CB-CB 4.46Å; L86-I111 PolarHBondContact N-O 3.13Å; L86-I111 PolarHBondContact O-N 3.41Å; I88-I111 HydrophobicContact CD1-CB 4.41Å; I88-I111 HydrophobicContact CD1-CD1 3.16Å; I88-I111 HydrophobicContact CD1-CG1 3.74Å; K109-I111 HydrophobicContact CD-CG1 4.42Å; K109-I111 HydrophobicContact CG-CG1 4.36Å; I111-D118 WeakPolarHBondContact CD1-O 3.47Å; I111-D118 HydrophobicContact CG1-CB 4.47Å; I111-D118 HydrophobicContact CG2-CB 3.99Å; I111-H119 WeakPolarHBondContact CG2-CD2 3.12Å; I111-I121 HydrophobicContact CD1-CD1 3.9Å; I111-I121 HydrophobicContact CD1-CG1 4.11Å
112	L	97.8	Very high	96.7	Very high	47 Å²	47	60 Å²	60	25%	0.246	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	146	179	-57.8	174.2	0	0	0	110.5	E85 I110 E114 N115 H119	E85-L112 HydrophobicContact CB-CD2 3.82Å; I110-L112 HydrophobicContact CG2-CD2 3.89Å; I110-L112 HydrophobicContact CG2-CG 4.42Å; L112-E114 VanDerWaalsContact CB-CD 3.45Å; L112-E114 HydrophobicContact CB-CG 3.92Å; L112-E114 HydrophobicContact CD1-CG 4.49Å; L112-E114 WeakPolarHBondContact CD1-OE1 3.27Å; L112-E114 PolarHBondContact O-N 3.31Å; L112-N115 PolarHBondContact O-N 3.28Å; L112-N115 VanDerWaalsContact O-N 3.13Å; L112-H119 PolarHBondContact O-NE2 2.99Å
113	R	96.4	Very high	96.8	Very high	79 Å²	79	60.9 Å²	60.9	30%	0.298	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-42	177	179.9	-170.9	-68.9	-165.8	7.1	111.4	F79 D80 W81 N82 T83 K84 N115 H119	F79-R113 HydrophobicContact CD1-CB 3.83Å; F79-R113 HydrophobicContact CD1-CG 4.19Å; F79-R113 HydrophobicContact CE1-CB 3.98Å; D80-R113 PolarHBondContact O-NH1 3.02Å; D80-R113 PolarHBondContact O-NH2 2.83Å; W81-R113 PolarHBondContact O-NH1 3.5Å; W81-R113 PolarHBondContact O-NH2 2.99Å; N82-R113 PolarHBondContact O-NH2 3.21Å; T83-R113 PolarHBondContact O-NE 3.48Å; T83-R113 PolarHBondContact O-NH2 2.86Å; K84-R113 VanDerWaalsContact O-CB 3.31Å; K84-R113 WeakPolarHBondContact O-CB 3.27Å; K84-R113 PolarHBondContact O-N 3.11Å; R113-N115 PolarHBondContact O-N 2.94Å; R113-N115 VanDerWaalsContact O-N 3.11Å; R113-H119 PolarHBondContact O-NE2 3.39Å
114	E	96	Very high	96.8	Very high	123 Å²	123	61.5 Å²	61.5	58%	0.575	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-12.5	-179	57.1	-94.2	-146.5	0	0	114.4	L112 P116	L112-E114 VanDerWaalsContact CB-CD 3.45Å; L112-E114 HydrophobicContact CB-CG 3.92Å; L112-E114 HydrophobicContact CD1-CG 4.49Å; L112-E114 WeakPolarHBondContact CD1-OE1 3.27Å; L112-E114 PolarHBondContact O-N 3.31Å; E114-P116 WeakPolarHBondContact O-CD 3.38Å
115	N	96.8	Very high	96.8	Very high	70 Å²	70	64.9 Å²	64.9	37%	0.374	32%	0.324	S	S	.	.			trans	-114.7	73.3	179	-63.1	-14.1	0	0	0	112.2	L112 R113 Q117 D118 H119	L112-N115 PolarHBondContact O-N 3.28Å; L112-N115 VanDerWaalsContact O-N 3.13Å; R113-N115 PolarHBondContact O-N 2.94Å; R113-N115 VanDerWaalsContact O-N 3.11Å; N115-Q117 PolarHBondContact O-N 2.81Å; N115-D118 HydrophobicContact CB-CB 4.38Å; N115-D118 WeakPolarHBondContact CB-OD2 3.27Å; N115-D118 PolarHBondContact O-N 3.49Å; N115-H119 PolarHBondContact O-CD2 3.16Å; N115-H119 PolarHBondContact O-NE2 3.29Å
116	P	95	Very high	96.6	Very high	79 Å²	79	62.1 Å²	62.1	51%	0.513	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-55	-26	179.9	-28.2	34.5	0	0	0	115.5	E114 D118 H119	E114-P116 WeakPolarHBondContact O-CD 3.38Å; P116-D118 PolarHBondContact O-N 2.85Å; P116-H119 WeakPolarHBondContact O-CB 3.31Å; P116-H119 PolarHBondContact O-N 3.35Å
117	Q	95.7	Very high	96.5	Very high	176 Å²	176	69.1 Å²	69.1	82%	0.822	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-66.7	-25.5	178.5	-52	-56	-14.3	0	0	112.5	N115	N115-Q117 PolarHBondContact O-N 2.81Å
118	D	96.3	Very high	96.3	Very high	50 Å²	50	68.4 Å²	68.4	27%	0.267	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-84.4	-13.7	178.5	-73.5	-46.8	0	0	0	113	K109 I111 N115 P116 V120	K109-D118 IonicContact NZ-OD1 2.73Å; K109-D118 PolarHBondContact NZ-OD1 3.14Å; I111-D118 WeakPolarHBondContact CD1-O 3.47Å; I111-D118 HydrophobicContact CG1-CB 4.47Å; I111-D118 HydrophobicContact CG2-CB 3.99Å; N115-D118 HydrophobicContact CB-CB 4.38Å; N115-D118 WeakPolarHBondContact CB-OD2 3.27Å; N115-D118 PolarHBondContact O-N 3.49Å; P116-D118 PolarHBondContact O-N 2.85Å; D118-V120 PolarHBondContact O-N 2.9Å
119	H	97.5	Very high	96.1	Very high	14 Å²	14	71.9 Å²	71.9	7%	0.065	35%	0.351	C	S	.	.	S	Bend	trans	-67	-19.1	-174	-64.2	-171.2	0	0	0	112.9	F75 R76 F79 I111 L112 R113 N115 P116	F75-H119 WeakPolarHBondContact CA-O 3.21Å; F75-H119 WeakPolarHBondContact CB-O 3.22Å; F75-H119 PolarHBondContact N-O 2.89Å; R76-H119 HydrophobicContact CG-CB 3.58Å; F79-H119 HydrophobicContact CD2-CB 4.49Å; F79-H119 AromaticContact CD2-CD2 3.89Å; F79-H119 AromaticContact CD2-CE1 3.45Å; F79-H119 VanDerWaalsContact CD2-CE1 3.45Å; F79-H119 WeakPolarHBondContact CD2-CE1 3.22Å; F79-H119 AromaticContact CD2-CG 3.71Å; F79-H119 AromaticContact CD2-ND1 3.45Å; F79-H119 WeakPolarHBondContact CD2-ND1 3.46Å; F79-H119 AromaticContact CD2-NE2 3.73Å; F79-H119 HydrophobicContact CE2-CB 4.47Å; F79-H119 AromaticContact CE2-CD2 3.55Å; F79-H119 AromaticContact CE2-CE1 3.84Å; F79-H119 AromaticContact CE2-CG 3.75Å; F79-H119 AromaticContact CE2-ND1 3.95Å; F79-H119 AromaticContact CE2-NE2 3.6Å; F79-H119 AromaticContact CG-CE1 3.69Å; F79-H119 AromaticContact CZ-NE2 3.91Å; I111-H119 WeakPolarHBondContact CG2-CD2 3.12Å; L112-H119 PolarHBondContact O-NE2 2.99Å; R113-H119 PolarHBondContact O-NE2 3.39Å; N115-H119 PolarHBondContact O-CD2 3.16Å; N115-H119 PolarHBondContact O-NE2 3.29Å; P116-H119 WeakPolarHBondContact O-CB 3.31Å; P116-H119 PolarHBondContact O-N 3.35Å
