A0A077Z1K6_TRITR Loading...

LIM domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z1K6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 244 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	55.5	Low	60.9	Low	245 Å²	245	107.5 Å²	107.5	100%	1.207	69%	0.685	S	S	*	*				0	94.4	0	-70.4	167.3	158.8	0	0	107.8
2	Q	39.4	Very low	63.3	Low	204 Å²	204	103.2 Å²	103.2	95%	0.953	65%	0.648	S	S	*	*			trans	-101.1	107.5	179.9	-71.5	157.2	26	0	0	107.1
3	A	51.8	Low	65.3	Low	103 Å²	103	97.9 Å²	97.9	85%	0.851	61%	0.613	S	S	*	*			trans	-103.8	100	165.1	0	0	0	0	0	106.4
4	G	44.1	Very low	67	Low	70 Å²	70	94.2 Å²	94.2	72%	0.722	59%	0.591	S	S	*	*			trans	-61	153.5	174.8	0	0	0	0	0	111.5	F6	G4-F6 PolarHBondContact O-N 3.18Å
5	G	40.8	Very low	68.4	Low	78 Å²	78	102.5 Å²	102.5	80%	0.804	61%	0.607	S	S	*	*			trans	-64.1	129.1	-170.9	0	0	0	0	0	113.2
6	F	53.1	Low	69.6	Low	169 Å²	169	104.1 Å²	104.1	74%	0.741	61%	0.606	S	S	*	*			trans	-106.3	110.9	143.5	-88	-98.7	0	0	0	106.5	G4 H8	G4-F6 PolarHBondContact O-N 3.18Å; F6-H8 WeakPolarHBondContact CB-NE2 3.36Å; F6-H8 AromaticContact CG-NE2 3.99Å; F6-H8 PolarHBondContact O-CD2 2.91Å; F6-H8 PolarHBondContact O-N 2.85Å
7	G	55.5	Low	70.7	Confident	81 Å²	81	100 Å²	100	84%	0.835	59%	0.592	S	S	*	*			trans	-69.3	69	176.7	0	0	0	0	0	111.3	S9	G7-S9 PolarHBondContact O-N 3.04Å
8	H	66.5	Low	71.7	Confident	117 Å²	117	95.4 Å²	95.4	54%	0.542	56%	0.564	S	S	.	*			trans	-71.8	100.3	176.6	-64.6	-63.7	0	0	0	109.5	F6 A10	F6-H8 WeakPolarHBondContact CB-NE2 3.36Å; F6-H8 AromaticContact CG-NE2 3.99Å; F6-H8 PolarHBondContact O-CD2 2.91Å; F6-H8 PolarHBondContact O-N 2.85Å; H8-A10 PolarHBondContact O-N 3.05Å
9	S	83.7	Confident	72.3	Confident	56 Å²	56	96.6 Å²	96.6	39%	0.392	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-53.9	118.6	167	-71.7	0	0	0	0	110.8	G7 I18 L30	G7-S9 PolarHBondContact O-N 3.04Å; S9-I18 VanDerWaalsContact O-CB 3.27Å; S9-I18 WeakPolarHBondContact O-CB 3.43Å; S9-I18 WeakPolarHBondContact O-CG1 3.47Å; S9-I18 PolarHBondContact O-N 2.91Å; S9-L30 WeakPolarHBondContact OG-CD1 3.49Å
10	A	88.5	Confident	72.6	Confident	58 Å²	58	95 Å²	95	48%	0.479	57%	0.566	S	S	.	*	B	Isolated β-bridge	trans	-90.5	140.4	-179.1	0	0	0	0	0	111.7	H8 F12 Q16	H8-A10 PolarHBondContact O-N 3.05Å; A10-F12 PolarHBondContact O-N 3.12Å; A10-Q16 WeakPolarHBondContact CA-O 3.32Å
11	C	90.9	Very high	73	Confident	2 Å²	2	97.9 Å²	97.9	1%	0.014	58%	0.579	C	S	.	*	B	Isolated β-bridge	trans	-64.9	123.4	175.3	175.2	0	0	0	0	110.7	L13 C14 R15 Q16 I18 L30	C11-L13 PolarHBondContact O-N 3.03Å; C11-L13 VanDerWaalsContact O-N 3.08Å; C11-C14 WeakPolarHBondContact CB-SG 3.4Å; C11-R15 WeakPolarHBondContact O-CA 3.49Å; C11-R15 PolarHBondContact O-N 3.34Å; C11-Q16 PolarHBondContact N-O 3.49Å; C11-I18 HydrophobicContact CB-CD1 4.21Å; C11-I18 HydrophobicContact CB-CG1 3.97Å; C11-L30 CarbonylContact C-O 3.57Å; C11-L30 VanDerWaalsContact CA-O 3.27Å; C11-L30 WeakPolarHBondContact CA-O 3.32Å
12	F	89.2	Confident	74.5	Confident	55 Å²	55	93.9 Å²	93.9	24%	0.241	55%	0.554	C	S	.	*	T	Hydrogen-bonded Turn	trans	-59.8	-25	-178.4	-179	-102.5	0	0	0	113.8	A10 R29 L30 I31 N55 F57	A10-F12 PolarHBondContact O-N 3.12Å; F12-R29 HydrophobicContact CB-CB 4.08Å; F12-R29 HydrophobicContact CB-CG 4.45Å; F12-R29 HydrophobicContact CD2-CB 4.43Å; F12-R29 HydrophobicContact CD2-CG 3.89Å; F12-R29 VanDerWaalsContact CE1-NH1 3.34Å; F12-R29 HydrophobicContact CE2-CG 4.38Å; F12-R29 VanDerWaalsContact CE2-CZ 3.42Å; F12-R29 HydrophobicContact CG-CB 4.21Å; F12-R29 HydrophobicContact CG-CG 4.12Å; F12-L30 PolarHBondContact N-O 3.46Å; F12-I31 HydrophobicContact CB-CG1 4.19Å; F12-N55 HydrophobicContact CE1-CB 3.98Å; F12-N55 HydrophobicContact CZ-CB 4.01Å; F12-F57 HydrophobicContact CD1-CE2 4.39Å
13	L	89.3	Confident	76.8	Confident	35 Å²	35	88.3 Å²	88.3	18%	0.183	53%	0.527	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-48.5	-176.9	-70.7	174.2	0	0	0	113.7	C11 I31 C35 N55 F57	C11-L13 PolarHBondContact O-N 3.03Å; C11-L13 VanDerWaalsContact O-N 3.08Å; L13-I31 HydrophobicContact CD1-CG2 3.66Å; L13-I31 HydrophobicContact CG-CG2 4.17Å; L13-C35 HydrophobicContact CB-CB 4.19Å; L13-C35 HydrophobicContact CD1-CB 3.88Å; L13-C35 WeakPolarHBondContact CD1-O 3.28Å; L13-N55 WeakPolarHBondContact CD2-O 3.49Å; L13-F57 HydrophobicContact CD1-CD2 3.74Å; L13-F57 HydrophobicContact CD1-CE2 3.84Å; L13-F57 HydrophobicContact CD2-CD2 4Å; L13-F57 HydrophobicContact CD2-CE2 3.85Å; L13-F57 HydrophobicContact CG-CD2 4.23Å; L13-F57 HydrophobicContact CG-CE2 3.93Å
14	C	90	Very high	78.6	Confident	46 Å²	46	84.1 Å²	84.1	31%	0.311	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-8.1	-177.9	69	0	0	0	0	114	C11 Q16 H32	C11-C14 WeakPolarHBondContact CB-SG 3.4Å; C14-Q16 PolarHBondContact O-N 2.93Å; C14-Q16 VanDerWaalsContact O-N 3.09Å; C14-H32 PolarHBondContact SG-ND1 3.02Å; C14-H32 VanDerWaalsContact SG-ND1 3.42Å
15	R	87.7	Confident	80.8	Confident	218 Å²	218	86.3 Å²	86.3	82%	0.823	48%	0.483	S	S	*	.			trans	60.5	9.2	-178.4	-54.8	179.6	-179.3	-126.2	3.4	115.3	C11	C11-R15 WeakPolarHBondContact O-CA 3.49Å; C11-R15 PolarHBondContact O-N 3.34Å
16	Q	88	Confident	82.9	Confident	128 Å²	128	84.2 Å²	84.2	60%	0.598	45%	0.454	S	S	*	.			trans	-84.2	152.4	174.4	-65.2	171	-27.4	0	0	110.3	A10 C11 C14	A10-Q16 WeakPolarHBondContact CA-O 3.32Å; C11-Q16 PolarHBondContact N-O 3.49Å; C14-Q16 PolarHBondContact O-N 2.93Å; C14-Q16 VanDerWaalsContact O-N 3.09Å
17	G	88	Confident	84.4	Confident	35 Å²	35	79.1 Å²	79.1	36%	0.361	45%	0.449	S	S	.	.	B	Isolated β-bridge	trans	-61	138	174.7	0	0	0	0	0	111.4	T19	G17-T19 PolarHBondContact O-N 2.94Å
18	I	87.8	Confident	85.7	Confident	18 Å²	18	87.2 Å²	87.2	9%	0.092	46%	0.455	C	S	.	.			trans	-88.5	100.5	172.6	-59.6	168.9	0	0	0	106.5	S9 C11 S20 F23 L30 H32	S9-I18 VanDerWaalsContact O-CB 3.27Å; S9-I18 WeakPolarHBondContact O-CB 3.43Å; S9-I18 WeakPolarHBondContact O-CG1 3.47Å; S9-I18 PolarHBondContact O-N 2.91Å; C11-I18 HydrophobicContact CB-CD1 4.21Å; C11-I18 HydrophobicContact CB-CG1 3.97Å; I18-S20 WeakPolarHBondContact CG2-O 3.49Å; I18-F23 HydrophobicContact CD1-CB 4.29Å; I18-F23 HydrophobicContact CG2-CB 3.74Å; I18-F23 HydrophobicContact CG2-CD1 3.82Å; I18-F23 HydrophobicContact CG2-CG 4.02Å; I18-L30 HydrophobicContact CD1-CB 3.29Å; I18-H32 WeakPolarHBondContact CG1-NE2 3.46Å
19	T	83.7	Confident	86.7	Confident	117 Å²	117	86.3 Å²	86.3	72%	0.718	45%	0.447	S	S	*	.			trans	-99.6	-6.8	177.6	52.2	0	0	0	0	112.8	G17	G17-T19 PolarHBondContact O-N 2.94Å
20	S	78.1	Confident	87	Confident	65 Å²	65	85.3 Å²	85.3	46%	0.455	44%	0.436	S	S	.	.	S	Bend	trans	-109.5	153.7	-176.6	-50.2	0	0	0	0	111.4	I18 K22 F23	I18-S20 WeakPolarHBondContact CG2-O 3.49Å; S20-K22 PolarHBondContact O-N 3.3Å; S20-K22 VanDerWaalsContact O-N 3.17Å; S20-F23 WeakPolarHBondContact O-CD1 3.38Å
21	D	82.1	Confident	87.1	Confident	155 Å²	155	82.5 Å²	82.5	83%	0.829	41%	0.414	S	S	*	.	S	Bend	trans	-70.8	-5.1	175.5	-50	-79	0	0	0	113.9	F23	D21-F23 PolarHBondContact O-N 3.1Å
22	K	85.3	Confident	87.1	Confident	161 Å²	161	83.9 Å²	83.9	70%	0.7	42%	0.42	S	S	*	.			trans	-90.2	66.3	-179.3	-63.9	-176	-178.1	-179.3	0	112	S20 Y33	S20-K22 PolarHBondContact O-N 3.3Å; S20-K22 VanDerWaalsContact O-N 3.17Å; K22-Y33 PolarHBondContact O-N 3.41Å
23	F	88.9	Confident	87.1	Confident	88 Å²	88	87.7 Å²	87.7	39%	0.386	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	157.7	174.2	63.4	-90.4	0	0	0	111.9	I18 S20 D21 L30 I31	I18-F23 HydrophobicContact CD1-CB 4.29Å; I18-F23 HydrophobicContact CG2-CB 3.74Å; I18-F23 HydrophobicContact CG2-CD1 3.82Å; I18-F23 HydrophobicContact CG2-CG 4.02Å; S20-F23 WeakPolarHBondContact O-CD1 3.38Å; D21-F23 PolarHBondContact O-N 3.1Å; F23-L30 HydrophobicContact CD2-CD2 3.43Å; F23-L30 VanDerWaalsContact CD2-CD2 3.43Å; F23-L30 HydrophobicContact CE2-CD2 3.56Å; F23-L30 HydrophobicContact CG-CD2 4.44Å; F23-I31 CarbonylContact C-O 3.52Å; F23-I31 VanDerWaalsContact CA-O 3.27Å; F23-I31 WeakPolarHBondContact CA-O 3.46Å; F23-I31 WeakPolarHBondContact CB-O 3.32Å
24	V	89.8	Confident	87.1	Confident	14 Å²	14	92 Å²	92	9%	0.085	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	129.3	172.2	-175.7	0	0	0	0	107.3	V26 I31 Y33 F36 T47	V24-V26 HydrophobicContact CG1-CG2 3.91Å; V24-I31 PolarHBondContact N-O 2.93Å; V24-I31 PolarHBondContact O-N 3.34Å; V24-Y33 HydrophobicContact CG2-CD2 3.62Å; V24-Y33 HydrophobicContact CG2-CE2 4.1Å; V24-Y33 HydrophobicContact CG2-CG 4.48Å; V24-F36 HydrophobicContact CB-CD1 4.28Å; V24-F36 HydrophobicContact CB-CG 4.33Å; V24-F36 HydrophobicContact CG1-CD1 4.1Å; V24-F36 HydrophobicContact CG1-CE1 4.06Å; V24-F36 HydrophobicContact CG1-CG 4.44Å; V24-F36 HydrophobicContact CG1-CZ 4.4Å; V24-F36 HydrophobicContact CG2-CB 4.3Å; V24-F36 HydrophobicContact CG2-CD1 4.02Å; V24-F36 HydrophobicContact CG2-CG 4.33Å; V24-T47 VanDerWaalsContact CG1-OG1 3.27Å; V24-T47 WeakPolarHBondContact CG1-OG1 3.39Å
25	E	89.1	Confident	87.1	Confident	117 Å²	117	91.2 Å²	91.2	55%	0.547	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	122.3	171.4	-169.6	174.1	153.1	0	0	109.5	G27 L30	E25-G27 WeakPolarHBondContact CG-O 3.1Å; E25-L30 HydrophobicContact CB-CD2 3.81Å; E25-L30 HydrophobicContact CG-CD2 3.88Å
26	V	85.9	Confident	87.3	Confident	33 Å²	33	81 Å²	81	20%	0.2	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	99.4	176.5	-173.3	0	0	0	0	108.5	V24 R28 R29 I31 F36 T47 F57	V24-V26 HydrophobicContact CG1-CG2 3.91Å; V26-R28 PolarHBondContact O-N 3.05Å; V26-R29 PolarHBondContact N-O 3.46Å; V26-R29 PolarHBondContact O-N 3.48Å; V26-I31 HydrophobicContact CB-CD1 4.36Å; V26-I31 HydrophobicContact CG2-CD1 4.06Å; V26-F36 HydrophobicContact CG2-CD2 4.35Å; V26-F36 HydrophobicContact CG2-CE2 3.67Å; V26-F36 HydrophobicContact CG2-CZ 3.96Å; V26-T47 HydrophobicContact CG2-CG2 4.36Å; V26-F57 HydrophobicContact CB-CE1 4.49Å; V26-F57 HydrophobicContact CG1-CE1 4.25Å; V26-F57 HydrophobicContact CG2-CE1 4.45Å
27	G	84.1	Confident	87.5	Confident	63 Å²	63	79.4 Å²	79.4	65%	0.649	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	-124.9	-169.5	0	0	0	0	0	110	E25	E25-G27 WeakPolarHBondContact CG-O 3.1Å
28	R	83.6	Confident	87.8	Confident	251 Å²	251	77.8 Å²	77.8	95%	0.947	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	28.1	176.2	-57.9	-173.8	-170.6	-176.2	2.8	113.2	V26	V26-R28 PolarHBondContact O-N 3.05Å
29	R	87.4	Confident	88	Confident	98 Å²	98	84.4 Å²	84.4	37%	0.37	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	126.4	-173.6	-65.7	173.6	179	-178.4	0.2	109.4	F12 V26	F12-R29 HydrophobicContact CB-CB 4.08Å; F12-R29 HydrophobicContact CB-CG 4.45Å; F12-R29 HydrophobicContact CD2-CB 4.43Å; F12-R29 HydrophobicContact CD2-CG 3.89Å; F12-R29 VanDerWaalsContact CE1-NH1 3.34Å; F12-R29 HydrophobicContact CE2-CG 4.38Å; F12-R29 VanDerWaalsContact CE2-CZ 3.42Å; F12-R29 HydrophobicContact CG-CB 4.21Å; F12-R29 HydrophobicContact CG-CG 4.12Å; V26-R29 PolarHBondContact N-O 3.46Å; V26-R29 PolarHBondContact O-N 3.48Å