120	V	97.6	Very high	96	Very high	65 Å²	65	74 Å²	74	39%	0.394	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	117.5	172.4	-176.1	0	0	0	0	108.4	R76 D118	R76-V120 HydrophobicContact CG-CG2 4.04Å; D118-V120 PolarHBondContact O-N 2.9Å
121	I	96.9	Very high	95.6	Very high	6 Å²	6	73.2 Å²	73.2	3%	0.031	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	123.1	175.5	-63.5	177.6	0	0	0	107.8	L71 Q72 A73 F75 I88 W107 I111 I123	L71-I121 HydrophobicContact CB-CG2 4.5Å; L71-I121 HydrophobicContact CD2-CG2 3.96Å; L71-I121 HydrophobicContact CG-CG2 4.02Å; Q72-I121 VanDerWaalsContact CA-O 3.27Å; Q72-I121 WeakPolarHBondContact CA-O 3.39Å; A73-I121 PolarHBondContact N-O 3.24Å; A73-I121 PolarHBondContact O-N 3.35Å; F75-I121 HydrophobicContact CD2-CD1 3.94Å; F75-I121 HydrophobicContact CD2-CG1 4.22Å; F75-I121 HydrophobicContact CE2-CD1 3.49Å; F75-I121 VanDerWaalsContact CE2-CD1 3.49Å; F75-I121 HydrophobicContact CE2-CG1 4.12Å; I88-I121 HydrophobicContact CD1-CD1 4.07Å; I88-I121 HydrophobicContact CG2-CD1 4.24Å; W107-I121 HydrophobicContact CH2-CD1 3.84Å; W107-I121 HydrophobicContact CH2-CG2 4.41Å; W107-I121 HydrophobicContact CZ3-CD1 4.28Å; I111-I121 HydrophobicContact CD1-CD1 3.9Å; I111-I121 HydrophobicContact CD1-CG1 4.11Å; I121-I123 HydrophobicContact CG2-CD1 3.8Å; I121-I123 HydrophobicContact CG2-CG1 3.86Å
122	N	96.8	Very high	95.3	Very high	101 Å²	101	73.2 Å²	73.2	54%	0.54	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	87.3	170	-176.6	19.6	0	0	0	108.4	L71 Q72	L71-N122 CarbonylContact O-C 3.51Å; L71-N122 WeakPolarHBondContact O-CA 3.35Å; Q72-N122 PolarHBondContact NE2-OD1 3.37Å
123	I	96.8	Very high	95	Very high	38 Å²	38	75.3 Å²	75.3	20%	0.195	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	131.8	178.9	-63	170	0	0	0	107.8	F69 D70 L71 W107 I121	F69-I123 HydrophobicContact CE2-CD1 4.34Å; F69-I123 HydrophobicContact CE2-CG2 4.22Å; D70-I123 CarbonylContact C-O 3.54Å; D70-I123 VanDerWaalsContact CA-O 3.22Å; D70-I123 WeakPolarHBondContact CA-O 3.35Å; L71-I123 HydrophobicContact CB-CB 4.3Å; L71-I123 HydrophobicContact CD2-CD1 4.47Å; L71-I123 PolarHBondContact N-O 3.01Å; L71-I123 PolarHBondContact O-N 2.95Å; W107-I123 HydrophobicContact CD2-CD1 4.45Å; W107-I123 HydrophobicContact CH2-CD1 3.82Å; W107-I123 HydrophobicContact CZ2-CD1 3.37Å; I121-I123 HydrophobicContact CG2-CD1 3.8Å; I121-I123 HydrophobicContact CG2-CG1 3.86Å
124	K	96.4	Very high	94.8	Very high	120 Å²	120	71.7 Å²	71.7	52%	0.522	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	129.1	174.5	-67.2	-57.7	-170.4	-174.3	0	109.6	D70 G126	D70-K124 HydrophobicContact CB-CD 4.16Å; D70-K124 VanDerWaalsContact CG-CD 3.47Å; D70-K124 WeakPolarHBondContact OD1-CA 3.39Å; D70-K124 WeakPolarHBondContact OD2-CD 3.49Å; D70-K124 IonicContact OD2-NZ 2.83Å; D70-K124 PolarHBondContact OD2-NZ 3.39Å; K124-G126 PolarHBondContact O-N 2.94Å
125	N	94.5	Very high	94.2	Very high	104 Å²	104	69.6 Å²	69.6	56%	0.556	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	50.8	41.7	-174.8	-163.7	38.8	0	0	0	112.3	T68 D70 R127	T68-N125 WeakPolarHBondContact CB-OD1 3.39Å; T68-N125 WeakPolarHBondContact CG2-OD1 3.12Å; T68-N125 PolarHBondContact OG1-OD1 3.27Å; D70-N125 PolarHBondContact OD1-N 2.96Å; N125-R127 PolarHBondContact O-N 3.02Å
126	G	94.2	Very high	93.7	Very high	9 Å²	9	67.1 Å²	67.1	9%	0.093	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	130.4	179.7	0	0	0	0	0	110.9	T68 F69 K124	T68-G126 CarbonylContact C-O 3.51Å; T68-G126 WeakPolarHBondContact CA-O 3.46Å; T68-G126 WeakPolarHBondContact CB-O 3.43Å; F69-G126 WeakPolarHBondContact CD1-O 3.47Å; F69-G126 PolarHBondContact N-O 2.79Å; F69-G126 WeakPolarHBondContact O-CA 3.36Å; F69-G126 PolarHBondContact O-N 2.82Å; K124-G126 PolarHBondContact O-N 2.94Å
127	R	93.5	Very high	93.4	Very high	146 Å²	146	68 Å²	68	55%	0.551	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	144.7	172	-61.6	-176.1	-179.6	-163.4	-3.4	109.4	N125 L184	N125-R127 PolarHBondContact O-N 3.02Å; R127-L184 WeakPolarHBondContact CD-OXT 3.38Å; R127-L184 PolarHBondContact NH1-O 3.46Å; R127-L184 PolarHBondContact NH1-OXT 2.79Å
128	M	93.7	Very high	93	Very high	17 Å²	17	60.9 Å²	60.9	8%	0.084	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-64.7	137.5	171.6	-56.4	-177.2	-45.8	0	0	110	A65 A66 F67 F69 I106 Y130 Y131	A65-M128 WeakPolarHBondContact O-CE 3.22Å; A66-M128 HydrophobicContact CB-CE 3.64Å; F67-M128 HydrophobicContact CD1-SD 4Å; F67-M128 HydrophobicContact CE1-SD 3.8Å; F67-M128 HydrophobicContact CE2-SD 4.37Å; F67-M128 HydrophobicContact CG-SD 4.37Å; F67-M128 HydrophobicContact CZ-SD 4Å; F67-M128 WeakPolarHBondContact O-CG 3.36Å; F69-M128 HydrophobicContact CE1-CG 4.46Å; I106-M128 HydrophobicContact CB-CB 4.42Å; I106-M128 HydrophobicContact CB-CG 4.19Å; I106-M128 HydrophobicContact CB-SD 4.22Å; I106-M128 HydrophobicContact CG2-SD 4.15Å; I106-M128 CarbonylContact O-C 3.56Å; M128-Y130 WeakPolarHBondContact CB-O 3.14Å; M128-Y131 HydrophobicContact CE-CD1 3.62Å; M128-Y131 HydrophobicContact CE-CE1 4.34Å; M128-Y131 HydrophobicContact CE-CG 4.4Å
129	K	94.4	Very high	92.8	Very high	105 Å²	105	58.5 Å²	58.5	46%	0.457	29%	0.289	S	S	.	.	S	Bend	trans	-79.3	-36.2	171.5	-174.6	-177.5	176.6	-160.7	0	110.6	I106 D108	I106-K129 PolarHBondContact O-N 3.18Å; D108-K129 IonicContact OD1-NZ 2.92Å; D108-K129 PolarHBondContact OD1-NZ 3.06Å; D108-K129 IonicContact OD2-NZ 2.65Å; D108-K129 PolarHBondContact OD2-NZ 3.5Å
130	Y	95	Very high	92.5	Very high	105 Å²	105	62.4 Å²	62.4	41%	0.412	31%	0.305	S	S	.	.	S	Bend	trans	-123	132.7	177.2	-52.5	-70.1	0	0	0	109	I105 I106 D108 M128	I105-Y130 HydrophobicContact CG2-CD2 4.28Å; I105-Y130 WeakPolarHBondContact O-CB 3.23Å; I106-Y130 WeakPolarHBondContact CA-O 3.48Å; I106-Y130 PolarHBondContact O-N 3.01Å; I106-Y130 VanDerWaalsContact O-N 3.11Å; D108-Y130 VanDerWaalsContact OD2-CE2 3.31Å; D108-Y130 WeakPolarHBondContact OD2-CE2 3.45Å; D108-Y130 PolarHBondContact OD2-OH 2.71Å; M128-Y130 WeakPolarHBondContact CB-O 3.14Å
131	Y	88.2	Confident	92.3	Very high	83 Å²	83	60.1 Å²	60.1	33%	0.325	30%	0.295	S	S	.	.			trans	-73.1	147.5	178.6	-58.5	-76.9	0	0	0	111	L64 A66 M128 L133 L184	L64-Y131 HydrophobicContact CD1-CD1 4.46Å; L64-Y131 HydrophobicContact CD1-CD2 4.31Å; L64-Y131 HydrophobicContact CD1-CG 3.93Å; L64-Y131 HydrophobicContact CD2-CD1 4.11Å; L64-Y131 HydrophobicContact CD2-CG 4.32Å; L64-Y131 HydrophobicContact CG-CG 4.3Å; A66-Y131 HydrophobicContact CB-CD1 4.28Å; M128-Y131 HydrophobicContact CE-CD1 3.62Å; M128-Y131 HydrophobicContact CE-CE1 4.34Å; M128-Y131 HydrophobicContact CE-CG 4.4Å; Y131-L133 PolarHBondContact O-N 3.49Å; Y131-L184 HydrophobicContact CE1-CD2 3.78Å; Y131-L184 VanDerWaalsContact OH-CD2 3.22Å; Y131-L184 WeakPolarHBondContact OH-CD2 3.49Å
132	L	92.1	Very high	92.1	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	93.6	172.8	-178.7	59.5	0	0	0	108.1	L64 A65 F67 A92 Y94 V104 I106 L139 V145	L64-L132 WeakPolarHBondContact CA-O 3.47Å; A65-L132 HydrophobicContact CB-CB 4.12Å; A65-L132 HydrophobicContact CB-CD2 4.04Å; A65-L132 HydrophobicContact CB-CG 4.28Å; A65-L132 PolarHBondContact N-O 2.76Å; A65-L132 PolarHBondContact O-N 2.84Å; F67-L132 HydrophobicContact CE1-CD2 4.44Å; A92-L132 HydrophobicContact CB-CD1 3.89Å; A92-L132 HydrophobicContact CB-CD2 4.16Å; Y94-L132 HydrophobicContact CD1-CD1 4.49Å; Y94-L132 HydrophobicContact CE1-CD1 3.82Å; V104-L132 HydrophobicContact CB-CD1 3.53Å; V104-L132 HydrophobicContact CG1-CD1 3.9Å; V104-L132 HydrophobicContact CG2-CD1 3.83Å; I106-L132 HydrophobicContact CG2-CB 4.46Å; L132-L139 HydrophobicContact CD2-CD1 4.33Å; L132-L139 HydrophobicContact CD2-CD2 4.09Å; L132-L139 HydrophobicContact CG-CD1 3.92Å; L132-L139 HydrophobicContact CG-CD2 4.36Å; L132-V145 HydrophobicContact CD2-CG1 4.05Å
133	L	91.3	Very high	91.7	Very high	92 Å²	92	62.7 Å²	62.7	48%	0.482	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	126.8	178.3	-170.3	103	0	0	0	109.4	L51 A62 D63 Y131	L51-L133 HydrophobicContact CD1-CD1 4.18Å; A62-L133 HydrophobicContact CB-CD1 4.31Å; A62-L133 HydrophobicContact CB-CG 4.45Å; D63-L133 WeakPolarHBondContact O-CA 3.27Å; Y131-L133 PolarHBondContact O-N 3.49Å
134	D	91.4	Very high	91.5	Very high	3 Å²	3	64.7 Å²	64.7	2%	0.016	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	143.5	174.6	-172.2	59	0	0	0	110.7	A62 D63 Y94 G136 G138 L139	A62-D134 WeakPolarHBondContact CA-O 3.39Å; A62-D134 VanDerWaalsContact CB-O 3.27Å; A62-D134 WeakPolarHBondContact CB-O 3.21Å; D63-D134 HydrophobicContact CB-CB 4.44Å; D63-D134 PolarHBondContact N-O 2.83Å; D63-D134 PolarHBondContact O-N 3Å; Y94-D134 WeakPolarHBondContact CE2-OD1 3.21Å; Y94-D134 WeakPolarHBondContact OH-CB 3.31Å; Y94-D134 PolarHBondContact OH-OD1 2.82Å; D134-G136 PolarHBondContact O-N 3.32Å; D134-G138 VanDerWaalsContact OD2-CA 3.27Å; D134-G138 WeakPolarHBondContact OD2-CA 3.22Å; D134-G138 PolarHBondContact OD2-N 3.13Å; D134-G138 VanDerWaalsContact OD2-N 3.08Å; D134-L139 HydrophobicContact CB-CD1 3.5Å; D134-L139 VanDerWaalsContact CB-CD1 3.5Å; D134-L139 HydrophobicContact CB-CD2 4.47Å; D134-L139 HydrophobicContact CB-CG 3.55Å
135	D	85.2	Confident	91.4	Very high	79 Å²	79	59 Å²	59	42%	0.422	29%	0.294	S	S	.	.	S	Bend	trans	-78.8	57.1	175.5	60.5	-25.3	0	0	0	111.3	M56	M56-D135 HydrophobicContact SD-CB 4.13Å
136	G	86.4	Confident	91.6	Very high	18 Å²	18	55 Å²	55	19%	0.186	27%	0.273	C	S	.	.	S	Bend	trans	158.3	-161.8	-179.7	0	0	0	0	0	112.7	K61 A62 D63 D134 G138	K61-G136 WeakPolarHBondContact O-CA 3.45Å; A62-G136 CarbonylContact C-O 3.57Å; A62-G136 WeakPolarHBondContact CA-O 3.37Å; D63-G136 PolarHBondContact N-O 3.11Å; D134-G136 PolarHBondContact O-N 3.32Å; G136-G138 VanDerWaalsContact C-N 3.34Å
137	E	87.1	Confident	91.7	Very high	97 Å²	97	54.5 Å²	54.5	45%	0.453	27%	0.269	S	S	.	.	S	Bend	trans	-99.3	28.6	174	-62.6	-176.8	145.5	0	0	111.2	K61 D63	K61-E137 HydrophobicContact CB-CG 4.29Å; K61-E137 HydrophobicContact CD-CG 4.37Å; K61-E137 WeakPolarHBondContact CD-OE1 3.24Å; K61-E137 IonicContact NZ-OE1 2.82Å; K61-E137 PolarHBondContact NZ-OE1 2.83Å; D63-E137 VanDerWaalsContact OD2-CA 3.32Å; D63-E137 WeakPolarHBondContact OD2-CA 2.97Å