30	L	89.5	Confident	88.5	Confident	34 Å²	34	83.4 Å²	83.4	18%	0.178	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	138.5	177.4	-64.4	161.8	0	0	0	109.2	S9 C11 F12 I18 F23 E25	S9-L30 WeakPolarHBondContact OG-CD1 3.49Å; C11-L30 CarbonylContact C-O 3.57Å; C11-L30 VanDerWaalsContact CA-O 3.27Å; C11-L30 WeakPolarHBondContact CA-O 3.32Å; F12-L30 PolarHBondContact N-O 3.46Å; I18-L30 HydrophobicContact CD1-CB 3.29Å; F23-L30 HydrophobicContact CD2-CD2 3.43Å; F23-L30 VanDerWaalsContact CD2-CD2 3.43Å; F23-L30 HydrophobicContact CE2-CD2 3.56Å; F23-L30 HydrophobicContact CG-CD2 4.44Å; E25-L30 HydrophobicContact CB-CD2 3.81Å; E25-L30 HydrophobicContact CG-CD2 3.88Å
31	I	90.6	Very high	89.2	Confident	0 Å²	0	83.1 Å²	83.1	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	131.3	-170	-49.2	175.5	0	0	0	107.8	F12 L13 F23 V24 V26 Y33 C35 F36 F57	F12-I31 HydrophobicContact CB-CG1 4.19Å; L13-I31 HydrophobicContact CD1-CG2 3.66Å; L13-I31 HydrophobicContact CG-CG2 4.17Å; F23-I31 CarbonylContact C-O 3.52Å; F23-I31 VanDerWaalsContact CA-O 3.27Å; F23-I31 WeakPolarHBondContact CA-O 3.46Å; F23-I31 WeakPolarHBondContact CB-O 3.32Å; V24-I31 PolarHBondContact N-O 2.93Å; V24-I31 PolarHBondContact O-N 3.34Å; V26-I31 HydrophobicContact CB-CD1 4.36Å; V26-I31 HydrophobicContact CG2-CD1 4.06Å; I31-Y33 PolarHBondContact O-N 2.88Å; I31-C35 HydrophobicContact CG2-CB 3.78Å; I31-F36 HydrophobicContact CD1-CD2 4.05Å; I31-F36 HydrophobicContact CD1-CE2 4.49Å; I31-F36 HydrophobicContact CG2-CB 4.04Å; I31-F36 HydrophobicContact CG2-CD2 4.5Å; I31-F57 HydrophobicContact CD1-CD2 4.41Å; I31-F57 HydrophobicContact CD1-CE1 3.89Å; I31-F57 HydrophobicContact CD1-CE2 3.43Å; I31-F57 VanDerWaalsContact CD1-CE2 3.43Å; I31-F57 HydrophobicContact CD1-CZ 3.12Å
32	H	91.5	Very high	89.7	Confident	30 Å²	30	83.5 Å²	83.5	14%	0.139	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	143	171.5	-63.1	130.1	0	0	0	110.8	C14 I18 D34 C35 F36	C14-H32 PolarHBondContact SG-ND1 3.02Å; C14-H32 VanDerWaalsContact SG-ND1 3.42Å; I18-H32 WeakPolarHBondContact CG1-NE2 3.46Å; H32-D34 PolarHBondContact O-N 2.92Å; H32-C35 HydrophobicContact CB-CB 3.95Å; H32-C35 CarbonylContact O-C 3.52Å; H32-C35 WeakPolarHBondContact O-CA 3.38Å; H32-C35 WeakPolarHBondContact O-CB 3.44Å; H32-C35 PolarHBondContact O-N 3.2Å; H32-F36 PolarHBondContact O-N 3.11Å
33	Y	89	Confident	90	Very high	136 Å²	136	81.9 Å²	81.9	53%	0.533	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-41.4	175.6	-154.8	-92.1	0	0	0	111.5	K22 V24 I31 C35 F36	K22-Y33 PolarHBondContact O-N 3.41Å; V24-Y33 HydrophobicContact CG2-CD2 3.62Å; V24-Y33 HydrophobicContact CG2-CE2 4.1Å; V24-Y33 HydrophobicContact CG2-CG 4.48Å; I31-Y33 PolarHBondContact O-N 2.88Å; Y33-C35 VanDerWaalsContact C-N 3.3Å; Y33-C35 PolarHBondContact O-N 3.28Å; Y33-F36 PolarHBondContact O-N 3.19Å
34	D	88.7	Confident	90.1	Very high	124 Å²	124	80.7 Å²	80.7	66%	0.663	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-26.4	175.4	-62.3	-55.9	0	0	0	114.2	H32 K37	H32-D34 PolarHBondContact O-N 2.92Å; D34-K37 PolarHBondContact O-NZ 3.39Å
35	C	90.1	Very high	90.2	Very high	31 Å²	31	80.5 Å²	80.5	21%	0.209	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-27.4	175.7	-69.4	0	0	0	0	111.3	L13 I31 H32 Y33 K37	L13-C35 HydrophobicContact CB-CB 4.19Å; L13-C35 HydrophobicContact CD1-CB 3.88Å; L13-C35 WeakPolarHBondContact CD1-O 3.28Å; I31-C35 HydrophobicContact CG2-CB 3.78Å; H32-C35 HydrophobicContact CB-CB 3.95Å; H32-C35 CarbonylContact O-C 3.52Å; H32-C35 WeakPolarHBondContact O-CA 3.38Å; H32-C35 WeakPolarHBondContact O-CB 3.44Å; H32-C35 PolarHBondContact O-N 3.2Å; Y33-C35 VanDerWaalsContact C-N 3.3Å; Y33-C35 PolarHBondContact O-N 3.28Å; C35-K37 PolarHBondContact O-N 3.25Å
36	F	92.3	Very high	90.1	Very high	2 Å²	2	83.3 Å²	83.3	1%	0.009	40%	0.395	C	S	.	.			trans	-79.3	64.7	-178.5	-167.1	-117.1	0	0	0	112.5	V24 V26 I31 H32 Y33 L45 A50 F57	V24-F36 HydrophobicContact CB-CD1 4.28Å; V24-F36 HydrophobicContact CB-CG 4.33Å; V24-F36 HydrophobicContact CG1-CD1 4.1Å; V24-F36 HydrophobicContact CG1-CE1 4.06Å; V24-F36 HydrophobicContact CG1-CG 4.44Å; V24-F36 HydrophobicContact CG1-CZ 4.4Å; V24-F36 HydrophobicContact CG2-CB 4.3Å; V24-F36 HydrophobicContact CG2-CD1 4.02Å; V24-F36 HydrophobicContact CG2-CG 4.33Å; V26-F36 HydrophobicContact CG2-CD2 4.35Å; V26-F36 HydrophobicContact CG2-CE2 3.67Å; V26-F36 HydrophobicContact CG2-CZ 3.96Å; I31-F36 HydrophobicContact CD1-CD2 4.05Å; I31-F36 HydrophobicContact CD1-CE2 4.49Å; I31-F36 HydrophobicContact CG2-CB 4.04Å; I31-F36 HydrophobicContact CG2-CD2 4.5Å; H32-F36 PolarHBondContact O-N 3.11Å; Y33-F36 PolarHBondContact O-N 3.19Å; F36-L45 HydrophobicContact CD1-CB 3.96Å; F36-L45 WeakPolarHBondContact CD1-O 3.38Å; F36-L45 VanDerWaalsContact CE1-C 3.41Å; F36-L45 HydrophobicContact CE1-CB 3.67Å; F36-L45 WeakPolarHBondContact CE1-O 3.49Å; F36-L45 HydrophobicContact CE2-CB 4.5Å; F36-L45 HydrophobicContact CZ-CB 3.97Å; F36-L45 PolarHBondContact O-N 2.85Å; F36-A50 HydrophobicContact CE1-CB 4.33Å; F36-A50 HydrophobicContact CE2-CB 3.84Å; F36-A50 HydrophobicContact CZ-CB 3.37Å; F36-F57 HydrophobicContact CD2-CD1 4.04Å; F36-F57 HydrophobicContact CD2-CD2 4.42Å; F36-F57 HydrophobicContact CD2-CE1 4.28Å; F36-F57 HydrophobicContact CD2-CG 4.12Å; F36-F57 AromaticContact CE2-CD1 3.49Å; F36-F57 HydrophobicContact CE2-CD1 3.49Å; F36-F57 VanDerWaalsContact CE2-CD1 3.49Å; F36-F57 AromaticContact CE2-CE1 3.76Å; F36-F57 HydrophobicContact CE2-CE1 3.76Å; F36-F57 AromaticContact CE2-CG 3.99Å; F36-F57 HydrophobicContact CE2-CG 3.99Å
37	K	93	Very high	90.2	Very high	96 Å²	96	85.2 Å²	85.2	42%	0.417	41%	0.407	S	S	.	.	B	Isolated β-bridge	trans	-128.2	156.4	178	58.1	177	171.4	-108.2	0	111.6	D34 C35 R39 K42 E43	D34-K37 PolarHBondContact O-NZ 3.39Å; C35-K37 PolarHBondContact O-N 3.25Å; K37-R39 PolarHBondContact O-N 2.94Å; K37-K42 HydrophobicContact CD-CB 4.5Å; K37-E43 CarbonylContact C-O 3.5Å; K37-E43 WeakPolarHBondContact CA-O 3.44Å; K37-E43 WeakPolarHBondContact CB-O 3.37Å
38	C	94.3	Very high	90.3	Very high	0 Å²	0	88.6 Å²	88.6	0%	0	41%	0.406	C	S	.	.			trans	-64.7	129.5	176.5	-179	0	0	0	0	110.5	Q40 C41 K42 E43 L45 F57 C59 C62	C38-Q40 PolarHBondContact O-N 3.24Å; C38-Q40 VanDerWaalsContact O-N 3.14Å; C38-Q40 PolarHBondContact SG-N 3.31Å; C38-C41 WeakPolarHBondContact CB-SG 3.3Å; C38-K42 WeakPolarHBondContact O-CA 3.32Å; C38-K42 PolarHBondContact O-N 2.96Å; C38-E43 PolarHBondContact N-O 2.83Å; C38-L45 HydrophobicContact CB-CD1 4.25Å; C38-L45 HydrophobicContact CB-CD2 4.05Å; C38-L45 HydrophobicContact CB-CG 4.23Å; C38-F57 WeakPolarHBondContact CA-O 3.19Å; C38-C59 HydrophobicContact CB-CB 4.01Å; C38-C59 PolarHBondContact SG-N 3.09Å; C38-C62 PolarHBondContact SG-SG 3.24Å
39	R	92.1	Very high	90.4	Very high	157 Å²	157	79 Å²	79	59%	0.592	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-28	175.7	-173	175.8	179.5	-160.3	-0.9	113.8	K37 F57 Y58	K37-R39 PolarHBondContact O-N 2.94Å; R39-F57 PolarHBondContact N-O 2.83Å; R39-Y58 HydrophobicContact CB-CE1 4.17Å
40	Q	92.8	Very high	90.5	Very high	97 Å²	97	75 Å²	75	45%	0.453	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-57.8	-175.2	-67	-63.5	-32.1	0	0	113.3	C38 Y58 C62 L66	C38-Q40 PolarHBondContact O-N 3.24Å; C38-Q40 VanDerWaalsContact O-N 3.14Å; C38-Q40 PolarHBondContact SG-N 3.31Å; Q40-Y58 HydrophobicContact CG-CD1 3.94Å; Q40-Y58 HydrophobicContact CG-CE1 3.86Å; Q40-C62 HydrophobicContact CB-CB 4.13Å; Q40-C62 HydrophobicContact CG-CB 4.44Å; Q40-L66 HydrophobicContact CG-CD1 3.41Å; Q40-L66 VanDerWaalsContact CG-CD1 3.41Å; Q40-L66 HydrophobicContact CG-CG 4.36Å
41	C	93.7	Very high	90.5	Very high	59 Å²	59	76.3 Å²	76.3	40%	0.399	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-8.5	-179.4	62	0	0	0	0	113.9	C38 E43	C38-C41 WeakPolarHBondContact CB-SG 3.3Å; C41-E43 PolarHBondContact O-N 3.47Å; C41-E43 VanDerWaalsContact O-N 3.09Å; C41-E43 WeakPolarHBondContact SG-CB 3.45Å
42	K	91.7	Very high	90.4	Very high	162 Å²	162	79.4 Å²	79.4	70%	0.704	39%	0.388	S	S	*	.			trans	61.4	8.8	-175.8	-54.9	176.5	-176.7	177.1	0	115.1	K37 C38	K37-K42 HydrophobicContact CD-CB 4.5Å; C38-K42 WeakPolarHBondContact O-CA 3.32Å; C38-K42 PolarHBondContact O-N 2.96Å
43	E	92.2	Very high	90.3	Very high	128 Å²	128	81 Å²	81	60%	0.598	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-70.7	141.1	176.2	-165.4	177.5	175.3	0	0	111.2	K37 C38 C41 L45	K37-E43 CarbonylContact C-O 3.5Å; K37-E43 WeakPolarHBondContact CA-O 3.44Å; K37-E43 WeakPolarHBondContact CB-O 3.37Å; C38-E43 PolarHBondContact N-O 2.83Å; C41-E43 PolarHBondContact O-N 3.47Å; C41-E43 VanDerWaalsContact O-N 3.09Å; C41-E43 WeakPolarHBondContact SG-CB 3.45Å; E43-L45 PolarHBondContact O-N 3.1Å
44	A	90	Very high	90.2	Very high	62 Å²	62	79.2 Å²	79.2	51%	0.512	40%	0.403	S	S	.	.	B	Isolated β-bridge	trans	-60.9	127.8	174.7	0	0	0	0	0	109.6
45	L	92.1	Very high	90.1	Very high	11 Å²	11	77.5 Å²	77.5	6%	0.058	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-90.1	156.3	180	-66.4	173.3	0	0	0	110	F36 C38 E43 A50 F57 C59	F36-L45 HydrophobicContact CD1-CB 3.96Å; F36-L45 WeakPolarHBondContact CD1-O 3.38Å; F36-L45 VanDerWaalsContact CE1-C 3.41Å; F36-L45 HydrophobicContact CE1-CB 3.67Å; F36-L45 WeakPolarHBondContact CE1-O 3.49Å; F36-L45 HydrophobicContact CE2-CB 4.5Å; F36-L45 HydrophobicContact CZ-CB 3.97Å; F36-L45 PolarHBondContact O-N 2.85Å; C38-L45 HydrophobicContact CB-CD1 4.25Å; C38-L45 HydrophobicContact CB-CD2 4.05Å; C38-L45 HydrophobicContact CB-CG 4.23Å; E43-L45 PolarHBondContact O-N 3.1Å; L45-A50 HydrophobicContact CB-CB 4.08Å; L45-A50 HydrophobicContact CD1-CB 4.11Å; L45-F57 HydrophobicContact CD1-CB 3.48Å; L45-F57 VanDerWaalsContact CD1-CB 3.48Å; L45-C59 VanDerWaalsContact CD2-CA 3.41Å; L45-C59 HydrophobicContact CD2-CB 3.66Å
46	R	88.3	Confident	90	Very high	176 Å²	176	80.3 Å²	80.3	66%	0.664	40%	0.4	S	S	*	.			trans	-104.3	149.6	167.1	-54.7	-174.1	177.5	-147.3	-0.1	109.7	E48 S49 A50	R46-E48 HydrophobicContact CB-CG 4.45Å; R46-E48 WeakPolarHBondContact CB-OE1 3.49Å; R46-E48 WeakPolarHBondContact CB-OE2 3.09Å; R46-E48 WeakPolarHBondContact CD-OE1 3.37Å; R46-E48 PolarHBondContact O-N 3.46Å; R46-E48 VanDerWaalsContact O-N 3.16Å; R46-S49 PolarHBondContact N-OG 2.71Å; R46-S49 PolarHBondContact O-N 3.4Å; R46-S49 PolarHBondContact O-OG 2.84Å; R46-A50 WeakPolarHBondContact O-CB 3.21Å; R46-A50 PolarHBondContact O-N 2.8Å
47	T	86.3	Confident	90	Very high	73 Å²	73	80.4 Å²	80.4	45%	0.448	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-36.7	-175.1	-51.7	0	0	0	0	111.7	V24 V26	V24-T47 VanDerWaalsContact CG1-OG1 3.27Å; V24-T47 WeakPolarHBondContact CG1-OG1 3.39Å; V26-T47 HydrophobicContact CG2-CG2 4.36Å