138	G	88.3	Confident	91.9	Very high	27 Å²	27	48.5 Å²	48.5	28%	0.278	25%	0.247	S	C	.	.			trans	-80.7	-12.6	-170.5	0	0	0	0	0	115.1	D134 G136 H142	D134-G138 VanDerWaalsContact OD2-CA 3.27Å; D134-G138 WeakPolarHBondContact OD2-CA 3.22Å; D134-G138 PolarHBondContact OD2-N 3.13Å; D134-G138 VanDerWaalsContact OD2-N 3.08Å; G136-G138 VanDerWaalsContact C-N 3.34Å; G138-H142 PolarHBondContact O-CD2 3.34Å
139	L	91.6	Very high	92.1	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.243	C	C	.	.	S	Bend	trans	-90	-31.5	-179.8	-69.9	173.4	0	0	0	112.7	V48 D63 A65 Y94 L132 D134 G141 H142 V145 I173	V48-L139 HydrophobicContact CG2-CB 4.42Å; D63-L139 HydrophobicContact CB-CB 3.84Å; D63-L139 HydrophobicContact CB-CD1 4.04Å; D63-L139 HydrophobicContact CB-CG 4.29Å; D63-L139 PolarHBondContact OD2-N 3.32Å; A65-L139 HydrophobicContact CB-CD1 4.01Å; Y94-L139 HydrophobicContact CD1-CD2 4.43Å; Y94-L139 HydrophobicContact CD2-CD2 3.92Å; Y94-L139 HydrophobicContact CE1-CD2 4.22Å; Y94-L139 HydrophobicContact CE2-CD2 3.66Å; Y94-L139 HydrophobicContact CE2-CG 4.4Å; Y94-L139 HydrophobicContact CG-CD2 4.3Å; L132-L139 HydrophobicContact CD2-CD1 4.33Å; L132-L139 HydrophobicContact CD2-CD2 4.09Å; L132-L139 HydrophobicContact CG-CD1 3.92Å; L132-L139 HydrophobicContact CG-CD2 4.36Å; D134-L139 HydrophobicContact CB-CD1 3.5Å; D134-L139 VanDerWaalsContact CB-CD1 3.5Å; D134-L139 HydrophobicContact CB-CD2 4.47Å; D134-L139 HydrophobicContact CB-CG 3.55Å; L139-G141 PolarHBondContact O-N 3.49Å; L139-H142 WeakPolarHBondContact O-CB 3.45Å; L139-H142 PolarHBondContact O-N 3.29Å; L139-V145 HydrophobicContact CD2-CG2 4.44Å; L139-I173 WeakPolarHBondContact O-CB 3.23Å; L139-I173 WeakPolarHBondContact O-CG2 3.39Å
140	K	91.8	Very high	92.3	Very high	95 Å²	95	42.8 Å²	42.8	41%	0.413	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	122.1	178.7	-177.6	-160	179.9	-179.2	0	110.7	D63 H142 D175 Y177	D63-K140 PolarHBondContact OD2-N 2.89Å; K140-H142 PolarHBondContact O-N 2.7Å; K140-D175 WeakPolarHBondContact CE-O 3.5Å; K140-Y177 HydrophobicContact CB-CE1 3.99Å; K140-Y177 HydrophobicContact CD-CD2 4.24Å; K140-Y177 HydrophobicContact CD-CE1 4.25Å; K140-Y177 HydrophobicContact CD-CE2 3.63Å; K140-Y177 HydrophobicContact CG-CE1 4.17Å; K140-Y177 HydrophobicContact CG-CE2 4.39Å
141	G	92.2	Very high	92.4	Very high	17 Å²	17	37.8 Å²	37.8	18%	0.175	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	20.5	-179.1	0	0	0	0	0	114.5	L139 D143 I173 P174 D175	L139-G141 PolarHBondContact O-N 3.49Å; G141-D143 PolarHBondContact O-N 3.47Å; G141-I173 WeakPolarHBondContact CA-O 3.21Å; G141-P174 PolarHBondContact N-O 2.94Å; G141-P174 VanDerWaalsContact N-O 3.1Å; G141-D175 WeakPolarHBondContact CA-OD1 3.42Å
142	H	92.9	Very high	92.8	Very high	32 Å²	32	34.5 Å²	34.5	15%	0.148	19%	0.191	C	C	.	.			trans	-76.6	121.7	178.8	-162.8	-70	0	0	0	111.2	K95 G138 L139 K140 N144 V145 I173	K95-H142 PolarHBondContact O-NE2 2.82Å; G138-H142 PolarHBondContact O-CD2 3.34Å; L139-H142 WeakPolarHBondContact O-CB 3.45Å; L139-H142 PolarHBondContact O-N 3.29Å; K140-H142 PolarHBondContact O-N 2.7Å; H142-N144 VanDerWaalsContact CE1-C 3.49Å; H142-N144 PolarHBondContact CE1-O 3.48Å; H142-N144 VanDerWaalsContact ND1-C 3.34Å; H142-N144 PolarHBondContact ND1-N 2.87Å; H142-N144 PolarHBondContact ND1-O 2.97Å; H142-V145 HydrophobicContact CB-CG2 4.44Å; H142-I173 HydrophobicContact CB-CB 4.32Å; H142-I173 HydrophobicContact CB-CG1 4.24Å; H142-I173 PolarHBondContact O-N 3.31Å
143	D	89.7	Confident	93	Very high	130 Å²	130	34.6 Å²	34.6	70%	0.695	19%	0.191	S	C	*	.	S	Bend	trans	-79.4	-17.8	-174.3	-65.5	-34.5	0	0	0	114.2	G141 T172	G141-D143 PolarHBondContact O-N 3.47Å; D143-T172 WeakPolarHBondContact O-CG2 3.25Å
144	N	91.4	Very high	93.3	Very high	80 Å²	80	31.5 Å²	31.5	43%	0.428	18%	0.175	S	C	.	.			trans	-145.1	79	-168.9	-170.7	13.1	0	0	0	113.4	H142 T146 H170	H142-N144 VanDerWaalsContact CE1-C 3.49Å; H142-N144 PolarHBondContact CE1-O 3.48Å; H142-N144 VanDerWaalsContact ND1-C 3.34Å; H142-N144 PolarHBondContact ND1-N 2.87Å; H142-N144 PolarHBondContact ND1-O 2.97Å; N144-T146 PolarHBondContact OD1-OG1 3.23Å; N144-H170 PolarHBondContact OD1-ND1 2.98Å
145	V	95.5	Very high	93.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	116	165	-178.3	0	0	0	0	108.3	A92 L132 L139 H142 L171 I173	A92-V145 HydrophobicContact CB-CG1 3.75Å; L132-V145 HydrophobicContact CD2-CG1 4.05Å; L139-V145 HydrophobicContact CD2-CG2 4.44Å; H142-V145 HydrophobicContact CB-CG2 4.44Å; V145-L171 HydrophobicContact CB-CB 4.41Å; V145-L171 WeakPolarHBondContact CB-O 3.31Å; V145-L171 PolarHBondContact N-O 2.87Å; V145-L171 PolarHBondContact O-N 3.35Å; V145-I173 HydrophobicContact CG2-CD1 4.19Å; V145-I173 HydrophobicContact CG2-CG1 3.78Å
146	T	96.8	Very high	93.9	Very high	19 Å²	19	32.8 Å²	32.8	12%	0.117	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	125.6	-176.6	-54.5	0	0	0	0	110.7	A92 E93 N144 I148 H169 H170	A92-T146 CarbonylContact C-O 3.49Å; A92-T146 WeakPolarHBondContact CA-O 3.24Å; E93-T146 PolarHBondContact N-O 2.92Å; E93-T146 PolarHBondContact O-N 3.45Å; N144-T146 PolarHBondContact OD1-OG1 3.23Å; T146-I148 HydrophobicContact CG2-CD1 4.16Å; T146-I148 HydrophobicContact CG2-CG1 3.86Å; T146-H169 CarbonylContact C-O 3.53Å; T146-H169 WeakPolarHBondContact CA-O 3.34Å; T146-H170 PolarHBondContact OG1-CE1 3.08Å; T146-H170 PolarHBondContact OG1-ND1 3.41Å
147	L	97.4	Very high	94.2	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	125.1	174.6	-55	-174.8	0	0	0	110.3	V41 F67 L90 Y91 A92 I106 S168 H169	V41-L147 HydrophobicContact CG1-CB 4.29Å; V41-L147 HydrophobicContact CG2-CB 4.4Å; V41-L147 HydrophobicContact CG2-CD1 4.2Å; F67-L147 HydrophobicContact CE2-CD1 3.66Å; F67-L147 HydrophobicContact CE2-CD2 4.13Å; F67-L147 HydrophobicContact CZ-CD1 4.1Å; F67-L147 HydrophobicContact CZ-CD2 3.7Å; L90-L147 HydrophobicContact CD1-CB 4.37Å; Y91-L147 WeakPolarHBondContact O-CA 3.3Å; A92-L147 HydrophobicContact CB-CD2 3.85Å; I106-L147 HydrophobicContact CD1-CD2 4Å; L147-S168 WeakPolarHBondContact O-CA 3.46Å; L147-H169 PolarHBondContact N-O 3.08Å; L147-H169 PolarHBondContact O-N 3.29Å
148	I	97.7	Very high	94.4	Very high	20 Å²	20	29.8 Å²	29.8	10%	0.103	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	132.3	-175.9	-54.2	176.2	0	0	0	109.7	Y91 E93 T146 T164	Y91-I148 HydrophobicContact CD1-CB 4.45Å; Y91-I148 VanDerWaalsContact CD1-O 3.23Å; Y91-I148 WeakPolarHBondContact CD1-O 3.16Å; Y91-I148 HydrophobicContact CE1-CB 3.86Å; Y91-I148 HydrophobicContact CE1-CG2 3.85Å; Y91-I148 HydrophobicContact CE2-CB 3.95Å; Y91-I148 HydrophobicContact CE2-CD1 4.1Å; Y91-I148 HydrophobicContact CE2-CG1 4.45Å; Y91-I148 HydrophobicContact CE2-CG2 4.48Å; Y91-I148 PolarHBondContact N-O 2.91Å; Y91-I148 PolarHBondContact O-N 3.42Å; Y91-I148 WeakPolarHBondContact OH-CG2 3.39Å; E93-I148 HydrophobicContact CB-CD1 4.26Å; T146-I148 HydrophobicContact CG2-CD1 4.16Å; T146-I148 HydrophobicContact CG2-CG1 3.86Å; I148-T164 HydrophobicContact CG2-CG2 3.37Å
149	L	97.9	Very high	94.5	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	127.8	173.9	-167.5	71.2	0	0	0	109.8	F39 L71 A73 F75 I88 L90 W151 G165	F39-L149 HydrophobicContact CB-CD2 3.73Å; F39-L149 HydrophobicContact CD1-CB 3.87Å; F39-L149 HydrophobicContact CD1-CD2 4.44Å; F39-L149 HydrophobicContact CD2-CB 3.6Å; F39-L149 HydrophobicContact CD2-CD2 4.19Å; F39-L149 HydrophobicContact CE1-CB 3.88Å; F39-L149 HydrophobicContact CE2-CB 3.6Å; F39-L149 HydrophobicContact CG-CB 3.73Å; F39-L149 HydrophobicContact CG-CD2 3.88Å; F39-L149 HydrophobicContact CG-CG 4.49Å; F39-L149 HydrophobicContact CZ-CB 3.75Å; F39-L149 VanDerWaalsContact CZ-N 3.26Å; L71-L149 HydrophobicContact CD1-CD1 4.18Å; L71-L149 HydrophobicContact CD1-CD2 4.09Å; L71-L149 HydrophobicContact CD2-CD1 3.79Å; A73-L149 HydrophobicContact CB-CD2 3.83Å; F75-L149 HydrophobicContact CE2-CD2 4.34Å; F75-L149 HydrophobicContact CZ-CD2 3.73Å; I88-L149 HydrophobicContact CG2-CD1 3.66Å; I88-L149 HydrophobicContact CG2-CG 4.16Å; L90-L149 HydrophobicContact CB-CD1 4.1Å; L90-L149 HydrophobicContact CD1-CB 4.37Å; L90-L149 HydrophobicContact CD1-CD1 4.27Å; L149-W151 HydrophobicContact CD2-CZ3 4.24Å; L149-W151 HydrophobicContact CG-CE3 4.35Å; L149-W151 HydrophobicContact CG-CZ3 4.29Å; L149-G165 PolarHBondContact O-N 2.88Å
150	A	98	Very high	94.6	Very high	1 Å²	1	41 Å²	41	1%	0.008	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	164.9	172.8	0	0	0	0	0	110.8	Y89 Y91 F163	Y89-A150 HydrophobicContact CD2-CB 4.42Å; Y89-A150 HydrophobicContact CE1-CB 4.22Å; Y89-A150 HydrophobicContact CE2-CB 3.73Å; Y89-A150 PolarHBondContact N-O 3.47Å; Y89-A150 PolarHBondContact O-N 2.93Å; Y89-A150 VanDerWaalsContact O-O 3.05Å; Y91-A150 HydrophobicContact CD1-CB 4.37Å; Y91-A150 HydrophobicContact CE1-CB 3.7Å; A150-F163 CarbonylContact C-O 3.58Å; A150-F163 VanDerWaalsContact CA-O 3.23Å; A150-F163 WeakPolarHBondContact CA-O 3.45Å; A150-F163 VanDerWaalsContact CB-O 3.28Å; A150-F163 WeakPolarHBondContact CB-O 3.45Å
151	W	97.9	Very high	94.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	154.2	179.1	53.7	91.1	0	0	0	112.7	Y35 V37 F75 L78 F87 I88 L149 F162 F163	Y35-W151 VanDerWaalsContact O-CE2 3.31Å; Y35-W151 WeakPolarHBondContact O-CZ2 3.45Å; Y35-W151 PolarHBondContact O-NE1 3.03Å; V37-W151 HydrophobicContact CB-CH2 4.32Å; V37-W151 HydrophobicContact CB-CZ2 4.44Å; V37-W151 HydrophobicContact CG2-CH2 3.28Å; V37-W151 HydrophobicContact CG2-CZ2 3.54Å; V37-W151 HydrophobicContact CG2-CZ3 4.03Å; F75-W151 AromaticContact CE1-CD2 3.69Å; F75-W151 HydrophobicContact CE1-CD2 3.69Å; F75-W151 AromaticContact CE1-CE3 3.55Å; F75-W151 HydrophobicContact CE1-CE3 3.55Å; F75-W151 HydrophobicContact CE1-CG 4.27Å; F75-W151 HydrophobicContact CE1-CH2 4.14Å; F75-W151 HydrophobicContact CE1-CZ2 4.27Å; F75-W151 AromaticContact CE1-CZ3 3.79Å; F75-W151 HydrophobicContact CE1-CZ3 3.79Å; F75-W151 HydrophobicContact CZ-CD2 4.46Å; F75-W151 AromaticContact CZ-CE3 3.94Å; F75-W151 HydrophobicContact CZ-CE3 3.94Å; F75-W151 HydrophobicContact CZ-CZ3 4.15Å; L78-W151 HydrophobicContact CD1-CZ2 4.22Å; L78-W151 VanDerWaalsContact CD1-NE1 3.31Å; F87-W151 CarbonylContact O-C 3.52Å; F87-W151 WeakPolarHBondContact O-CA 3.39Å; F87-W151 WeakPolarHBondContact O-CB 3.45Å; I88-W151 HydrophobicContact CB-CB 4.28Å; I88-W151 HydrophobicContact CG1-CB 3.59Å; I88-W151 HydrophobicContact CG1-CG 4.44Å; L149-W151 HydrophobicContact CD2-CZ3 4.24Å; L149-W151 HydrophobicContact CG-CE3 4.35Å; L149-W151 HydrophobicContact CG-CZ3 4.29Å; W151-F162 WeakPolarHBondContact O-CA 3.39Å; W151-F163 HydrophobicContact CZ2-CB 4.21Å; W151-F163 PolarHBondContact N-O 3.46Å; W151-F163 PolarHBondContact O-N 2.87Å