48	E	86.6	Confident	90	Very high	134 Å²	134	76.3 Å²	76.3	63%	0.626	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-33.1	178.4	66.6	-78.7	173.6	0	0	114.4	R46	R46-E48 HydrophobicContact CB-CG 4.45Å; R46-E48 WeakPolarHBondContact CB-OE1 3.49Å; R46-E48 WeakPolarHBondContact CB-OE2 3.09Å; R46-E48 WeakPolarHBondContact CD-OE1 3.37Å; R46-E48 PolarHBondContact O-N 3.46Å; R46-E48 VanDerWaalsContact O-N 3.16Å
49	S	86.9	Confident	89.8	Confident	50 Å²	50	76.9 Å²	76.9	35%	0.35	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-22.7	-173.4	60	0	0	0	0	113.1	R46 K51	R46-S49 PolarHBondContact N-OG 2.71Å; R46-S49 PolarHBondContact O-N 3.4Å; R46-S49 PolarHBondContact O-OG 2.84Å; S49-K51 PolarHBondContact O-NZ 3.22Å
50	A	89.5	Confident	89.7	Confident	14 Å²	14	70.2 Å²	70.2	12%	0.116	37%	0.366	C	S	.	.			trans	-59.6	138.2	-179.1	0	0	0	0	0	112.3	F36 L45 R46 F57	F36-A50 HydrophobicContact CE1-CB 4.33Å; F36-A50 HydrophobicContact CE2-CB 3.84Å; F36-A50 HydrophobicContact CZ-CB 3.37Å; L45-A50 HydrophobicContact CB-CB 4.08Å; L45-A50 HydrophobicContact CD1-CB 4.11Å; R46-A50 WeakPolarHBondContact O-CB 3.21Å; R46-A50 PolarHBondContact O-N 2.8Å; A50-F57 HydrophobicContact CB-CD1 4.31Å
51	K	89.4	Confident	89.4	Confident	60 Å²	60	69.6 Å²	69.6	26%	0.261	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	128.9	173.2	-60.5	-70	167.1	-83.1	0	109	S49 F57 Y58 Y63	S49-K51 PolarHBondContact O-NZ 3.22Å; K51-F57 WeakPolarHBondContact O-CA 3.36Å; K51-Y58 PolarHBondContact N-O 3.12Å; K51-Y58 PolarHBondContact O-N 2.82Å; K51-Y63 HydrophobicContact CB-CD1 4.33Å; K51-Y63 HydrophobicContact CB-CD2 3.35Å; K51-Y63 HydrophobicContact CB-CE2 3.8Å; K51-Y63 HydrophobicContact CB-CG 3.64Å; K51-Y63 HydrophobicContact CG-CD1 4.38Å; K51-Y63 HydrophobicContact CG-CD2 4.25Å; K51-Y63 HydrophobicContact CG-CG 4.04Å
52	V	88.7	Confident	89.3	Confident	66 Å²	66	66.9 Å²	66.9	40%	0.4	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	126.6	-179.9	-172.5	0	0	0	0	109.1	R56 F57	V52-R56 WeakPolarHBondContact CA-O 3.31Å; V52-F57 HydrophobicContact CG2-CD1 3.7Å; V52-F57 HydrophobicContact CG2-CE1 3.4Å; V52-F57 HydrophobicContact CG2-CZ 4.21Å
53	H	87.9	Confident	89.3	Confident	64 Å²	64	60.7 Å²	60.7	30%	0.296	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	127.9	171.1	-157.8	80.4	0	0	0	108.9	N55 R56 Y58 Y63 F67	H53-N55 VanDerWaalsContact C-N 3.32Å; H53-N55 PolarHBondContact O-N 2.69Å; H53-R56 PolarHBondContact N-O 3.29Å; H53-R56 PolarHBondContact O-N 2.86Å; H53-Y58 HydrophobicContact CB-CD2 3.9Å; H53-Y58 HydrophobicContact CB-CE2 3.71Å; H53-Y63 HydrophobicContact CB-CD2 4.38Å; H53-Y63 HydrophobicContact CB-CE2 3.88Å; H53-F67 HydrophobicContact CB-CD2 4.33Å; H53-F67 HydrophobicContact CB-CE2 3.79Å; H53-F67 HydrophobicContact CB-CZ 3.93Å; H53-F67 AromaticContact CD2-CD1 3.68Å; H53-F67 AromaticContact CD2-CE1 3.14Å; H53-F67 WeakPolarHBondContact CD2-CE1 3.15Å; H53-F67 AromaticContact CD2-CE2 3.92Å; H53-F67 AromaticContact CD2-CZ 3.28Å; H53-F67 WeakPolarHBondContact CD2-CZ 3.4Å; H53-F67 AromaticContact CE1-CD1 3.87Å; H53-F67 AromaticContact CG-CE1 3.84Å; H53-F67 AromaticContact CG-CE2 3.81Å; H53-F67 AromaticContact CG-CZ 3.67Å; H53-F67 AromaticContact NE2-CD1 3.51Å; H53-F67 AromaticContact NE2-CE1 3.37Å; H53-F67 WeakPolarHBondContact NE2-CE1 3.41Å
54	S	87.5	Confident	89.1	Confident	97 Å²	97	56 Å²	56	68%	0.678	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	49	177.5	-51	0	0	0	0	114	R56	S54-R56 PolarHBondContact O-N 3.21Å
55	N	85.8	Confident	88.9	Confident	88 Å²	88	61.3 Å²	61.3	47%	0.471	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	25.3	-177.9	-64.3	-11.7	0	0	0	115.3	F12 L13 H53	F12-N55 HydrophobicContact CE1-CB 3.98Å; F12-N55 HydrophobicContact CZ-CB 4.01Å; L13-N55 WeakPolarHBondContact CD2-O 3.49Å; H53-N55 VanDerWaalsContact C-N 3.32Å; H53-N55 PolarHBondContact O-N 2.69Å
56	R	89.5	Confident	88.7	Confident	90 Å²	90	64.4 Å²	64.4	34%	0.34	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	155.2	174.7	-60.6	-74.9	97.9	141.9	-2.7	109.9	V52 H53 S54 Y58	V52-R56 WeakPolarHBondContact CA-O 3.31Å; H53-R56 PolarHBondContact N-O 3.29Å; H53-R56 PolarHBondContact O-N 2.86Å; S54-R56 PolarHBondContact O-N 3.21Å; R56-Y58 HydrophobicContact CB-CE2 3.69Å
57	F	91.4	Very high	88.6	Confident	5 Å²	5	59.4 Å²	59.4	2%	0.022	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	139.3	-180	-60.1	-92.7	0	0	0	111.2	F12 L13 V26 I31 F36 C38 R39 L45 A50 K51 V52	F12-F57 HydrophobicContact CD1-CE2 4.39Å; L13-F57 HydrophobicContact CD1-CD2 3.74Å; L13-F57 HydrophobicContact CD1-CE2 3.84Å; L13-F57 HydrophobicContact CD2-CD2 4Å; L13-F57 HydrophobicContact CD2-CE2 3.85Å; L13-F57 HydrophobicContact CG-CD2 4.23Å; L13-F57 HydrophobicContact CG-CE2 3.93Å; V26-F57 HydrophobicContact CB-CE1 4.49Å; V26-F57 HydrophobicContact CG1-CE1 4.25Å; V26-F57 HydrophobicContact CG2-CE1 4.45Å; I31-F57 HydrophobicContact CD1-CD2 4.41Å; I31-F57 HydrophobicContact CD1-CE1 3.89Å; I31-F57 HydrophobicContact CD1-CE2 3.43Å; I31-F57 VanDerWaalsContact CD1-CE2 3.43Å; I31-F57 HydrophobicContact CD1-CZ 3.12Å; F36-F57 HydrophobicContact CD2-CD1 4.04Å; F36-F57 HydrophobicContact CD2-CD2 4.42Å; F36-F57 HydrophobicContact CD2-CE1 4.28Å; F36-F57 HydrophobicContact CD2-CG 4.12Å; F36-F57 AromaticContact CE2-CD1 3.49Å; F36-F57 HydrophobicContact CE2-CD1 3.49Å; F36-F57 VanDerWaalsContact CE2-CD1 3.49Å; F36-F57 AromaticContact CE2-CE1 3.76Å; F36-F57 HydrophobicContact CE2-CE1 3.76Å; F36-F57 AromaticContact CE2-CG 3.99Å; F36-F57 HydrophobicContact CE2-CG 3.99Å; C38-F57 WeakPolarHBondContact CA-O 3.19Å; R39-F57 PolarHBondContact N-O 2.83Å; L45-F57 HydrophobicContact CD1-CB 3.48Å; L45-F57 VanDerWaalsContact CD1-CB 3.48Å; A50-F57 HydrophobicContact CB-CD1 4.31Å; K51-F57 WeakPolarHBondContact O-CA 3.36Å; V52-F57 HydrophobicContact CG2-CD1 3.7Å; V52-F57 HydrophobicContact CG2-CE1 3.4Å; V52-F57 HydrophobicContact CG2-CZ 4.21Å
58	Y	92.4	Very high	88.6	Confident	9 Å²	9	56.9 Å²	56.9	4%	0.035	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	143.4	-178.1	-63.8	-93.6	0	0	0	110.7	R39 Q40 K51 H53 R56 L66 F67	R39-Y58 HydrophobicContact CB-CE1 4.17Å; Q40-Y58 HydrophobicContact CG-CD1 3.94Å; Q40-Y58 HydrophobicContact CG-CE1 3.86Å; K51-Y58 PolarHBondContact N-O 3.12Å; K51-Y58 PolarHBondContact O-N 2.82Å; H53-Y58 HydrophobicContact CB-CD2 3.9Å; H53-Y58 HydrophobicContact CB-CE2 3.71Å; R56-Y58 HydrophobicContact CB-CE2 3.69Å; Y58-L66 HydrophobicContact CD1-CD1 3.84Å; Y58-L66 HydrophobicContact CE1-CD1 3.51Å; Y58-F67 AromaticContact CD1-CE2 3.98Å; Y58-F67 HydrophobicContact CD1-CE2 3.98Å; Y58-F67 AromaticContact CD2-CE2 3.91Å; Y58-F67 HydrophobicContact CD2-CE2 3.91Å; Y58-F67 AromaticContact CE1-CE2 3.86Å; Y58-F67 HydrophobicContact CE1-CE2 3.86Å; Y58-F67 HydrophobicContact CE1-CZ 4.04Å; Y58-F67 AromaticContact CE2-CE2 3.82Å; Y58-F67 HydrophobicContact CE2-CE2 3.82Å; Y58-F67 AromaticContact CE2-CZ 3.98Å; Y58-F67 HydrophobicContact CE2-CZ 3.98Å; Y58-F67 AromaticContact CG-CE2 4Å; Y58-F67 HydrophobicContact CG-CE2 4Å; Y58-F67 AromaticContact CZ-CE2 3.79Å; Y58-F67 AromaticContact CZ-CZ 3.7Å
59	C	91.7	Very high	88.6	Confident	12 Å²	12	52.3 Å²	52.3	8%	0.081	28%	0.28	C	S	.	.			trans	-66.1	148.4	168.3	90.2	0	0	0	0	109.1	C38 L45 C62 Y63	C38-C59 HydrophobicContact CB-CB 4.01Å; C38-C59 PolarHBondContact SG-N 3.09Å; L45-C59 VanDerWaalsContact CD2-CA 3.41Å; L45-C59 HydrophobicContact CD2-CB 3.66Å; C59-C62 HydrophobicContact CB-CB 4.07Å; C59-C62 WeakPolarHBondContact CB-SG 3.43Å; C59-C62 WeakPolarHBondContact O-CA 3.35Å; C59-C62 WeakPolarHBondContact O-CB 3.24Å; C59-C62 PolarHBondContact O-N 2.96Å; C59-C62 WeakPolarHBondContact SG-CB 3.34Å; C59-C62 PolarHBondContact SG-N 3.43Å; C59-C62 CovalentContact SG-SG 2.07Å; C59-C62 PolarHBondContact SG-SG 3.25Å; C59-Y63 WeakPolarHBondContact O-CB 3.34Å; C59-Y63 PolarHBondContact O-N 3.45Å
60	G	88.4	Confident	88.7	Confident	17 Å²	17	59.4 Å²	59.4	18%	0.175	30%	0.299	C	S	.	.	H	α-helix	trans	-47	-53.1	177.2	0	0	0	0	0	113.1	C62 Y63 L64	G60-C62 VanDerWaalsContact C-N 3.32Å; G60-C62 PolarHBondContact O-N 3.22Å; G60-Y63 PolarHBondContact O-N 3.48Å; G60-L64 WeakPolarHBondContact O-CD1 3.39Å; G60-L64 PolarHBondContact O-N 3.4Å
61	P	88.3	Confident	88.8	Confident	85 Å²	85	58.8 Å²	58.8	55%	0.552	29%	0.294	S	S	*	.	H	α-helix	trans	-59.4	-38.3	176.1	-25.1	32.5	0	0	0	114.3	L64 R65	P61-L64 WeakPolarHBondContact O-CB 3.32Å; P61-L64 PolarHBondContact O-N 3.02Å; P61-R65 WeakPolarHBondContact O-CB 3.36Å; P61-R65 PolarHBondContact O-N 3.08Å
62	C	91.4	Very high	88.8	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.014	29%	0.293	C	S	.	.	H	α-helix	trans	-70.3	-43.5	-179	-51.5	0	0	0	0	111	C38 Q40 C59 G60 L64 R65 L66	C38-C62 PolarHBondContact SG-SG 3.24Å; Q40-C62 HydrophobicContact CB-CB 4.13Å; Q40-C62 HydrophobicContact CG-CB 4.44Å; C59-C62 HydrophobicContact CB-CB 4.07Å; C59-C62 WeakPolarHBondContact CB-SG 3.43Å; C59-C62 WeakPolarHBondContact O-CA 3.35Å; C59-C62 WeakPolarHBondContact O-CB 3.24Å; C59-C62 PolarHBondContact O-N 2.96Å; C59-C62 WeakPolarHBondContact SG-CB 3.34Å; C59-C62 PolarHBondContact SG-N 3.43Å; C59-C62 CovalentContact SG-SG 2.07Å; C59-C62 PolarHBondContact SG-SG 3.25Å; G60-C62 VanDerWaalsContact C-N 3.32Å; G60-C62 PolarHBondContact O-N 3.22Å; C62-L64 VanDerWaalsContact C-N 3.26Å; C62-L64 PolarHBondContact O-N 3.23Å; C62-R65 PolarHBondContact O-N 3.19Å; C62-L66 WeakPolarHBondContact O-CB 3.14Å; C62-L66 WeakPolarHBondContact O-CG 3.47Å; C62-L66 PolarHBondContact O-N 3.15Å; C62-L66 VanDerWaalsContact O-N 3.09Å
63	Y	90.8	Very high	88.8	Confident	32 Å²	32	58.8 Å²	58.8	13%	0.125	29%	0.294	C	S	.	.	H	α-helix	trans	-61.3	-40.4	174.7	-171.7	-86.7	0	0	0	110.2	K51 H53 C59 G60 F67 P80	K51-Y63 HydrophobicContact CB-CD1 4.33Å; K51-Y63 HydrophobicContact CB-CD2 3.35Å; K51-Y63 HydrophobicContact CB-CE2 3.8Å; K51-Y63 HydrophobicContact CB-CG 3.64Å; K51-Y63 HydrophobicContact CG-CD1 4.38Å; K51-Y63 HydrophobicContact CG-CD2 4.25Å; K51-Y63 HydrophobicContact CG-CG 4.04Å; H53-Y63 HydrophobicContact CB-CD2 4.38Å; H53-Y63 HydrophobicContact CB-CE2 3.88Å; C59-Y63 WeakPolarHBondContact O-CB 3.34Å; C59-Y63 PolarHBondContact O-N 3.45Å; G60-Y63 PolarHBondContact O-N 3.48Å; Y63-F67 HydrophobicContact CD1-CD2 4.5Å; Y63-F67 AromaticContact CD2-CD2 3.57Å; Y63-F67 HydrophobicContact CD2-CD2 3.57Å; Y63-F67 HydrophobicContact CD2-CE2 4.04Å; Y63-F67 HydrophobicContact CE1-CB 4.43Å; Y63-F67 AromaticContact CE2-CD2 3.86Å; Y63-F67 HydrophobicContact CE2-CD2 3.86Å; Y63-F67 HydrophobicContact CE2-CE2 4.43Å; Y63-F67 AromaticContact CG-CD2 3.94Å; Y63-F67 HydrophobicContact CG-CD2 3.94Å; Y63-F67 WeakPolarHBondContact O-CB 2.95Å; Y63-F67 PolarHBondContact O-N 3.33Å; Y63-P80 HydrophobicContact CE1-CG 3.97Å