152	N	97.2	Very high	94.8	Very high	15 Å²	15	43.2 Å²	43.2	8%	0.08	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	129.2	167.7	-173.5	-143.6	0	0	0	109.8	L86 F87 M160 P161 F162	L86-N152 WeakPolarHBondContact CA-O 3.49Å; F87-N152 HydrophobicContact CB-CB 4.3Å; F87-N152 PolarHBondContact N-O 3.41Å; F87-N152 PolarHBondContact O-N 3.33Å; N152-M160 VanDerWaalsContact ND2-C 3.28Å; N152-M160 PolarHBondContact ND2-O 3.37Å; N152-P161 WeakPolarHBondContact CA-O 3.22Å; N152-P161 PolarHBondContact ND2-O 2.97Å; N152-F162 HydrophobicContact CB-CD1 3.77Å; N152-F162 HydrophobicContact CB-CE1 3.55Å; N152-F162 HydrophobicContact CB-CG 4.39Å; N152-F162 HydrophobicContact CB-CZ 3.98Å
153	V	96.1	Very high	94.9	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	122.9	175.4	-176.4	0	0	0	0	108.5	Y35 T83 L86 P155 M160 P161 F163	Y35-V153 HydrophobicContact CD1-CG1 4.05Å; Y35-V153 HydrophobicContact CD1-CG2 3.95Å; Y35-V153 HydrophobicContact CD2-CG2 4.39Å; Y35-V153 HydrophobicContact CE1-CG1 3.87Å; Y35-V153 HydrophobicContact CG-CG2 3.85Å; T83-V153 HydrophobicContact CG2-CG1 3.8Å; L86-V153 HydrophobicContact CD2-CB 4.11Å; L86-V153 HydrophobicContact CD2-CG1 4.03Å; L86-V153 HydrophobicContact CD2-CG2 3.86Å; V153-P155 WeakPolarHBondContact O-CD 3.29Å; V153-M160 VanDerWaalsContact O-CA 3.24Å; V153-M160 WeakPolarHBondContact O-CA 3.38Å; V153-P161 HydrophobicContact CB-CG 4.1Å; V153-P161 PolarHBondContact N-O 3.25Å; V153-F163 HydrophobicContact CG2-CD2 4.03Å; V153-F163 HydrophobicContact CG2-CE2 4.21Å
154	I	96.1	Very high	95.2	Very high	28 Å²	28	41 Å²	41	14%	0.144	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	104.8	179.3	-60.7	172.7	0	0	0	108.3	K84 E85 M160	K84-I154 WeakPolarHBondContact CB-O 3.26Å; K84-I154 PolarHBondContact N-O 2.66Å; E85-I154 HydrophobicContact CG-CB 3.52Å; E85-I154 HydrophobicContact CG-CD1 3.85Å; E85-I154 HydrophobicContact CG-CG1 4.18Å; E85-I154 HydrophobicContact CG-CG2 3.79Å; E85-I154 PolarHBondContact N-O 2.92Å; E85-I154 PolarHBondContact O-N 2.87Å; E85-I154 VanDerWaalsContact OE1-CD1 3.25Å; E85-I154 WeakPolarHBondContact OE1-CD1 3.48Å; I154-M160 HydrophobicContact CG1-CG 4.42Å; I154-M160 HydrophobicContact CG1-SD 4.4Å; I154-M160 HydrophobicContact CG2-CE 4.26Å
155	P	95.5	Very high	95.3	Very high	10 Å²	10	37.7 Å²	37.7	7%	0.065	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	164.9	176.6	34.4	-36.6	0	0	0	112	T30 N82 V153 A157 R159	T30-P155 HydrophobicContact CG2-CB 3.95Å; T30-P155 HydrophobicContact CG2-CG 4.11Å; N82-P155 CarbonylContact O-C 3.54Å; N82-P155 WeakPolarHBondContact O-CA 3.38Å; V153-P155 WeakPolarHBondContact O-CD 3.29Å; P155-A157 VanDerWaalsContact C-N 3.31Å; P155-R159 VanDerWaalsContact CD-O 3.22Å; P155-R159 WeakPolarHBondContact CD-O 3.45Å; P155-R159 WeakPolarHBondContact CG-O 3.31Å
156	N	94.1	Very high	95.2	Very high	99 Å²	99	43 Å²	43	53%	0.529	23%	0.225	S	C	.	.	S	Bend	trans	-62.3	-40.4	168.3	-67.9	-51.4	0	0	0	111.5	N82 K84	N82-N156 PolarHBondContact O-N 3.04Å; N82-N156 PolarHBondContact O-ND2 2.86Å; N82-N156 VanDerWaalsContact O-ND2 3.14Å; N82-N156 PolarHBondContact OD1-N 3.46Å; K84-N156 WeakPolarHBondContact CB-OD1 3.48Å
157	A	92.5	Very high	95.1	Very high	25 Å²	25	43.8 Å²	43.8	21%	0.207	24%	0.237	C	C	.	.	S	Bend	trans	-146	122.5	171.9	0	0	0	0	0	109.7	T23 C26 N82 P155	T23-A157 HydrophobicContact CG2-CB 3.96Å; C26-A157 HydrophobicContact CB-CB 4.08Å; N82-A157 PolarHBondContact ND2-O 3.44Å; N82-A157 PolarHBondContact OD1-N 2.94Å; P155-A157 VanDerWaalsContact C-N 3.31Å
158	G	91.2	Very high	95	Very high	27 Å²	27	47 Å²	47	28%	0.278	26%	0.259	S	S	.	.	S	Bend	trans	152.7	-168.9	-178.8	0	0	0	0	0	114
159	R	91	Very high	94.9	Very high	150 Å²	150	48.3 Å²	48.3	57%	0.566	27%	0.265	S	S	*	.			trans	-76.3	153.9	172.4	-62	178.1	63.8	-162.1	-2.1	109.6	F27 T30 P155 P161	F27-R159 HydrophobicContact CD2-CG 4.24Å; F27-R159 HydrophobicContact CE1-CG 4.3Å; F27-R159 HydrophobicContact CE2-CB 4.49Å; F27-R159 HydrophobicContact CE2-CG 3.35Å; F27-R159 HydrophobicContact CZ-CG 3.39Å; T30-R159 PolarHBondContact OG1-N 2.96Å; P155-R159 VanDerWaalsContact CD-O 3.22Å; P155-R159 WeakPolarHBondContact CD-O 3.45Å; P155-R159 WeakPolarHBondContact CG-O 3.31Å; R159-P161 WeakPolarHBondContact O-CD 3.35Å
160	M	93.7	Very high	94.7	Very high	113 Å²	113	53.5 Å²	53.5	56%	0.557	29%	0.289	S	S	*	.			trans	-104.8	77	172.8	-61.1	175.3	-170	0	0	110.2	N152 V153 I154	N152-M160 VanDerWaalsContact ND2-C 3.28Å; N152-M160 PolarHBondContact ND2-O 3.37Å; V153-M160 VanDerWaalsContact O-CA 3.24Å; V153-M160 WeakPolarHBondContact O-CA 3.38Å; I154-M160 HydrophobicContact CG1-CG 4.42Å; I154-M160 HydrophobicContact CG1-SD 4.4Å; I154-M160 HydrophobicContact CG2-CE 4.26Å
161	P	93.2	Very high	94.5	Very high	29 Å²	29	53.8 Å²	53.8	19%	0.188	29%	0.29	C	S	.	.			trans	-72.6	150.7	-176.8	32	-38.6	0	0	0	112.4	N152 V153 R159 F163	N152-P161 WeakPolarHBondContact CA-O 3.22Å; N152-P161 PolarHBondContact ND2-O 2.97Å; V153-P161 HydrophobicContact CB-CG 4.1Å; V153-P161 PolarHBondContact N-O 3.25Å; R159-P161 WeakPolarHBondContact O-CD 3.35Å; P161-F163 HydrophobicContact CB-CD2 4.25Å; P161-F163 HydrophobicContact CB-CE2 3.51Å; P161-F163 HydrophobicContact CB-CZ 4Å; P161-F163 HydrophobicContact CG-CD2 4.34Å; P161-F163 HydrophobicContact CG-CE2 3.47Å; P161-F163 VanDerWaalsContact CG-CE2 3.47Å; P161-F163 HydrophobicContact CG-CZ 4.19Å