64	L	87.6	Confident	88.9	Confident	30 Å²	30	58 Å²	58	16%	0.157	30%	0.295	C	S	.	.	H	α-helix	trans	-60.7	-50.6	173.9	-97.4	64.5	0	0	0	112.1	G60 P61 C62 L66 C68 F79	G60-L64 WeakPolarHBondContact O-CD1 3.39Å; G60-L64 PolarHBondContact O-N 3.4Å; P61-L64 WeakPolarHBondContact O-CB 3.32Å; P61-L64 PolarHBondContact O-N 3.02Å; C62-L64 VanDerWaalsContact C-N 3.26Å; C62-L64 PolarHBondContact O-N 3.23Å; L64-L66 VanDerWaalsContact C-N 3.26Å; L64-L66 PolarHBondContact O-N 3.29Å; L64-C68 VanDerWaalsContact CA-SG 3.55Å; L64-C68 HydrophobicContact CB-CB 4.4Å; L64-C68 HydrophobicContact CG-CB 4.25Å; L64-C68 WeakPolarHBondContact O-CA 3.41Å; L64-C68 WeakPolarHBondContact O-CB 3.47Å; L64-C68 PolarHBondContact O-N 3.38Å; L64-C68 VanDerWaalsContact O-N 3.12Å; L64-F79 HydrophobicContact CD1-CD1 3.45Å; L64-F79 VanDerWaalsContact CD1-CD1 3.45Å; L64-F79 HydrophobicContact CD1-CD2 3.93Å; L64-F79 HydrophobicContact CD1-CE1 3.07Å; L64-F79 HydrophobicContact CD1-CE2 3.58Å; L64-F79 HydrophobicContact CD1-CG 3.88Å; L64-F79 HydrophobicContact CD1-CZ 3.14Å; L64-F79 HydrophobicContact CD2-CD2 4.43Å; L64-F79 HydrophobicContact CD2-CE2 3.98Å; L64-F79 HydrophobicContact CD2-CZ 4.22Å; L64-F79 HydrophobicContact CG-CE1 4.44Å; L64-F79 HydrophobicContact CG-CE2 4.34Å; L64-F79 HydrophobicContact CG-CZ 4.29Å
65	R	85.7	Confident	89	Confident	172 Å²	172	59.9 Å²	59.9	65%	0.649	29%	0.291	S	S	*	.	H	α-helix	trans	-64.2	-34.8	-175.6	-162.9	-176.7	-52.6	105.6	3.1	112.9	P61 C62	P61-R65 WeakPolarHBondContact O-CB 3.36Å; P61-R65 PolarHBondContact O-N 3.08Å; C62-R65 PolarHBondContact O-N 3.19Å
66	L	87.7	Confident	89.1	Confident	77 Å²	77	62.8 Å²	62.8	40%	0.403	30%	0.299	S	S	.	.	H	α-helix	trans	-90.2	-41.2	-174.1	-69	179.4	0	0	0	114.2	Q40 Y58 C62 L64	Q40-L66 HydrophobicContact CG-CD1 3.41Å; Q40-L66 VanDerWaalsContact CG-CD1 3.41Å; Q40-L66 HydrophobicContact CG-CG 4.36Å; Y58-L66 HydrophobicContact CD1-CD1 3.84Å; Y58-L66 HydrophobicContact CE1-CD1 3.51Å; C62-L66 WeakPolarHBondContact O-CB 3.14Å; C62-L66 WeakPolarHBondContact O-CG 3.47Å; C62-L66 PolarHBondContact O-N 3.15Å; C62-L66 VanDerWaalsContact O-N 3.09Å; L64-L66 VanDerWaalsContact C-N 3.26Å; L64-L66 PolarHBondContact O-N 3.29Å
67	F	86.3	Confident	89.1	Confident	71 Å²	71	60.5 Å²	60.5	31%	0.311	30%	0.297	S	S	.	.	H	α-helix	trans	-115.3	-9.1	-167.3	-53.4	-64.4	0	0	0	113.1	H53 Y58 Y63	H53-F67 HydrophobicContact CB-CD2 4.33Å; H53-F67 HydrophobicContact CB-CE2 3.79Å; H53-F67 HydrophobicContact CB-CZ 3.93Å; H53-F67 AromaticContact CD2-CD1 3.68Å; H53-F67 AromaticContact CD2-CE1 3.14Å; H53-F67 WeakPolarHBondContact CD2-CE1 3.15Å; H53-F67 AromaticContact CD2-CE2 3.92Å; H53-F67 AromaticContact CD2-CZ 3.28Å; H53-F67 WeakPolarHBondContact CD2-CZ 3.4Å; H53-F67 AromaticContact CE1-CD1 3.87Å; H53-F67 AromaticContact CG-CE1 3.84Å; H53-F67 AromaticContact CG-CE2 3.81Å; H53-F67 AromaticContact CG-CZ 3.67Å; H53-F67 AromaticContact NE2-CD1 3.51Å; H53-F67 AromaticContact NE2-CE1 3.37Å; H53-F67 WeakPolarHBondContact NE2-CE1 3.41Å; Y58-F67 AromaticContact CD1-CE2 3.98Å; Y58-F67 HydrophobicContact CD1-CE2 3.98Å; Y58-F67 AromaticContact CD2-CE2 3.91Å; Y58-F67 HydrophobicContact CD2-CE2 3.91Å; Y58-F67 AromaticContact CE1-CE2 3.86Å; Y58-F67 HydrophobicContact CE1-CE2 3.86Å; Y58-F67 HydrophobicContact CE1-CZ 4.04Å; Y58-F67 AromaticContact CE2-CE2 3.82Å; Y58-F67 HydrophobicContact CE2-CE2 3.82Å; Y58-F67 AromaticContact CE2-CZ 3.98Å; Y58-F67 HydrophobicContact CE2-CZ 3.98Å; Y58-F67 AromaticContact CG-CE2 4Å; Y58-F67 HydrophobicContact CG-CE2 4Å; Y58-F67 AromaticContact CZ-CE2 3.79Å; Y58-F67 AromaticContact CZ-CZ 3.7Å; Y63-F67 HydrophobicContact CD1-CD2 4.5Å; Y63-F67 AromaticContact CD2-CD2 3.57Å; Y63-F67 HydrophobicContact CD2-CD2 3.57Å; Y63-F67 HydrophobicContact CD2-CE2 4.04Å; Y63-F67 HydrophobicContact CE1-CB 4.43Å; Y63-F67 AromaticContact CE2-CD2 3.86Å; Y63-F67 HydrophobicContact CE2-CD2 3.86Å; Y63-F67 HydrophobicContact CE2-CE2 4.43Å; Y63-F67 AromaticContact CG-CD2 3.94Å; Y63-F67 HydrophobicContact CG-CD2 3.94Å; Y63-F67 WeakPolarHBondContact O-CB 2.95Å; Y63-F67 PolarHBondContact O-N 3.33Å
68	C	86.1	Confident	88.9	Confident	19 Å²	19	60.3 Å²	60.3	13%	0.128	30%	0.296	C	S	.	.			trans	-104.6	143.4	-175.9	-60.8	0	0	0	0	111.7	L64 V78 P80	L64-C68 VanDerWaalsContact CA-SG 3.55Å; L64-C68 HydrophobicContact CB-CB 4.4Å; L64-C68 HydrophobicContact CG-CB 4.25Å; L64-C68 WeakPolarHBondContact O-CA 3.41Å; L64-C68 WeakPolarHBondContact O-CB 3.47Å; L64-C68 PolarHBondContact O-N 3.38Å; L64-C68 VanDerWaalsContact O-N 3.12Å; C68-V78 WeakPolarHBondContact CB-O 3.49Å; C68-P80 WeakPolarHBondContact SG-CD 3.4Å
69	A	87.5	Confident	88.6	Confident	38 Å²	38	62.9 Å²	62.9	31%	0.314	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	163.5	173.2	0	0	0	0	0	111.3	S77 V78 K90	A69-S77 CarbonylContact O-C 3.56Å; A69-S77 WeakPolarHBondContact O-CA 3.09Å; A69-V78 PolarHBondContact O-N 3.32Å; A69-K90 HydrophobicContact CB-CB 3.63Å; A69-K90 HydrophobicContact CB-CG 3.66Å
70	R	89.8	Confident	88.2	Confident	200 Å²	200	65.6 Å²	65.6	76%	0.755	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	134.7	170.5	-65.4	-174.3	-166.1	138.7	2.6	110.4	N72	R70-N72 PolarHBondContact O-N 3.04Å
71	C	91.7	Very high	88	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-65.1	127.8	175.5	-176.2	0	0	0	0	110.1	I73 C74 K75 K76 V78 K90 H92	C71-I73 PolarHBondContact O-N 3.3Å; C71-I73 PolarHBondContact SG-N 2.98Å; C71-C74 WeakPolarHBondContact CB-SG 2.89Å; C71-K75 WeakPolarHBondContact O-CA 3.11Å; C71-K75 PolarHBondContact O-N 2.83Å; C71-K76 VanDerWaalsContact CB-O 3.24Å; C71-K76 WeakPolarHBondContact CB-O 3.11Å; C71-K76 PolarHBondContact N-O 3.46Å; C71-V78 HydrophobicContact CB-CG2 3.51Å; C71-K90 CarbonylContact C-O 3.49Å; C71-K90 WeakPolarHBondContact CA-O 3.07Å; C71-H92 VanDerWaalsContact CB-ND1 3.31Å; C71-H92 WeakPolarHBondContact CB-ND1 3.21Å; C71-H92 PolarHBondContact SG-ND1 2.83Å
72	N	89.1	Confident	88	Confident	47 Å²	47	70 Å²	70	25%	0.251	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-23.8	177.6	-168.5	53.4	0	0	0	113.4	R70 K75 K89 K90 V91	R70-N72 PolarHBondContact O-N 3.04Å; N72-K75 WeakPolarHBondContact O-CE 3.41Å; N72-K75 PolarHBondContact O-NZ 2.96Å; N72-K75 PolarHBondContact OD1-NZ 3.32Å; N72-K89 HydrophobicContact CB-CB 4.19Å; N72-K89 HydrophobicContact CB-CD 4.2Å; N72-K89 VanDerWaalsContact ND2-CD 3.34Å; N72-K89 WeakPolarHBondContact ND2-CD 3.42Å; N72-K90 PolarHBondContact N-O 3.37Å; N72-V91 HydrophobicContact CB-CG1 4.16Å
73	I	88.6	Confident	87.9	Confident	80 Å²	80	72 Å²	72	41%	0.41	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-61.1	-175.5	-60.3	172.3	0	0	0	110.5	C71 V91 C95 L117	C71-I73 PolarHBondContact O-N 3.3Å; C71-I73 PolarHBondContact SG-N 2.98Å; I73-V91 HydrophobicContact CD1-CB 4.22Å; I73-V91 HydrophobicContact CD1-CG1 3.9Å; I73-V91 HydrophobicContact CG1-CG1 3.92Å; I73-C95 HydrophobicContact CB-CB 4.15Å; I73-C95 HydrophobicContact CD1-CB 3.96Å; I73-C95 WeakPolarHBondContact CD1-O 3.45Å; I73-C95 HydrophobicContact CG2-CB 4.3Å; I73-L117 HydrophobicContact CD1-CD1 3.86Å
74	C	90.7	Very high	87.8	Confident	47 Å²	47	70.9 Å²	70.9	32%	0.318	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-3.6	-176.5	72.8	0	0	0	0	114.4	C71 K76 H92	C71-C74 WeakPolarHBondContact CB-SG 2.89Å; C74-K76 PolarHBondContact O-N 2.78Å; C74-H92 PolarHBondContact SG-CE1 3.06Å; C74-H92 PolarHBondContact SG-ND1 2.97Å
75	K	88.8	Confident	87.9	Confident	136 Å²	136	73 Å²	73	59%	0.591	36%	0.358	S	S	*	.			trans	60.4	8.2	-177.2	-51.5	-55.9	-171.9	-165.6	0	115.9	C71 N72	C71-K75 WeakPolarHBondContact O-CA 3.11Å; C71-K75 PolarHBondContact O-N 2.83Å; N72-K75 WeakPolarHBondContact O-CE 3.41Å; N72-K75 PolarHBondContact O-NZ 2.96Å; N72-K75 PolarHBondContact OD1-NZ 3.32Å
76	K	88.6	Confident	87.9	Confident	149 Å²	149	65.7 Å²	65.7	65%	0.648	33%	0.332	S	S	*	.	S	Bend	trans	-87.2	158	174.5	-57.4	179	-176.4	178	0	111.7	C71 C74	C71-K76 VanDerWaalsContact CB-O 3.24Å; C71-K76 WeakPolarHBondContact CB-O 3.11Å; C71-K76 PolarHBondContact N-O 3.46Å; C74-K76 PolarHBondContact O-N 2.78Å
77	S	89.2	Confident	87.7	Confident	43 Å²	43	70.5 Å²	70.5	30%	0.301	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	142.9	175.4	-65.5	0	0	0	0	112.3	A69 H92	A69-S77 CarbonylContact O-C 3.56Å; A69-S77 WeakPolarHBondContact O-CA 3.09Å; S77-H92 PolarHBondContact O-NE2 3.2Å
78	V	87.3	Confident	87.6	Confident	1 Å²	1	70.1 Å²	70.1	1%	0.006	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	117.7	-174.8	-169.1	0	0	0	0	110.2	C68 A69 C71 D82 V83 H92	C68-V78 WeakPolarHBondContact CB-O 3.49Å; A69-V78 PolarHBondContact O-N 3.32Å; C71-V78 HydrophobicContact CB-CG2 3.51Å; V78-D82 WeakPolarHBondContact CG1-O 3.48Å; V78-V83 HydrophobicContact CB-CB 4.31Å; V78-V83 HydrophobicContact CB-CG2 4.22Å; V78-V83 HydrophobicContact CG1-CB 3.62Å; V78-V83 HydrophobicContact CG1-CG2 3.89Å; V78-H92 HydrophobicContact CG1-CB 4.47Å
79	F	85.8	Confident	87.7	Confident	63 Å²	63	73.3 Å²	73.3	28%	0.276	37%	0.372	S	S	.	.			trans	-55.8	146.1	175.4	-74.3	-91.8	0	0	0	111.3	L64 Q81 D82 V83	L64-F79 HydrophobicContact CD1-CD1 3.45Å; L64-F79 VanDerWaalsContact CD1-CD1 3.45Å; L64-F79 HydrophobicContact CD1-CD2 3.93Å; L64-F79 HydrophobicContact CD1-CE1 3.07Å; L64-F79 HydrophobicContact CD1-CE2 3.58Å; L64-F79 HydrophobicContact CD1-CG 3.88Å; L64-F79 HydrophobicContact CD1-CZ 3.14Å; L64-F79 HydrophobicContact CD2-CD2 4.43Å; L64-F79 HydrophobicContact CD2-CE2 3.98Å; L64-F79 HydrophobicContact CD2-CZ 4.22Å; L64-F79 HydrophobicContact CG-CE1 4.44Å; L64-F79 HydrophobicContact CG-CE2 4.34Å; L64-F79 HydrophobicContact CG-CZ 4.29Å; F79-Q81 HydrophobicContact CB-CG 3.99Å; F79-Q81 PolarHBondContact O-N 3.44Å; F79-D82 CarbonylContact O-C 3.5Å; F79-D82 PolarHBondContact O-N 2.92Å; F79-V83 PolarHBondContact O-N 2.88Å; F79-V83 VanDerWaalsContact O-N 3.14Å
80	P	83.2	Confident	87.8	Confident	68 Å²	68	75.1 Å²	75.1	44%	0.442	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-22.6	179.6	25	-36.3	0	0	0	113.6	Y63 C68 V83	Y63-P80 HydrophobicContact CE1-CG 3.97Å; C68-P80 WeakPolarHBondContact SG-CD 3.4Å; P80-V83 WeakPolarHBondContact O-CG1 3.39Å
81	Q	84.4	Confident	87.9	Confident	149 Å²	149	65.8 Å²	65.8	70%	0.696	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-24	175.2	68.4	-167.7	-48.5	0	0	114	F79	F79-Q81 HydrophobicContact CB-CG 3.99Å; F79-Q81 PolarHBondContact O-N 3.44Å
82	D	87.5	Confident	87.9	Confident	47 Å²	47	67.1 Å²	67.1	25%	0.251	34%	0.344	S	S	.	.	S	Bend	trans	-112	11.7	-175.2	-173.7	31.3	0	0	0	111.7	V78 F79 H92 Q93	V78-D82 WeakPolarHBondContact CG1-O 3.48Å; F79-D82 CarbonylContact O-C 3.5Å; F79-D82 PolarHBondContact O-N 2.92Å; D82-H92 WeakPolarHBondContact O-CA 3.37Å; D82-H92 IonicContact OD2-CD2 2.69Å; D82-Q93 PolarHBondContact O-N 3.06Å; D82-Q93 VanDerWaalsContact O-N 3.08Å; D82-Q93 WeakPolarHBondContact OD1-CB 3.47Å; D82-Q93 WeakPolarHBondContact OD1-CG 3.1Å; D82-Q93 PolarHBondContact OD1-N 3.42Å