162	F	95.4	Very high	94.3	Very high	129 Å²	129	58.2 Å²	58.2	57%	0.566	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.7	138.5	170.7	-69.7	-97.8	0	0	0	109.4	Y89 W151 N152	Y89-F162 HydrophobicContact CE1-CD1 4.34Å; Y89-F162 HydrophobicContact CE1-CE1 4.46Å; W151-F162 WeakPolarHBondContact O-CA 3.39Å; N152-F162 HydrophobicContact CB-CD1 3.77Å; N152-F162 HydrophobicContact CB-CE1 3.55Å; N152-F162 HydrophobicContact CB-CG 4.39Å; N152-F162 HydrophobicContact CB-CZ 3.98Å
163	F	95.7	Very high	94.2	Very high	42 Å²	42	57.7 Å²	57.7	18%	0.184	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	145.9	176.2	-66.9	-86.1	0	0	0	110.2	Y35 V36 A150 W151 V153 P161	Y35-F163 HydrophobicContact CD2-CD2 4.39Å; Y35-F163 AromaticContact CD2-CE2 3.43Å; Y35-F163 HydrophobicContact CD2-CE2 3.43Å; Y35-F163 VanDerWaalsContact CD2-CE2 3.43Å; Y35-F163 AromaticContact CD2-CZ 3.64Å; Y35-F163 HydrophobicContact CD2-CZ 3.64Å; Y35-F163 HydrophobicContact CE2-CE2 4.44Å; Y35-F163 HydrophobicContact CG-CD2 4.41Å; Y35-F163 AromaticContact CG-CE2 3.86Å; Y35-F163 HydrophobicContact CG-CE2 3.86Å; Y35-F163 HydrophobicContact CG-CZ 4.32Å; V36-F163 HydrophobicContact CG2-CD1 3.86Å; V36-F163 HydrophobicContact CG2-CE1 4.48Å; A150-F163 CarbonylContact C-O 3.58Å; A150-F163 VanDerWaalsContact CA-O 3.23Å; A150-F163 WeakPolarHBondContact CA-O 3.45Å; A150-F163 VanDerWaalsContact CB-O 3.28Å; A150-F163 WeakPolarHBondContact CB-O 3.45Å; W151-F163 HydrophobicContact CZ2-CB 4.21Å; W151-F163 PolarHBondContact N-O 3.46Å; W151-F163 PolarHBondContact O-N 2.87Å; V153-F163 HydrophobicContact CG2-CD2 4.03Å; V153-F163 HydrophobicContact CG2-CE2 4.21Å; P161-F163 HydrophobicContact CB-CD2 4.25Å; P161-F163 HydrophobicContact CB-CE2 3.51Å; P161-F163 HydrophobicContact CB-CZ 4Å; P161-F163 HydrophobicContact CG-CD2 4.34Å; P161-F163 HydrophobicContact CG-CE2 3.47Å; P161-F163 VanDerWaalsContact CG-CE2 3.47Å; P161-F163 HydrophobicContact CG-CZ 4.19Å
164	T	96	Very high	94.1	Very high	74 Å²	74	60.1 Å²	60.1	45%	0.454	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	136.7	169.7	-61.4	0	0	0	0	108.2	I148	I148-T164 HydrophobicContact CG2-CG2 3.37Å
165	G	93.1	Very high	93.9	Very high	9 Å²	9	64.3 Å²	64.3	9%	0.093	35%	0.353	C	S	.	.			trans	-71.3	165.5	179.2	0	0	0	0	0	113.3	V37 L149	V37-G165 WeakPolarHBondContact O-CA 3.39Å; L149-G165 PolarHBondContact O-N 2.88Å
166	I	93.7	Very high	93.8	Very high	112 Å²	112	72.1 Å²	72.1	57%	0.574	39%	0.386	S	S	*	.	B	Isolated β-bridge	trans	-89.9	109.6	173.7	-60	164.7	0	0	0	107.9	V36 V37 P38 F39	V36-I166 HydrophobicContact CG1-CD1 3.53Å; V36-I166 HydrophobicContact CG1-CG1 3.53Å; V37-I166 PolarHBondContact O-N 3.43Å; V37-I166 VanDerWaalsContact O-N 3.1Å; P38-I166 WeakPolarHBondContact CA-O 3.15Å; F39-I166 PolarHBondContact N-O 2.92Å; F39-I166 VanDerWaalsContact N-O 3.09Å
167	G	93.6	Very high	93.7	Very high	36 Å²	36	70.4 Å²	70.4	37%	0.371	37%	0.372	S	S	.	.			trans	144.8	161.4	-177.7	0	0	0	0	0	110.7	F39	F39-G167 WeakPolarHBondContact CE1-O 3.38Å; F39-G167 WeakPolarHBondContact CZ-O 3.5Å
168	S	94.3	Very high	93.5	Very high	68 Å²	68	71.5 Å²	71.5	48%	0.476	38%	0.379	S	S	.	.			trans	-163.1	160.6	170.3	59.2	0	0	0	0	108.7	L147	L147-S168 WeakPolarHBondContact O-CA 3.46Å
169	H	95.8	Very high	93	Very high	47 Å²	47	77.4 Å²	77.4	22%	0.218	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	132.5	171.8	177.1	69.2	0	0	0	110.1	V41 S43 T146 L147	V41-H169 HydrophobicContact CG1-CB 3.55Å; V41-H169 VanDerWaalsContact O-CB 3.31Å; V41-H169 WeakPolarHBondContact O-CB 3.45Å; S43-H169 PolarHBondContact N-NE2 3.32Å; S43-H169 PolarHBondContact OG-CD2 3.42Å; S43-H169 PolarHBondContact OG-NE2 3.09Å; T146-H169 CarbonylContact C-O 3.53Å; T146-H169 WeakPolarHBondContact CA-O 3.34Å; L147-H169 PolarHBondContact N-O 3.08Å; L147-H169 PolarHBondContact O-N 3.29Å
170	H	95.1	Very high	92.2	Very high	108 Å²	108	72.2 Å²	72.2	50%	0.5	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	131.5	179.9	-58.9	-72.3	0	0	0	109.8	N144 T146	N144-H170 PolarHBondContact OD1-ND1 2.98Å; T146-H170 PolarHBondContact OG1-CE1 3.08Å; T146-H170 PolarHBondContact OG1-ND1 3.41Å
171	L	93.2	Very high	91	Very high	8 Å²	8	77.7 Å²	77.7	4%	0.042	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	131.8	179.6	169.3	71.1	0	0	0	108.9	S43 A46 F67 V145 I173	S43-L171 VanDerWaalsContact OG-CD1 3.27Å; S43-L171 WeakPolarHBondContact OG-CD1 3.49Å; A46-L171 HydrophobicContact CB-CD1 3.96Å; A46-L171 HydrophobicContact CB-CD2 4.1Å; A46-L171 HydrophobicContact CB-CG 4.32Å; F67-L171 HydrophobicContact CD1-CD2 3.44Å; F67-L171 VanDerWaalsContact CD1-CD2 3.44Å; F67-L171 HydrophobicContact CD2-CD2 4.23Å; F67-L171 HydrophobicContact CE1-CD2 3.41Å; F67-L171 VanDerWaalsContact CE1-CD2 3.41Å; F67-L171 HydrophobicContact CE2-CD2 4.21Å; F67-L171 HydrophobicContact CG-CD2 3.87Å; F67-L171 HydrophobicContact CZ-CD2 3.82Å; V145-L171 HydrophobicContact CB-CB 4.41Å; V145-L171 WeakPolarHBondContact CB-O 3.31Å; V145-L171 PolarHBondContact N-O 2.87Å; V145-L171 PolarHBondContact O-N 3.35Å; L171-I173 HydrophobicContact CD2-CD1 3.91Å; L171-I173 HydrophobicContact CG-CD1 4.13Å