83	V	88.8	Confident	87.9	Confident	43 Å²	43	69.6 Å²	69.6	26%	0.261	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	127.3	-179.1	74.8	0	0	0	0	111.2	V78 F79 P80 K90	V78-V83 HydrophobicContact CB-CB 4.31Å; V78-V83 HydrophobicContact CB-CG2 4.22Å; V78-V83 HydrophobicContact CG1-CB 3.62Å; V78-V83 HydrophobicContact CG1-CG2 3.89Å; F79-V83 PolarHBondContact O-N 2.88Å; F79-V83 VanDerWaalsContact O-N 3.14Å; P80-V83 WeakPolarHBondContact O-CG1 3.39Å; V83-K90 HydrophobicContact CG2-CB 3.69Å; V83-K90 HydrophobicContact CG2-CD 3.77Å; V83-K90 HydrophobicContact CG2-CG 4.15Å
84	V	89.8	Confident	88	Confident	9 Å²	9	69.7 Å²	69.7	6%	0.055	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	139.8	168.9	-174.2	0	0	0	0	108.7	L86 K90 V91 Q93 L96 I107	V84-L86 HydrophobicContact CG1-CD2 4.03Å; V84-L86 HydrophobicContact CG1-CG 4.28Å; V84-K90 WeakPolarHBondContact O-CA 3.44Å; V84-V91 HydrophobicContact CB-CG2 4.08Å; V84-V91 PolarHBondContact N-O 3.15Å; V84-V91 PolarHBondContact O-N 2.85Å; V84-Q93 HydrophobicContact CG2-CB 4.22Å; V84-Q93 HydrophobicContact CG2-CG 3.33Å; V84-L96 HydrophobicContact CB-CD1 4.34Å; V84-L96 HydrophobicContact CG1-CD1 4.2Å; V84-L96 HydrophobicContact CG2-CD1 4.09Å; V84-I107 HydrophobicContact CG1-CD1 4.3Å; V84-I107 HydrophobicContact CG1-CG1 4.12Å; V84-I107 HydrophobicContact CG2-CD1 4.19Å; V84-I107 HydrophobicContact CG2-CG1 4.42Å
85	T	89.7	Confident	88.1	Confident	75 Å²	75	68.4 Å²	68.4	46%	0.46	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	117.1	172.6	-57.3	0	0	0	0	109.6	K89 K90	T85-K89 CarbonylContact C-O 3.51Å; T85-K89 WeakPolarHBondContact CA-O 3.45Å; T85-K90 VanDerWaalsContact CG2-NZ 3.33Å; T85-K90 WeakPolarHBondContact OG1-CD 3.48Å; T85-K90 WeakPolarHBondContact OG1-CE 3.45Å; T85-K90 PolarHBondContact OG1-NZ 2.82Å
86	L	84.8	Confident	88.2	Confident	18 Å²	18	62.1 Å²	62.1	9%	0.094	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	119	174.9	-66.7	-169.1	0	0	0	110.2	V84 G88 K89 V91 L96 H110 L117	V84-L86 HydrophobicContact CG1-CD2 4.03Å; V84-L86 HydrophobicContact CG1-CG 4.28Å; L86-G88 PolarHBondContact O-N 2.91Å; L86-G88 VanDerWaalsContact O-N 3.15Å; L86-K89 PolarHBondContact N-O 2.84Å; L86-K89 WeakPolarHBondContact O-CA 3.27Å; L86-K89 WeakPolarHBondContact O-CB 3.48Å; L86-K89 PolarHBondContact O-N 2.81Å; L86-V91 HydrophobicContact CD1-CG2 3.99Å; L86-V91 HydrophobicContact CG-CG2 3.98Å; L86-L96 HydrophobicContact CD1-CD2 3.28Å; L86-L96 HydrophobicContact CG-CD2 4.1Å; L86-H110 WeakPolarHBondContact CD2-CE1 3.11Å; L86-H110 WeakPolarHBondContact CD2-NE2 3.07Å; L86-L117 HydrophobicContact CD1-CD1 3.79Å; L86-L117 HydrophobicContact CD1-CD2 3.97Å
87	R	84.8	Confident	88.4	Confident	178 Å²	178	57.7 Å²	57.7	67%	0.672	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	42.6	-176.8	-67.6	-172.9	168.3	164.9	0.7	112.7	K89 I112	R87-K89 PolarHBondContact O-N 3.18Å; R87-I112 HydrophobicContact CG-CD1 3.91Å; R87-I112 PolarHBondContact NH1-O 3.31Å; R87-I112 PolarHBondContact NH2-O 3.31Å
88	G	84.2	Confident	88.6	Confident	62 Å²	62	55.7 Å²	55.7	64%	0.639	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.6	-16.7	-176.3	0	0	0	0	0	115.7	L86	L86-G88 PolarHBondContact O-N 2.91Å; L86-G88 VanDerWaalsContact O-N 3.15Å
89	K	87.4	Confident	88.8	Confident	86 Å²	86	57.7 Å²	57.7	37%	0.374	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	147.2	178.1	-55.4	-171.5	-178.1	-178.2	0	111	N72 T85 L86 R87 E115	N72-K89 HydrophobicContact CB-CB 4.19Å; N72-K89 HydrophobicContact CB-CD 4.2Å; N72-K89 VanDerWaalsContact ND2-CD 3.34Å; N72-K89 WeakPolarHBondContact ND2-CD 3.42Å; T85-K89 CarbonylContact C-O 3.51Å; T85-K89 WeakPolarHBondContact CA-O 3.45Å; L86-K89 PolarHBondContact N-O 2.84Å; L86-K89 WeakPolarHBondContact O-CA 3.27Å; L86-K89 WeakPolarHBondContact O-CB 3.48Å; L86-K89 PolarHBondContact O-N 2.81Å; R87-K89 PolarHBondContact O-N 3.18Å; K89-E115 IonicContact NZ-OE1 2.88Å; K89-E115 PolarHBondContact NZ-OE1 3.4Å
90	K	90.5	Very high	89.1	Confident	76 Å²	76	57.5 Å²	57.5	33%	0.33	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	133.5	178.9	-59	-64	-175.4	-110.6	0	110.1	A69 C71 N72 V83 V84 T85	A69-K90 HydrophobicContact CB-CB 3.63Å; A69-K90 HydrophobicContact CB-CG 3.66Å; C71-K90 CarbonylContact C-O 3.49Å; C71-K90 WeakPolarHBondContact CA-O 3.07Å; N72-K90 PolarHBondContact N-O 3.37Å; V83-K90 HydrophobicContact CG2-CB 3.69Å; V83-K90 HydrophobicContact CG2-CD 3.77Å; V83-K90 HydrophobicContact CG2-CG 4.15Å; V84-K90 WeakPolarHBondContact O-CA 3.44Å; T85-K90 VanDerWaalsContact CG2-NZ 3.33Å; T85-K90 WeakPolarHBondContact OG1-CD 3.48Å; T85-K90 WeakPolarHBondContact OG1-CE 3.45Å; T85-K90 PolarHBondContact OG1-NZ 2.82Å
91	V	91	Very high	89.5	Confident	5 Å²	5	57.4 Å²	57.4	3%	0.03	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	155.7	-178.9	-61.6	0	0	0	0	110.9	N72 I73 V84 L86 L96	N72-V91 HydrophobicContact CB-CG1 4.16Å; I73-V91 HydrophobicContact CD1-CB 4.22Å; I73-V91 HydrophobicContact CD1-CG1 3.9Å; I73-V91 HydrophobicContact CG1-CG1 3.92Å; V84-V91 HydrophobicContact CB-CG2 4.08Å; V84-V91 PolarHBondContact N-O 3.15Å; V84-V91 PolarHBondContact O-N 2.85Å; L86-V91 HydrophobicContact CD1-CG2 3.99Å; L86-V91 HydrophobicContact CG-CG2 3.98Å; V91-L96 HydrophobicContact CG2-CD2 3.56Å; V91-L96 HydrophobicContact CG2-CG 4.41Å
92	H	91.9	Very high	89.9	Confident	27 Å²	27	58.4 Å²	58.4	13%	0.125	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	147.4	170.1	-59.9	94.8	0	0	0	110.4	C71 C74 S77 V78 D82 A94 C95	C71-H92 VanDerWaalsContact CB-ND1 3.31Å; C71-H92 WeakPolarHBondContact CB-ND1 3.21Å; C71-H92 PolarHBondContact SG-ND1 2.83Å; C74-H92 PolarHBondContact SG-CE1 3.06Å; C74-H92 PolarHBondContact SG-ND1 2.97Å; S77-H92 PolarHBondContact O-NE2 3.2Å; V78-H92 HydrophobicContact CG1-CB 4.47Å; D82-H92 WeakPolarHBondContact O-CA 3.37Å; D82-H92 IonicContact OD2-CD2 2.69Å; H92-A94 PolarHBondContact O-N 3.04Å; H92-C95 HydrophobicContact CB-CB 3.9Å; H92-C95 PolarHBondContact ND1-SG 2.93Å; H92-C95 WeakPolarHBondContact O-CB 3.3Å; H92-C95 PolarHBondContact O-N 2.81Å
93	Q	90	Very high	90.1	Very high	100 Å²	100	57.9 Å²	57.9	47%	0.467	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-57.7	-42.6	169.6	-64.7	-179.9	18.6	0	0	110.4	D82 V84 C95 L96	D82-Q93 PolarHBondContact O-N 3.06Å; D82-Q93 VanDerWaalsContact O-N 3.08Å; D82-Q93 WeakPolarHBondContact OD1-CB 3.47Å; D82-Q93 WeakPolarHBondContact OD1-CG 3.1Å; D82-Q93 PolarHBondContact OD1-N 3.42Å; V84-Q93 HydrophobicContact CG2-CB 4.22Å; V84-Q93 HydrophobicContact CG2-CG 3.33Å; Q93-C95 PolarHBondContact O-N 3.06Å; Q93-L96 VanDerWaalsContact O-CB 3.3Å; Q93-L96 WeakPolarHBondContact O-CB 3.34Å; Q93-L96 WeakPolarHBondContact O-CG 3.37Å; Q93-L96 PolarHBondContact O-N 3.33Å; Q93-L96 VanDerWaalsContact O-N 3.12Å
94	A	90.3	Very high	90.3	Very high	81 Å²	81	61.4 Å²	61.4	67%	0.669	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-66.6	-18.3	176.9	0	0	0	0	0	114.2	H92 L96	H92-A94 PolarHBondContact O-N 3.04Å; A94-L96 VanDerWaalsContact C-N 3.33Å
95	C	91.3	Very high	90.3	Very high	20 Å²	20	61.6 Å²	61.6	14%	0.135	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-86	-6.8	176.2	-74.7	0	0	0	0	112.7	I73 H92 Q93 V97	I73-C95 HydrophobicContact CB-CB 4.15Å; I73-C95 HydrophobicContact CD1-CB 3.96Å; I73-C95 WeakPolarHBondContact CD1-O 3.45Å; I73-C95 HydrophobicContact CG2-CB 4.3Å; H92-C95 HydrophobicContact CB-CB 3.9Å; H92-C95 PolarHBondContact ND1-SG 2.93Å; H92-C95 WeakPolarHBondContact O-CB 3.3Å; H92-C95 PolarHBondContact O-N 2.81Å; Q93-C95 PolarHBondContact O-N 3.06Å; C95-V97 PolarHBondContact O-N 3.14Å
96	L	91.2	Very high	90	Very high	5 Å²	5	59.7 Å²	59.7	3%	0.026	35%	0.345	C	S	.	.			trans	-72.9	81.9	173.4	-61.1	-174.7	0	0	0	108.9	V84 L86 V91 Q93 A94 P104 L105 I107 L117	V84-L96 HydrophobicContact CB-CD1 4.34Å; V84-L96 HydrophobicContact CG1-CD1 4.2Å; V84-L96 HydrophobicContact CG2-CD1 4.09Å; L86-L96 HydrophobicContact CD1-CD2 3.28Å; L86-L96 HydrophobicContact CG-CD2 4.1Å; V91-L96 HydrophobicContact CG2-CD2 3.56Å; V91-L96 HydrophobicContact CG2-CG 4.41Å; Q93-L96 VanDerWaalsContact O-CB 3.3Å; Q93-L96 WeakPolarHBondContact O-CB 3.34Å; Q93-L96 WeakPolarHBondContact O-CG 3.37Å; Q93-L96 PolarHBondContact O-N 3.33Å; Q93-L96 VanDerWaalsContact O-N 3.12Å; A94-L96 VanDerWaalsContact C-N 3.33Å; L96-P104 CarbonylContact O-C 3.57Å; L96-P104 WeakPolarHBondContact O-CA 3.14Å; L96-L105 HydrophobicContact CB-CB 4.11Å; L96-L105 VanDerWaalsContact CB-O 3.32Å; L96-L105 WeakPolarHBondContact CB-O 3.46Å; L96-L105 PolarHBondContact O-N 3.35Å; L96-I107 HydrophobicContact CD1-CG1 4.34Å; L96-L117 HydrophobicContact CD2-CD1 3.88Å
97	V	92.9	Very high	89.9	Confident	55 Å²	55	64.7 Å²	64.7	33%	0.333	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-130.8	147.6	180	-65.1	0	0	0	0	110.5	C95 A99 A103	C95-V97 PolarHBondContact O-N 3.14Å; V97-A99 PolarHBondContact O-N 3.3Å; V97-A103 CarbonylContact C-O 3.52Å; V97-A103 VanDerWaalsContact CA-O 3.28Å; V97-A103 WeakPolarHBondContact CA-O 3.4Å
98	C	93.7	Very high	89.8	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.007	37%	0.371	C	S	.	.			trans	-65.9	128.8	176.6	179.8	0	0	0	0	110.8	L100 C101 K102 A103 L105 L117 C119	C98-L100 PolarHBondContact O-N 3.08Å; C98-L100 VanDerWaalsContact O-N 3.1Å; C98-L100 PolarHBondContact SG-N 2.94Å; C98-C101 WeakPolarHBondContact CB-SG 3.28Å; C98-K102 WeakPolarHBondContact O-CA 3.37Å; C98-K102 PolarHBondContact O-N 3.29Å; C98-A103 PolarHBondContact N-O 2.07Å; C98-L105 HydrophobicContact CB-CD2 4.23Å; C98-L117 CarbonylContact C-O 3.56Å; C98-L117 VanDerWaalsContact CA-O 3.32Å; C98-L117 WeakPolarHBondContact CA-O 3.27Å; C98-C119 HydrophobicContact CB-CB 4.2Å
99	A	91.5	Very high	89.7	Confident	44 Å²	44	63.8 Å²	63.8	36%	0.364	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-21.5	178.5	0	0	0	0	0	113.8	V97 D116 L117 F118 K127	V97-A99 PolarHBondContact O-N 3.3Å; A99-D116 HydrophobicContact CB-CB 4Å; A99-L117 PolarHBondContact N-O 3.49Å; A99-F118 HydrophobicContact CB-CE1 4.1Å; A99-F118 HydrophobicContact CB-CZ 4.39Å; A99-K127 HydrophobicContact CB-CD 4.02Å
100	L	91.3	Very high	89.7	Confident	58 Å²	58	61.3 Å²	61.3	30%	0.304	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-61.1	178.7	-171.9	72.1	0	0	0	112.7	C98 C123 E126 K127	C98-L100 PolarHBondContact O-N 3.08Å; C98-L100 VanDerWaalsContact O-N 3.1Å; C98-L100 PolarHBondContact SG-N 2.94Å; L100-C123 HydrophobicContact CB-CB 4.23Å; L100-C123 HydrophobicContact CD2-CB 4.01Å; L100-C123 WeakPolarHBondContact CD2-O 3.4Å; L100-E126 HydrophobicContact CD2-CB 3.47Å; L100-E126 VanDerWaalsContact CD2-CB 3.47Å; L100-E126 HydrophobicContact CD2-CG 4.41Å; L100-K127 HydrophobicContact CD1-CB 4.21Å
101	C	93.4	Very high	89.6	Confident	66 Å²	66	63.6 Å²	63.6	45%	0.446	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-3.9	-173.8	66.9	0	0	0	0	114.1	C98 A103 C119	C98-C101 WeakPolarHBondContact CB-SG 3.28Å; C101-A103 PolarHBondContact O-N 3.16Å; C101-A103 VanDerWaalsContact SG-CB 3.52Å; C101-C119 PolarHBondContact SG-SG 2.96Å
102	K	91.9	Very high	89.5	Confident	171 Å²	171	65 Å²	65	74%	0.743	38%	0.379	S	S	*	.			trans	58.9	13.3	-177.6	-54.9	175.8	-178.4	176.7	0	114.8	C98	C98-K102 WeakPolarHBondContact O-CA 3.37Å; C98-K102 PolarHBondContact O-N 3.29Å
103	A	92.5	Very high	89.3	Confident	36 Å²	36	66.3 Å²	66.3	30%	0.298	39%	0.389	S	S	.	.			trans	-65.1	138.8	175.7	0	0	0	0	0	110.9	V97 C98 C101	V97-A103 CarbonylContact C-O 3.52Å; V97-A103 VanDerWaalsContact CA-O 3.28Å; V97-A103 WeakPolarHBondContact CA-O 3.4Å; C98-A103 PolarHBondContact N-O 2.07Å; C101-A103 PolarHBondContact O-N 3.16Å; C101-A103 VanDerWaalsContact SG-CB 3.52Å
104	P	91.3	Very high	89	Confident	117 Å²	117	64.4 Å²	64.4	76%	0.76	40%	0.397	S	S	*	.	B	Isolated β-bridge	trans	-63.2	140.3	175.7	28.2	-34.3	0	0	0	110.4	L96	L96-P104 CarbonylContact O-C 3.57Å; L96-P104 WeakPolarHBondContact O-CA 3.14Å
105	L	90.6	Very high	88.7	Confident	12 Å²	12	67.3 Å²	67.3	6%	0.063	40%	0.396	C	S	.	.			trans	-112.3	127.6	-175.4	-56.7	177.7	0	0	0	109.2	L96 C98 H110 L117 C119	L96-L105 HydrophobicContact CB-CB 4.11Å; L96-L105 VanDerWaalsContact CB-O 3.32Å; L96-L105 WeakPolarHBondContact CB-O 3.46Å; L96-L105 PolarHBondContact O-N 3.35Å; C98-L105 HydrophobicContact CB-CD2 4.23Å; L105-H110 HydrophobicContact CB-CB 4.14Å; L105-H110 HydrophobicContact CD1-CB 3.87Å; L105-H110 HydrophobicContact CG-CB 4.43Å; L105-L117 HydrophobicContact CD1-CB 3.44Å; L105-L117 VanDerWaalsContact CD1-CB 3.44Å; L105-L117 HydrophobicContact CD1-CD1 4.33Å; L105-L117 HydrophobicContact CD1-CG 4.48Å; L105-C119 HydrophobicContact CD2-CB 3.42Å; L105-C119 VanDerWaalsContact CD2-CB 3.42Å
106	G	84.3	Confident	88.6	Confident	35 Å²	35	69.2 Å²	69.2	36%	0.361	41%	0.405	S	S	.	.			trans	-69.6	158.1	172.1	0	0	0	0	0	112.2	G108 Q109 H110	G106-G108 PolarHBondContact O-N 2.79Å; G106-Q109 PolarHBondContact O-N 3.34Å; G106-H110 PolarHBondContact O-ND1 2.95Å
107	I	82.7	Confident	88.6	Confident	123 Å²	123	69.6 Å²	69.6	63%	0.631	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	121.7	168.2	-54.9	174	0	0	0	107.4	V84 L96 Q109	V84-I107 HydrophobicContact CG1-CD1 4.3Å; V84-I107 HydrophobicContact CG1-CG1 4.12Å; V84-I107 HydrophobicContact CG2-CD1 4.19Å; V84-I107 HydrophobicContact CG2-CG1 4.42Å; L96-I107 HydrophobicContact CD1-CG1 4.34Å; I107-Q109 PolarHBondContact O-N 2.99Å
108	G	81	Confident	88.6	Confident	67 Å²	67	67.2 Å²	67.2	69%	0.691	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.5	-16.5	-178	0	0	0	0	0	116.1	G106 H110	G106-G108 PolarHBondContact O-N 2.79Å; G108-H110 PolarHBondContact N-CE1 2.95Å
109	Q	83	Confident	88.6	Confident	155 Å²	155	69.4 Å²	69.4	72%	0.724	41%	0.407	S	S	*	.			trans	-105.1	52.5	179.6	-63.2	-175	3	0	0	112	G106 I107	G106-Q109 PolarHBondContact O-N 3.34Å; I107-Q109 PolarHBondContact O-N 2.99Å
110	H	88.1	Confident	88.6	Confident	34 Å²	34	68.8 Å²	68.8	16%	0.157	40%	0.4	C	S	.	.			trans	-144.2	143.1	179.6	51.2	-98.9	0	0	0	111.5	L86 L105 G106 G108 F118	L86-H110 WeakPolarHBondContact CD2-CE1 3.11Å; L86-H110 WeakPolarHBondContact CD2-NE2 3.07Å; L105-H110 HydrophobicContact CB-CB 4.14Å; L105-H110 HydrophobicContact CD1-CB 3.87Å; L105-H110 HydrophobicContact CG-CB 4.43Å; G106-H110 PolarHBondContact O-ND1 2.95Å; G108-H110 PolarHBondContact N-CE1 2.95Å; H110-F118 WeakPolarHBondContact CA-O 3.48Å
111	Y	88.7	Confident	88.6	Confident	124 Å²	124	69.5 Å²	69.5	49%	0.486	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	123.6	174.5	-65.4	-93.1	0	0	0	108.3	L117 F118	Y111-L117 CarbonylContact O-C 3.56Å; Y111-F118 PolarHBondContact N-O 3.34Å; Y111-F118 WeakPolarHBondContact O-CD2 3.4Å; Y111-F118 PolarHBondContact O-N 2.94Å
112	I	88.5	Confident	88.6	Confident	34 Å²	34	74.3 Å²	74.3	17%	0.174	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	110.3	-178.9	-44.3	-176.3	0	0	0	109	R87 D116 L117	R87-I112 HydrophobicContact CG-CD1 3.91Å; R87-I112 PolarHBondContact NH1-O 3.31Å; R87-I112 PolarHBondContact NH2-O 3.31Å; I112-D116 WeakPolarHBondContact CA-O 3.45Å; I112-L117 HydrophobicContact CB-CD2 4.27Å; I112-L117 HydrophobicContact CD1-CD2 3.95Å; I112-L117 HydrophobicContact CG1-CD2 3.61Å; I112-L117 HydrophobicContact CG2-CD2 4.07Å
113	V	87	Confident	88.7	Confident	54 Å²	54	67 Å²	67	33%	0.327	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	110.8	176.1	-175.5	0	0	0	0	107.9	E115 D116 F118 A124	V113-E115 PolarHBondContact O-N 3.12Å; V113-D116 PolarHBondContact N-O 2.84Å; V113-D116 VanDerWaalsContact N-O 3.09Å; V113-D116 PolarHBondContact O-N 3.47Å; V113-F118 HydrophobicContact CB-CD2 4.27Å; V113-F118 HydrophobicContact CB-CE2 3.78Å; V113-F118 HydrophobicContact CG2-CD2 4.15Å; V113-F118 HydrophobicContact CG2-CE2 4.12Å; V113-A124 HydrophobicContact CG2-CB 3.94Å
114	G	84.6	Confident	88.7	Confident	61 Å²	61	65.4 Å²	65.4	63%	0.629	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.9	-119.5	-169.4	0	0	0	0	0	111.4
115	E	83.7	Confident	88.7	Confident	141 Å²	141	66.5 Å²	66.5	66%	0.659	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-5.7	176.7	-56.7	-159.1	115.1	0	0	113.8	K89 V113	K89-E115 IonicContact NZ-OE1 2.88Å; K89-E115 PolarHBondContact NZ-OE1 3.4Å; V113-E115 PolarHBondContact O-N 3.12Å
116	D	88.6	Confident	88.8	Confident	60 Å²	60	70.3 Å²	70.3	32%	0.321	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	146.7	-176.9	-69	-42.3	0	0	0	112.2	A99 I112 V113 F118 K127	A99-D116 HydrophobicContact CB-CB 4Å; I112-D116 WeakPolarHBondContact CA-O 3.45Å; V113-D116 PolarHBondContact N-O 2.84Å; V113-D116 VanDerWaalsContact N-O 3.09Å; V113-D116 PolarHBondContact O-N 3.47Å; D116-F118 HydrophobicContact CB-CD2 4.49Å; D116-F118 HydrophobicContact CB-CE2 3.5Å; D116-F118 HydrophobicContact CB-CZ 3.58Å; D116-K127 WeakPolarHBondContact OD2-CE 3.27Å; D116-K127 IonicContact OD2-NZ 2.94Å; D116-K127 PolarHBondContact OD2-NZ 2.93Å
117	L	90.6	Very high	89	Confident	13 Å²	13	70.5 Å²	70.5	7%	0.068	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	140.7	176.7	-55.3	176.6	0	0	0	111.2	I73 L86 L96 C98 A99 L105 Y111 I112	I73-L117 HydrophobicContact CD1-CD1 3.86Å; L86-L117 HydrophobicContact CD1-CD1 3.79Å; L86-L117 HydrophobicContact CD1-CD2 3.97Å; L96-L117 HydrophobicContact CD2-CD1 3.88Å; C98-L117 CarbonylContact C-O 3.56Å; C98-L117 VanDerWaalsContact CA-O 3.32Å; C98-L117 WeakPolarHBondContact CA-O 3.27Å; A99-L117 PolarHBondContact N-O 3.49Å; L105-L117 HydrophobicContact CD1-CB 3.44Å; L105-L117 VanDerWaalsContact CD1-CB 3.44Å; L105-L117 HydrophobicContact CD1-CD1 4.33Å; L105-L117 HydrophobicContact CD1-CG 4.48Å; Y111-L117 CarbonylContact O-C 3.56Å; I112-L117 HydrophobicContact CB-CD2 4.27Å; I112-L117 HydrophobicContact CD1-CD2 3.95Å; I112-L117 HydrophobicContact CG1-CD2 3.61Å; I112-L117 HydrophobicContact CG2-CD2 4.07Å
118	F	93	Very high	89.3	Confident	5 Å²	5	71.5 Å²	71.5	2%	0.022	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	142.5	-179.4	-55.3	-88	0	0	0	112.5	A99 H110 Y111 V113 D116 S120 C123 A124 K127	A99-F118 HydrophobicContact CB-CE1 4.1Å; A99-F118 HydrophobicContact CB-CZ 4.39Å; H110-F118 WeakPolarHBondContact CA-O 3.48Å; Y111-F118 PolarHBondContact N-O 3.34Å; Y111-F118 WeakPolarHBondContact O-CD2 3.4Å; Y111-F118 PolarHBondContact O-N 2.94Å; V113-F118 HydrophobicContact CB-CD2 4.27Å; V113-F118 HydrophobicContact CB-CE2 3.78Å; V113-F118 HydrophobicContact CG2-CD2 4.15Å; V113-F118 HydrophobicContact CG2-CE2 4.12Å; D116-F118 HydrophobicContact CB-CD2 4.49Å; D116-F118 HydrophobicContact CB-CE2 3.5Å; D116-F118 HydrophobicContact CB-CZ 3.58Å; F118-S120 VanDerWaalsContact C-N 3.3Å; F118-C123 HydrophobicContact CB-CB 4.28Å; F118-C123 HydrophobicContact CD1-CB 4.07Å; F118-A124 HydrophobicContact CB-CB 4.11Å; F118-A124 VanDerWaalsContact CD1-CA 3.5Å; F118-A124 HydrophobicContact CD1-CB 4.04Å; F118-A124 HydrophobicContact CD2-CB 3.74Å; F118-A124 HydrophobicContact CE1-CB 4.39Å; F118-A124 HydrophobicContact CE2-CB 4.15Å; F118-A124 HydrophobicContact CG-CB 3.68Å; F118-A124 HydrophobicContact CZ-CB 4.43Å; F118-K127 HydrophobicContact CE1-CB 3.62Å; F118-K127 HydrophobicContact CE1-CD 3.55Å; F118-K127 HydrophobicContact CE1-CG 4.12Å; F118-K127 HydrophobicContact CZ-CB 4.15Å; F118-K127 HydrophobicContact CZ-CD 3.69Å; F118-K127 HydrophobicContact CZ-CG 4.34Å
119	C	93.4	Very high	89.6	Confident	47 Å²	47	74.3 Å²	74.3	32%	0.318	37%	0.366	S	S	.	.	S	Bend	trans	-75	-21	176.8	61.9	0	0	0	0	113.3	C98 C101 L105 C123	C98-C119 HydrophobicContact CB-CB 4.2Å; C101-C119 PolarHBondContact SG-SG 2.96Å; L105-C119 HydrophobicContact CD2-CB 3.42Å; L105-C119 VanDerWaalsContact CD2-CB 3.42Å; C119-C123 PolarHBondContact SG-SG 2.82Å
120	S	92.4	Very high	89.8	Confident	31 Å²	31	75.9 Å²	75.9	22%	0.217	37%	0.365	C	S	.	.	S	Bend	trans	-154.5	156.5	-177.9	61	0	0	0	0	110.4	F118 K122 C123 A124	F118-S120 VanDerWaalsContact C-N 3.3Å; S120-K122 PolarHBondContact O-N 3.43Å; S120-C123 PolarHBondContact O-N 3.32Å; S120-C123 VanDerWaalsContact O-N 3.11Å; S120-C123 PolarHBondContact OG-N 3.36Å; S120-C123 PolarHBondContact OG-SG 3.09Å; S120-A124 PolarHBondContact O-N 2.92Å
121	P	91.5	Very high	89.6	Confident	73 Å²	73	79.4 Å²	79.4	47%	0.474	39%	0.385	S	S	.	.	H	α-helix	trans	-60.8	-28.2	173.3	24.7	-34.1	0	0	0	112	A124 Y125	P121-A124 PolarHBondContact O-N 3.32Å; P121-Y125 WeakPolarHBondContact O-CB 3.39Å; P121-Y125 PolarHBondContact O-N 2.99Å
122	K	93.5	Very high	89.3	Confident	167 Å²	167	84 Å²	84	73%	0.726	40%	0.401	S	S	*	.	H	α-helix	trans	-59.8	-48.2	172.8	-67.3	-179.1	179.9	175.1	0	111.3	S120 A124 Y125 E126	S120-K122 PolarHBondContact O-N 3.43Å; K122-A124 VanDerWaalsContact C-N 3.31Å; K122-A124 PolarHBondContact O-N 3.37Å; K122-Y125 PolarHBondContact O-N 3.27Å; K122-E126 WeakPolarHBondContact O-CB 3.38Å; K122-E126 WeakPolarHBondContact O-CG 3.27Å; K122-E126 PolarHBondContact O-N 3.09Å
123	C	94.2	Very high	88.7	Confident	17 Å²	17	84.9 Å²	84.9	12%	0.115	41%	0.414	C	S	.	.	H	α-helix	trans	-63.4	-37.1	177.3	-73.7	0	0	0	0	112.7	L100 F118 C119 S120 K127	L100-C123 HydrophobicContact CB-CB 4.23Å; L100-C123 HydrophobicContact CD2-CB 4.01Å; L100-C123 WeakPolarHBondContact CD2-O 3.4Å; F118-C123 HydrophobicContact CB-CB 4.28Å; F118-C123 HydrophobicContact CD1-CB 4.07Å; C119-C123 PolarHBondContact SG-SG 2.82Å; S120-C123 PolarHBondContact O-N 3.32Å; S120-C123 VanDerWaalsContact O-N 3.11Å; S120-C123 PolarHBondContact OG-N 3.36Å; S120-C123 PolarHBondContact OG-SG 3.09Å; C123-K127 PolarHBondContact O-N 2.77Å