172	T	94.5	Very high	89.4	Confident	92 Å²	92	77.2 Å²	77.2	56%	0.564	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-96.1	136.7	171	57.2	0	0	0	0	109.8	D143	D143-T172 WeakPolarHBondContact O-CG2 3.25Å
173	I	94	Very high	87.6	Confident	5 Å²	5	79.7 Å²	79.7	3%	0.026	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-98	135.3	175.2	-52	-58.8	0	0	0	109	A46 V48 A65 L139 G141 H142 V145 L171	A46-I173 HydrophobicContact CB-CD1 3.53Å; V48-I173 HydrophobicContact CB-CG2 3.71Å; V48-I173 HydrophobicContact CG1-CG2 4.07Å; V48-I173 HydrophobicContact CG2-CG2 4.16Å; A65-I173 HydrophobicContact CB-CD1 4.23Å; L139-I173 WeakPolarHBondContact O-CB 3.23Å; L139-I173 WeakPolarHBondContact O-CG2 3.39Å; G141-I173 WeakPolarHBondContact CA-O 3.21Å; H142-I173 HydrophobicContact CB-CB 4.32Å; H142-I173 HydrophobicContact CB-CG1 4.24Å; H142-I173 PolarHBondContact O-N 3.31Å; V145-I173 HydrophobicContact CG2-CD1 4.19Å; V145-I173 HydrophobicContact CG2-CG1 3.78Å; L171-I173 HydrophobicContact CD2-CD1 3.91Å; L171-I173 HydrophobicContact CG-CD1 4.13Å
174	P	93.7	Very high	85.5	Confident	51 Å²	51	83.2 Å²	83.2	33%	0.331	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-66.2	149.7	-177.9	26.2	-35.8	0	0	0	113.3	A46 V48 G141 K176	A46-P174 VanDerWaalsContact O-CD 3.25Å; A46-P174 WeakPolarHBondContact O-CD 3.37Å; A46-P174 VanDerWaalsContact O-CG 3.3Å; A46-P174 WeakPolarHBondContact O-CG 3.33Å; V48-P174 HydrophobicContact CG1-CG 4.22Å; G141-P174 PolarHBondContact N-O 2.94Å; G141-P174 VanDerWaalsContact N-O 3.1Å; P174-K176 PolarHBondContact O-N 3.26Å; P174-K176 VanDerWaalsContact O-N 3.15Å
175	D	92.6	Very high	85	Confident	117 Å²	117	83.7 Å²	83.7	63%	0.626	45%	0.447	S	S	*	.	S	Bend	trans	-69.8	-5.1	176.3	-62.5	-43.7	0	0	0	114.6	K140 G141	K140-D175 WeakPolarHBondContact CE-O 3.5Å; G141-D175 WeakPolarHBondContact CA-OD1 3.42Å
176	K	92.6	Very high	84.5	Confident	174 Å²	174	87.6 Å²	87.6	76%	0.757	47%	0.466	S	S	*	.	S	Bend	trans	-120.8	128.9	-174.7	-67.5	-175.6	-178.7	177.4	0	110.7	P174	P174-K176 PolarHBondContact O-N 3.26Å; P174-K176 VanDerWaalsContact O-N 3.15Å
177	Y	92.4	Very high	84	Confident	62 Å²	62	86.3 Å²	86.3	24%	0.243	46%	0.46	C	S	.	.	B	Isolated β-bridge	trans	-65	138.6	169.2	-68	-57.7	0	0	0	110.9	V48 D63 K140	V48-Y177 HydrophobicContact CB-CD1 4.48Å; V48-Y177 HydrophobicContact CG1-CD1 3.89Å; V48-Y177 HydrophobicContact CG1-CE1 4.32Å; V48-Y177 HydrophobicContact CG2-CD1 4.15Å; V48-Y177 HydrophobicContact CG2-CE1 3.96Å; V48-Y177 WeakPolarHBondContact O-CA 3.44Å; D63-Y177 WeakPolarHBondContact OD1-CE1 3.42Å; D63-Y177 VanDerWaalsContact OD1-CZ 3.28Å; D63-Y177 PolarHBondContact OD1-OH 2.67Å; D63-Y177 PolarHBondContact OD2-OH 3.24Å; K140-Y177 HydrophobicContact CB-CE1 3.99Å; K140-Y177 HydrophobicContact CD-CD2 4.24Å; K140-Y177 HydrophobicContact CD-CE1 4.25Å; K140-Y177 HydrophobicContact CD-CE2 3.63Å; K140-Y177 HydrophobicContact CG-CE1 4.17Å; K140-Y177 HydrophobicContact CG-CE2 4.39Å
178	S	88	Confident	83.5	Confident	49 Å²	49	89.2 Å²	89.2	34%	0.343	47%	0.465	S	S	.	.			trans	-80.5	125.5	174.5	179.2	0	0	0	0	111.3	V48	V48-S178 PolarHBondContact O-N 2.74Å
179	T	81.5	Confident	82.8	Confident	151 Å²	151	90.6 Å²	90.6	93%	0.926	46%	0.464	S	S	*	.			trans	-83	-15.4	178	-41.7	0	0	0	0	112.7
180	G	74.6	Confident	81.9	Confident	41 Å²	41	93.5 Å²	93.5	42%	0.423	48%	0.481	S	S	.	.	S	Bend	trans	-84.3	173.1	-176.7	0	0	0	0	0	113.7	K49	K49-G180 WeakPolarHBondContact CE-O 3.25Å; K49-G180 PolarHBondContact NZ-O 3.16Å
181	R	67.4	Low	81	Confident	228 Å²	228	92.4 Å²	92.4	86%	0.86	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-63.4	133.7	166.8	-167.4	177	178.3	172.5	-0.7	108	E183	R181-E183 PolarHBondContact O-N 3.22Å
182	V	60.9	Low	80	Confident	19 Å²	19	98.9 Å²	98.9	12%	0.115	51%	0.513	C	S	.	.	P	Polyproline II helix	trans	-67.6	132.6	168.8	-177	0	0	0	0	105	K49 A66 L184	K49-V182 HydrophobicContact CD-CG2 3.46Å; K49-V182 VanDerWaalsContact CD-CG2 3.46Å; K49-V182 HydrophobicContact CG-CG2 4.13Å; K49-V182 VanDerWaalsContact NZ-N 3.17Å; A66-V182 HydrophobicContact CB-CG1 3.85Å; V182-L184 HydrophobicContact CB-CD2 3.93Å; V182-L184 HydrophobicContact CG1-CD2 4.11Å; V182-L184 PolarHBondContact O-N 3.07Å
183	E	57.6	Low	78.8	Confident	181 Å²	181	99.5 Å²	99.5	85%	0.846	51%	0.509	S	S	*	.			trans	-67.5	90.4	162.9	-66.8	-159.2	166.4	0	0	107.5	R181	R181-E183 PolarHBondContact O-N 3.22Å
184	L	50.8	Low	77.5	Confident	116 Å²	116	108.1 Å²	108.1	61%	0.607	55%	0.552	S	S	*	*			trans	-67.7	0	168.7	-49.8	172.8	0	0	0	108.5	R127 Y131 V182	R127-L184 WeakPolarHBondContact CD-OXT 3.38Å; R127-L184 PolarHBondContact NH1-O 3.46Å; R127-L184 PolarHBondContact NH1-OXT 2.79Å; Y131-L184 HydrophobicContact CE1-CD2 3.78Å; Y131-L184 VanDerWaalsContact OH-CD2 3.22Å; Y131-L184 WeakPolarHBondContact OH-CD2 3.49Å; V182-L184 HydrophobicContact CB-CD2 3.93Å; V182-L184 HydrophobicContact CG1-CD2 4.11Å; V182-L184 PolarHBondContact O-N 3.07Å

Retrieved 184 of 184 residues in 120.8 ms (Link to these results)

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