124	A	91.7	Very high	87.9	Confident	3 Å²	3	87.5 Å²	87.5	3%	0.025	43%	0.432	C	S	.	.	H	α-helix	trans	-65.8	-39	174.9	0	0	0	0	0	112.3	V113 F118 S120 P121 K122 R128	V113-A124 HydrophobicContact CG2-CB 3.94Å; F118-A124 HydrophobicContact CB-CB 4.11Å; F118-A124 VanDerWaalsContact CD1-CA 3.5Å; F118-A124 HydrophobicContact CD1-CB 4.04Å; F118-A124 HydrophobicContact CD2-CB 3.74Å; F118-A124 HydrophobicContact CE1-CB 4.39Å; F118-A124 HydrophobicContact CE2-CB 4.15Å; F118-A124 HydrophobicContact CG-CB 3.68Å; F118-A124 HydrophobicContact CZ-CB 4.43Å; S120-A124 PolarHBondContact O-N 2.92Å; P121-A124 PolarHBondContact O-N 3.32Å; K122-A124 VanDerWaalsContact C-N 3.31Å; K122-A124 PolarHBondContact O-N 3.37Å; A124-R128 WeakPolarHBondContact O-CG 3.08Å; A124-R128 PolarHBondContact O-N 3.21Å
125	Y	91.8	Very high	87.2	Confident	141 Å²	141	90.6 Å²	90.6	55%	0.553	44%	0.441	S	S	*	.	H	α-helix	trans	-66.1	-49.1	175.3	-179.4	-96.5	0	0	0	111.9	P121 K122 K127 R128 K129	P121-Y125 WeakPolarHBondContact O-CB 3.39Å; P121-Y125 PolarHBondContact O-N 2.99Å; K122-Y125 PolarHBondContact O-N 3.27Å; Y125-K127 PolarHBondContact O-N 2.96Å; Y125-R128 PolarHBondContact O-N 3.33Å; Y125-K129 PolarHBondContact O-N 3.37Å
126	E	92.5	Very high	86	Confident	91 Å²	91	88 Å²	88	43%	0.425	44%	0.444	S	S	.	.	H	α-helix	trans	-61	-40.5	179.1	-72	-56.2	136.6	0	0	112.4	L100 K122 K129 R130	L100-E126 HydrophobicContact CD2-CB 3.47Å; L100-E126 VanDerWaalsContact CD2-CB 3.47Å; L100-E126 HydrophobicContact CD2-CG 4.41Å; K122-E126 WeakPolarHBondContact O-CB 3.38Å; K122-E126 WeakPolarHBondContact O-CG 3.27Å; K122-E126 PolarHBondContact O-N 3.09Å; E126-K129 PolarHBondContact O-N 3.18Å; E126-R130 PolarHBondContact O-N 3.44Å
127	K	89.6	Confident	84.7	Confident	40 Å²	40	90.4 Å²	90.4	17%	0.174	46%	0.463	C	S	.	.	H	α-helix	trans	-63.1	-46	174.6	-176.7	167.1	-179.6	-69.1	0	111.5	A99 L100 D116 F118 C123 Y125 K129 R130 D131	A99-K127 HydrophobicContact CB-CD 4.02Å; L100-K127 HydrophobicContact CD1-CB 4.21Å; D116-K127 WeakPolarHBondContact OD2-CE 3.27Å; D116-K127 IonicContact OD2-NZ 2.94Å; D116-K127 PolarHBondContact OD2-NZ 2.93Å; F118-K127 HydrophobicContact CE1-CB 3.62Å; F118-K127 HydrophobicContact CE1-CD 3.55Å; F118-K127 HydrophobicContact CE1-CG 4.12Å; F118-K127 HydrophobicContact CZ-CB 4.15Å; F118-K127 HydrophobicContact CZ-CD 3.69Å; F118-K127 HydrophobicContact CZ-CG 4.34Å; C123-K127 PolarHBondContact O-N 2.77Å; Y125-K127 PolarHBondContact O-N 2.96Å; K127-K129 VanDerWaalsContact C-N 3.28Å; K127-K129 PolarHBondContact O-N 3.31Å; K127-R130 WeakPolarHBondContact O-CB 3.49Å; K127-R130 PolarHBondContact O-N 3.22Å; K127-R130 VanDerWaalsContact O-N 3.1Å; K127-D131 WeakPolarHBondContact CG-OD2 3.48Å; K127-D131 IonicContact NZ-OD2 3.51Å; K127-D131 PolarHBondContact NZ-OD2 2.86Å; K127-D131 PolarHBondContact O-N 2.91Å
128	R	87.3	Confident	83.4	Confident	143 Å²	143	95.6 Å²	95.6	54%	0.54	50%	0.497	S	S	.	.	H	α-helix	trans	-59.6	-38.3	175.4	-77.4	-171	-71.6	-161.4	0.3	112.6	A124 Y125 D131 R132	A124-R128 WeakPolarHBondContact O-CG 3.08Å; A124-R128 PolarHBondContact O-N 3.21Å; Y125-R128 PolarHBondContact O-N 3.33Å; R128-D131 PolarHBondContact O-N 3.37Å; R128-R132 WeakPolarHBondContact O-CB 3.45Å; R128-R132 PolarHBondContact O-N 3.22Å
129	K	88.9	Confident	81.9	Confident	126 Å²	126	104.6 Å²	104.6	55%	0.548	54%	0.537	S	S	.	.	H	α-helix	trans	-64.6	-40.4	174.9	-172.8	-179.3	175.9	-174.3	0	111.6	Y125 E126 K127 A133	Y125-K129 PolarHBondContact O-N 3.37Å; E126-K129 PolarHBondContact O-N 3.18Å; K127-K129 VanDerWaalsContact C-N 3.28Å; K127-K129 PolarHBondContact O-N 3.31Å; K129-A133 WeakPolarHBondContact O-CB 3.48Å; K129-A133 PolarHBondContact O-N 3.2Å
130	R	86	Confident	80.4	Confident	189 Å²	189	108 Å²	108	71%	0.713	56%	0.558	S	S	*	*	H	α-helix	trans	-67.8	-41.8	174.8	-175.7	177.7	178.2	174.9	0.2	112.7	E126 K127 R132 A133	E126-R130 PolarHBondContact O-N 3.44Å; K127-R130 WeakPolarHBondContact O-CB 3.49Å; K127-R130 PolarHBondContact O-N 3.22Å; K127-R130 VanDerWaalsContact O-N 3.1Å; R130-R132 VanDerWaalsContact C-N 3.3Å; R130-R132 PolarHBondContact O-N 2.86Å; R130-A133 WeakPolarHBondContact O-CB 3.14Å; R130-A133 PolarHBondContact O-N 3.48Å
131	D	84.3	Confident	78.7	Confident	107 Å²	107	111 Å²	111	57%	0.572	58%	0.584	S	S	*	*	H	α-helix	trans	-68.9	-29.6	178.5	-69.1	-33.9	0	0	0	111.7	K127 R128	K127-D131 WeakPolarHBondContact CG-OD2 3.48Å; K127-D131 IonicContact NZ-OD2 3.51Å; K127-D131 PolarHBondContact NZ-OD2 2.86Å; K127-D131 PolarHBondContact O-N 2.91Å; R128-D131 PolarHBondContact O-N 3.37Å
132	R	82.5	Confident	77	Confident	220 Å²	220	113.7 Å²	113.7	83%	0.83	60%	0.599	S	S	*	*	H	α-helix	trans	-87.7	-17.7	174.9	-168.6	63.7	-166.7	-159.7	6.5	113.5	R128 R130	R128-R132 WeakPolarHBondContact O-CB 3.45Å; R128-R132 PolarHBondContact O-N 3.22Å; R130-R132 VanDerWaalsContact C-N 3.3Å; R130-R132 PolarHBondContact O-N 2.86Å
133	A	76	Confident	75.4	Confident	54 Å²	54	112 Å²	112	45%	0.446	60%	0.603	S	S	.	*	S	Bend	trans	-61.6	133.7	178.1	0	0	0	0	0	108.9	K129 R130	K129-A133 WeakPolarHBondContact O-CB 3.48Å; K129-A133 PolarHBondContact O-N 3.2Å; R130-A133 WeakPolarHBondContact O-CB 3.14Å; R130-A133 PolarHBondContact O-N 3.48Å
134	P	70.3	Confident	73.6	Confident	109 Å²	109	119.7 Å²	119.7	71%	0.708	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-55.1	146	170.3	24.2	-31.6	0	0	0	108.7	A136	P134-A136 PolarHBondContact O-N 3Å
135	P	68.6	Low	72.2	Confident	125 Å²	125	128.2 Å²	128.2	81%	0.812	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-51.9	123	175.6	23.2	-32.8	0	0	0	107.7
136	A	59.5	Low	71	Confident	88 Å²	88	126.4 Å²	126.4	73%	0.727	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-54.2	135.8	178	0	0	0	0	0	107.9	P134	P134-A136 PolarHBondContact O-N 3Å
137	P	60.3	Low	69.5	Low	110 Å²	110	128.3 Å²	128.3	71%	0.714	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-54.2	143.2	174.8	24.6	-33.1	0	0	0	108.2	K139	P137-K139 PolarHBondContact O-N 2.88Å; P137-K139 VanDerWaalsContact O-N 3.12Å
138	P	63.6	Low	68.1	Low	121 Å²	121	135.1 Å²	135.1	79%	0.786	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-51.5	128.3	174.7	23.6	-32.7	0	0	0	107.5	P140	P138-P140 VanDerWaalsContact O-N 3.17Å
139	K	62.7	Low	66.5	Low	195 Å²	195	137.5 Å²	137.5	85%	0.848	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-51.1	128.5	173.8	-65.2	-179	-178.2	-179.3	0	106.3	P137 A141	P137-K139 PolarHBondContact O-N 2.88Å; P137-K139 VanDerWaalsContact O-N 3.12Å; K139-A141 PolarHBondContact O-N 2.93Å
140	P	60.5	Low	64.8	Low	119 Å²	119	136 Å²	136	77%	0.773	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-55.2	124.3	172	22.9	-30.6	0	0	0	106.5	P138 V142	P138-P140 VanDerWaalsContact O-N 3.17Å; P140-V142 PolarHBondContact O-N 2.74Å
141	A	57.7	Low	63.7	Low	92 Å²	92	136.6 Å²	136.6	76%	0.76	77%	0.768	S	S	*	*			trans	-55	109.6	167	0	0	0	0	0	105.4	K139 V143	K139-A141 PolarHBondContact O-N 2.93Å; A141-V143 VanDerWaalsContact C-N 3.28Å; A141-V143 PolarHBondContact O-N 3.36Å
142	V	56.5	Low	62	Low	130 Å²	130	137.7 Å²	137.7	79%	0.788	78%	0.781	S	S	*	*			trans	-55.7	108.7	159	-107.3	0	0	0	0	103.9	P140 E144	P140-V142 PolarHBondContact O-N 2.74Å; V142-E144 PolarHBondContact O-N 2.98Å
143	V	59.7	Low	60.9	Low	132 Å²	132	131.8 Å²	131.8	80%	0.8	78%	0.778	S	S	*	*			trans	-54.8	98	157.1	168.1	0	0	0	0	103.8	A141 K145	A141-V143 VanDerWaalsContact C-N 3.28Å; A141-V143 PolarHBondContact O-N 3.36Å; V143-K145 PolarHBondContact O-N 3.14Å
144	E	56.3	Low	59.9	Low	179 Å²	179	138 Å²	138	84%	0.836	80%	0.798	S	S	*	*			trans	-56.7	114.4	164.7	-98.9	178.7	87.3	0	0	105.7	V142	V142-E144 PolarHBondContact O-N 2.98Å
145	K	62.4	Low	59.1	Low	181 Å²	181	140.4 Å²	140.4	79%	0.787	80%	0.8	S	S	*	*			trans	-54.1	134.1	175.2	-169.5	177.7	179	-173.3	0	107.6	V143	V143-K145 PolarHBondContact O-N 3.14Å
146	P	65.3	Low	58.6	Low	104 Å²	104	144 Å²	144	68%	0.675	81%	0.806	S	S	*	*			trans	-51.2	138.4	178.2	-26.1	33.4	0	0	0	111.2	E148	P146-E148 PolarHBondContact O-N 3.17Å
147	P	60.5	Low	59.1	Low	130 Å²	130	148.4 Å²	148.4	84%	0.844	81%	0.809	S	S	*	*			trans	-68.1	115.8	179.4	26.8	-30.7	0	0	0	109.2
148	E	60.4	Low	58.8	Low	183 Å²	183	147.9 Å²	147.9	86%	0.855	81%	0.805	S	S	*	*			trans	-86.8	121.9	172.7	-162.7	172.2	102.2	0	0	108.4	P146	P146-E148 PolarHBondContact O-N 3.17Å
149	E	54.4	Low	58.3	Low	194 Å²	194	146.2 Å²	146.2	91%	0.907	80%	0.802	S	S	*	*			trans	-52.1	127.6	179.8	-81.9	161.7	61.1	0	0	113.5
150	A	54.4	Low	58	Low	93 Å²	93	146.3 Å²	146.3	77%	0.769	81%	0.805	S	S	*	*			trans	-144.4	94.8	160.6	0	0	0	0	0	111.1
151	K	61.8	Low	57.5	Low	203 Å²	203	144.2 Å²	144.2	88%	0.883	81%	0.805	S	S	*	*			trans	49.9	130.9	144.6	-72.1	179.3	172.3	178.1	0	121.6
152	P	49.5	Very low	57.2	Low	130 Å²	130	148.9 Å²	148.9	84%	0.844	81%	0.811	S	S	*	*			trans	-89	148.4	168.4	36	-29.8	0	0	0	112.4
153	A	57.9	Low	56.9	Low	95 Å²	95	147.1 Å²	147.1	79%	0.785	81%	0.81	S	S	*	*			trans	-150.9	105.6	161	0	0	0	0	0	106.6
154	E	55.4	Low	56.2	Low	185 Å²	185	145.8 Å²	145.8	86%	0.864	81%	0.813	S	S	*	*				73.1	88.7	89.7	-157.8	170.3	102	0	0	110.5
155	E	54.6	Low	56.2	Low	160 Å²	160	141.7 Å²	141.7	75%	0.748	81%	0.81	S	S	*	*				84.5	110.4	83.1	-174	153.2	95.8	0	0	113.3
156	Q	57.8	Low	56.4	Low	200 Å²	200	138.6 Å²	138.6	94%	0.935	81%	0.809	S	S	*	*			trans	-149.5	79.7	153.9	-93.9	179.8	7.2	0	0	110.8
157	K	69	Low	56.2	Low	180 Å²	180	139.2 Å²	139.2	78%	0.783	81%	0.813	S	S	*	*				10.6	171.9	123.2	-121.4	-154.2	138	-175.2	0	121.5
158	P	54.8	Low	55.7	Low	99 Å²	99	137.9 Å²	137.9	64%	0.643	81%	0.812	S	S	*	*				-137.1	-168.2	-108	46	-25.4	0	0	0	113.9
159	A	51.9	Low	55.3	Low	86 Å²	86	133.5 Å²	133.5	71%	0.711	81%	0.808	S	S	*	*			trans	-177.2	112.1	145.9	0	0	0	0	0	108.7
160	Q	57.4	Low	55.5	Low	197 Å²	197	130.5 Å²	130.5	92%	0.921	81%	0.805	S	S	*	*				59.1	133.7	84.7	-65.8	-176.3	-41.5	0	0	113.5
161	G	49.7	Very low	55.3	Low	75 Å²	75	135.5 Å²	135.5	77%	0.773	81%	0.813	S	S	*	*			cis	-159.2	-162.2	1.7	0	0	0	0	0	106.8
162	E	52	Low	54.6	Low	190 Å²	190	129.8 Å²	129.8	89%	0.888	81%	0.811	S	S	*	*			cis	-171.3	149.4	4.1	-165.9	161.2	95	0	0	108.3
163	A	48.8	Very low	54.4	Low	93 Å²	93	127.2 Å²	127.2	77%	0.769	81%	0.808	S	S	*	*			trans	35.4	131.4	152.8	0	0	0	0	0	123.9
164	A	45.2	Very low	53.8	Low	104 Å²	104	127.8 Å²	127.8	86%	0.86	81%	0.813	S	S	*	*				-178.6	140.5	99.6	0	0	0	0	0	111.4
165	A	56.3	Low	53.2	Low	94 Å²	94	123.9 Å²	123.9	78%	0.777	81%	0.812	S	S	*	*			trans	-111.2	-162.5	-173.7	0	0	0	0	0	111.1
166	P	68	Low	52.9	Low	116 Å²	116	120.7 Å²	120.7	75%	0.753	81%	0.813	S	S	*	*				-115.2	-133.6	-118.8	37.1	-13.4	0	0	0	109.7
167	P	61	Low	53.4	Low	117 Å²	117	116.9 Å²	116.9	76%	0.76	81%	0.806	S	S	*	*			cis	-133.1	-174.5	-27.1	34.1	-12.9	0	0	0	113.2
168	A	48.6	Very low	52.4	Low	101 Å²	101	114 Å²	114	84%	0.835	81%	0.806	S	S	*	*			trans	158.1	138.3	135.7	0	0	0	0	0	113.7
169	A	52.9	Low	52	Low	92 Å²	92	114 Å²	114	76%	0.76	81%	0.814	S	S	*	*			trans	-77.4	173.1	169.8	0	0	0	0	0	111.6
170	P	58.1	Low	52.1	Low	130 Å²	130	119.1 Å²	119.1	84%	0.844	82%	0.823	S	S	*	*				-153.8	-176.9	81.7	38.1	-16.2	0	0	0	116.4
171	E	50.3	Low	51.6	Low	199 Å²	199	119 Å²	119	93%	0.93	82%	0.822	S	S	*	*			trans	-77.4	162.3	-177.2	-53.8	177.9	88.1	0	0	114.8
172	G	47.9	Very low	51.3	Low	82 Å²	82	119.3 Å²	119.3	85%	0.845	83%	0.826	S	S	*	*			trans	125.9	123.1	146.5	0	0	0	0	0	118.5
173	G	45.6	Very low	51.1	Low	77 Å²	77	114.8 Å²	114.8	79%	0.794	82%	0.821	S	S	*	*			trans	96.2	102.5	131	0	0	0	0	0	119.9
174	A	43.6	Very low	51	Low	107 Å²	107	116.9 Å²	116.9	88%	0.884	83%	0.826	S	S	*	*			trans	15.8	126.6	139.8	0	0	0	0	0	120.6
175	A	44.1	Very low	51.3	Low	103 Å²	103	116.6 Å²	116.6	85%	0.851	82%	0.824	S	S	*	*				177.6	141.3	127.3	0	0	0	0	0	110.9
176	A	48.4	Very low	51.4	Low	92 Å²	92	118.2 Å²	118.2	76%	0.76	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-66.5	151.3	173.2	0	0	0	0	0	112.6
177	P	67.5	Low	51.2	Low	120 Å²	120	118.6 Å²	118.6	78%	0.779	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-89.7	135.9	159.7	32.4	-29.5	0	0	0	111.4
178	P	49.1	Very low	51	Low	121 Å²	121	117 Å²	117	79%	0.786	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-84.8	167.8	162.9	35	-30.2	0	0	0	111.2
179	A	46.3	Very low	51.7	Low	98 Å²	98	118.2 Å²	118.2	81%	0.81	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-49.5	134.8	174.5	0	0	0	0	0	113.3
180	Q	53.6	Low	52.1	Low	193 Å²	193	119.8 Å²	119.8	90%	0.902	82%	0.823	S	S	*	*			trans	-137.6	130.7	152.5	-80.3	-165	-7.1	0	0	110.6
181	E	46	Very low	52.5	Low	195 Å²	195	119.6 Å²	119.6	91%	0.911	82%	0.823	S	S	*	*			trans	-74	154.6	173.6	-61	170.1	79.9	0	0	110.7
182	G	43.3	Very low	52.3	Low	82 Å²	82	119 Å²	119	85%	0.845	82%	0.82	S	S	*	*			trans	90.1	88.6	149.6	0	0	0	0	0	117.4
183	A	48.1	Very low	52.5	Low	95 Å²	95	119.2 Å²	119.2	79%	0.785	81%	0.813	S	S	*	*			trans	-153.8	123	140.8	0	0	0	0	0	109.3	A185	A183-A185 PolarHBondContact O-N 2.8Å
184	P	47.6	Very low	52.7	Low	136 Å²	136	120.1 Å²	120.1	88%	0.883	81%	0.813	S	S	*	*			trans	-81.9	113.1	177.7	31.2	-30.2	0	0	0	109.9
185	A	51.9	Low	53.5	Low	98 Å²	98	120.1 Å²	120.1	81%	0.81	81%	0.807	S	S	*	*			trans	-93.7	111.4	163.4	0	0	0	0	0	108.4	A183	A183-A185 PolarHBondContact O-N 2.8Å
186	T	57.2	Low	54.7	Low	129 Å²	129	120.6 Å²	120.6	79%	0.791	80%	0.801	S	S	*	*			trans	-41.3	134.6	175.5	44.9	0	0	0	0	113.8
187	P	64.5	Low	55.7	Low	123 Å²	123	121.6 Å²	121.6	80%	0.799	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-71.4	132.5	171	29	-32	0	0	0	110.6
188	A	56.7	Low	55.4	Low	85 Å²	85	122 Å²	122	70%	0.702	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-58.3	146.8	166	0	0	0	0	0	110.5	T190	A188-T190 PolarHBondContact O-N 2.85Å
189	P	62.7	Low	55.6	Low	126 Å²	126	120.7 Å²	120.7	82%	0.818	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-64.9	118.9	179.4	26.9	-33.7	0	0	0	110.4
190	T	62.3	Low	56	Low	124 Å²	124	120.4 Å²	120.4	76%	0.761	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-60.5	135	163	38.5	0	0	0	0	109.6	A188 E192	A188-T190 PolarHBondContact O-N 2.85Å; T190-E192 PolarHBondContact O-N 3.32Å; T190-E192 VanDerWaalsContact O-N 3.15Å
191	P	66.1	Low	55.9	Low	127 Å²	127	117.5 Å²	117.5	83%	0.825	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-60.8	121.8	166	25.6	-31.5	0	0	0	108.7	A193	P191-A193 PolarHBondContact O-N 3.08Å
192	E	47	Very low	56.8	Low	186 Å²	186	114.1 Å²	114.1	87%	0.869	79%	0.79	S	S	*	*			trans	-43.8	122.1	176.9	-152.4	167.9	94.7	0	0	110.6	T190 A194	T190-E192 PolarHBondContact O-N 3.32Å; T190-E192 VanDerWaalsContact O-N 3.15Å; E192-A194 PolarHBondContact O-N 3.19Å
193	A	51.9	Low	57.2	Low	86 Å²	86	119.5 Å²	119.5	71%	0.711	79%	0.793	S	S	*	*			trans	-60.8	105.8	166.2	0	0	0	0	0	107.3	P191 S195	P191-A193 PolarHBondContact O-N 3.08Å; A193-S195 VanDerWaalsContact C-N 3.32Å; A193-S195 PolarHBondContact O-N 3.11Å
194	A	49.9	Very low	57.2	Low	96 Å²	96	118.8 Å²	118.8	79%	0.793	80%	0.796	S	S	*	*			trans	-54.1	102.5	165.7	0	0	0	0	0	107.6	E192	E192-A194 PolarHBondContact O-N 3.19Å
195	S	59.5	Low	57.5	Low	107 Å²	107	116.6 Å²	116.6	75%	0.748	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-56.4	123.7	170.3	-65.4	0	0	0	0	107.7	A193	A193-S195 VanDerWaalsContact C-N 3.32Å; A193-S195 PolarHBondContact O-N 3.11Å
196	P	69.2	Low	58.2	Low	114 Å²	114	117.6 Å²	117.6	74%	0.74	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-63.3	137.8	165.7	27.1	-31.6	0	0	0	108.1
197	P	69.2	Low	58.4	Low	112 Å²	112	117.3 Å²	117.3	73%	0.727	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-62.3	155.2	175.3	27.7	-34.1	0	0	0	110.2	A199	P197-A199 PolarHBondContact O-N 3.2Å
198	P	61.6	Low	58.3	Low	128 Å²	128	115.7 Å²	115.7	83%	0.831	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-60.6	124.8	173	26.7	-32.6	0	0	0	108.8	A200	P198-A200 PolarHBondContact O-N 3.02Å
199	A	53	Low	58.5	Low	95 Å²	95	117.6 Å²	117.6	79%	0.785	79%	0.79	S	S	*	*			trans	-59.8	111.7	176.8	0	0	0	0	0	109.5	P197 T201	P197-A199 PolarHBondContact O-N 3.2Å; A199-T201 PolarHBondContact O-N 2.89Å
200	A	54.7	Low	58.6	Low	92 Å²	92	115.7 Å²	115.7	76%	0.76	79%	0.785	S	S	*	*			trans	-59.4	122.7	159.3	0	0	0	0	0	107.7	P198 P202	P198-A200 PolarHBondContact O-N 3.02Å; A200-P202 WeakPolarHBondContact O-CD 3.23Å
201	T	52.2	Low	58.7	Low	132 Å²	132	115.9 Å²	115.9	81%	0.81	79%	0.788	S	S	*	*			trans	-74.9	115.5	173	42	0	0	0	0	109.8	A199	A199-T201 PolarHBondContact O-N 2.89Å
202	P	63.8	Low	58.8	Low	123 Å²	123	115.7 Å²	115.7	80%	0.799	79%	0.785	S	S	*	*			trans	-81	119.9	155.1	30.4	-30	0	0	0	108.8	A200	A200-P202 WeakPolarHBondContact O-CD 3.23Å
203	E	51.8	Low	59.6	Low	195 Å²	195	112.8 Å²	112.8	91%	0.911	78%	0.782	S	S	*	*			trans	-51.1	142.4	162.3	-76.7	171.3	68.5	0	0	110.9
204	G	47.5	Very low	59.8	Low	81 Å²	81	118.4 Å²	118.4	84%	0.835	79%	0.793	S	S	*	*			trans	87.6	71.8	156.4	0	0	0	0	0	116.7
205	A	55.9	Low	59.9	Low	90 Å²	90	117.1 Å²	117.1	74%	0.744	79%	0.79	S	S	*	*			trans	-138.6	125.1	152.2	0	0	0	0	0	109.1
206	P	65.8	Low	60	Low	118 Å²	118	116.3 Å²	116.3	77%	0.766	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-66.1	151.6	-177.6	28	-34.1	0	0	0	111.1	A208	P206-A208 PolarHBondContact O-N 3.29Å
207	P	62.1	Low	59.8	Low	124 Å²	124	116.4 Å²	116.4	81%	0.805	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-63.6	128.2	179.3	27	-33.4	0	0	0	110.2
208	A	60.4	Low	59.5	Low	89 Å²	89	117.2 Å²	117.2	74%	0.736	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-60.1	142.4	167.4	0	0	0	0	0	109.8	P206	P206-A208 PolarHBondContact O-N 3.29Å
209	P	61.7	Low	59.5	Low	125 Å²	125	117.2 Å²	117.2	81%	0.812	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-62.5	143.7	-178.5	26.2	-33.9	0	0	0	111.4
210	A	65.3	Low	60.1	Low	86 Å²	86	118.5 Å²	118.5	71%	0.711	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-57	144.9	177.8	0	0	0	0	0	112	T212	A210-T212 PolarHBondContact O-N 3.42Å
211	P	64.1	Low	60.5	Low	127 Å²	127	118.5 Å²	118.5	83%	0.825	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-66	119.1	172.8	27.8	-32.5	0	0	0	109.4
212	T	67.3	Low	60.8	Low	124 Å²	124	118.1 Å²	118.1	76%	0.761	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-63.4	145.7	168.8	40.8	0	0	0	0	110	A210 E214	A210-T212 PolarHBondContact O-N 3.42Å; T212-E214 PolarHBondContact O-N 3.44Å
213	P	64.3	Low	60.8	Low	124 Å²	124	116.4 Å²	116.4	81%	0.805	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-63.9	125.3	171.1	26.4	-31.7	0	0	0	109.2	G215	P213-G215 PolarHBondContact O-N 2.8Å
214	E	55.5	Low	61	Low	205 Å²	205	113.7 Å²	113.7	96%	0.958	79%	0.788	S	S	*	*			trans	-53.6	98.4	173	-79.3	174.5	78.8	0	0	110.2	T212	T212-E214 PolarHBondContact O-N 3.44Å
215	G	52.9	Low	61.6	Low	69 Å²	69	113.6 Å²	113.6	71%	0.711	79%	0.787	S	S	*	*			trans	-85.1	125	163.2	0	0	0	0	0	109.3	P213	P213-G215 PolarHBondContact O-N 2.8Å
216	A	61.2	Low	61.4	Low	90 Å²	90	118.1 Å²	118.1	74%	0.744	79%	0.793	S	S	*	*			trans	44.1	128.9	160.3	0	0	0	0	0	119.2
217	P	64.8	Low	61.2	Low	116 Å²	116	118.1 Å²	118.1	75%	0.753	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-60.1	142.5	172.6	28.1	-34.4	0	0	0	110.6	T219	P217-T219 PolarHBondContact O-N 3.09Å
218	P	62.8	Low	61.1	Low	128 Å²	128	116.7 Å²	116.7	83%	0.831	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-62.1	129.3	172.6	26.5	-32.7	0	0	0	109.2
219	T	62.8	Low	61.2	Low	129 Å²	129	118 Å²	118	79%	0.791	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-56	142.4	167.8	30.5	0	0	0	0	109.9	P217 A221	P217-T219 PolarHBondContact O-N 3.09Å; T219-A221 PolarHBondContact O-N 2.79Å
220	P	66.1	Low	61.1	Low	122 Å²	122	117.1 Å²	117.1	79%	0.792	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-62.5	132.1	179.1	26.1	-33	0	0	0	110.1
221	A	62.5	Low	60.9	Low	92 Å²	92	122.2 Å²	122.2	76%	0.76	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-58.6	136.4	172.4	0	0	0	0	0	110.3	T219	T219-A221 PolarHBondContact O-N 2.79Å
222	P	58.2	Low	61.1	Low	123 Å²	123	125.2 Å²	125.2	80%	0.799	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-68.5	141.2	175.3	27.9	-32.6	0	0	0	110.7
223	A	63.4	Low	61.3	Low	88 Å²	88	124.5 Å²	124.5	73%	0.727	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-62.5	145.8	175.3	0	0	0	0	0	111.1	G225	A223-G225 PolarHBondContact O-N 3.39Å
224	P	57.2	Low	61.3	Low	137 Å²	137	124.7 Å²	124.7	89%	0.89	80%	0.804	S	S	*	*	S	Bend	trans	-75.7	117.8	174.2	30.2	-29.8	0	0	0	109
225	G	58.5	Low	61.6	Low	79 Å²	79	124 Å²	124	81%	0.814	80%	0.801	S	S	*	*			trans	144	22.8	167.2	0	0	0	0	0	118.7	A223	A223-G225 PolarHBondContact O-N 3.39Å
226	E	52.2	Low	61.6	Low	185 Å²	185	124.6 Å²	124.6	86%	0.864	81%	0.807	S	S	*	*			trans	-120.3	128.7	174.6	-141.9	165.5	98.7	0	0	110.4	A228	E226-A228 PolarHBondContact O-N 3.44Å
227	P	61.9	Low	61.5	Low	118 Å²	118	124 Å²	124	77%	0.766	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-68.2	128.9	-177.7	27.1	-32.9	0	0	0	110.6
228	A	59.5	Low	61.3	Low	94 Å²	94	123.3 Å²	123.3	78%	0.777	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-58.9	131.6	-179.8	0	0	0	0	0	111.8	E226	E226-A228 PolarHBondContact O-N 3.44Å
229	P	62	Low	61.5	Low	117 Å²	117	126.2 Å²	126.2	76%	0.76	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-70.8	134.5	167.3	28.7	-31.2	0	0	0	109.8	E231	P229-E231 PolarHBondContact O-N 2.79Å; P229-E231 VanDerWaalsContact O-N 3.11Å
230	A	61	Low	62	Low	106 Å²	106	125.3 Å²	125.3	88%	0.876	81%	0.813	S	S	*	*			trans	-59.1	111.1	178.2	0	0	0	0	0	111.2	K232	A230-K232 PolarHBondContact O-N 3.46Å
231	E	59.7	Low	62.4	Low	194 Å²	194	124.9 Å²	124.9	91%	0.907	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-70.2	120.5	168.9	-88.3	-173.9	84.1	0	0	109.9	P229	P229-E231 PolarHBondContact O-N 2.79Å; P229-E231 VanDerWaalsContact O-N 3.11Å
232	K	69.9	Low	62.6	Low	189 Å²	189	126.8 Å²	126.8	82%	0.822	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-62.2	139.4	168.2	-102.9	-176.5	172	-164	0	109.6	A230	A230-K232 PolarHBondContact O-N 3.46Å
233	P	70.8	Confident	63	Low	110 Å²	110	125.4 Å²	125.4	71%	0.714	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-66.4	145.7	174.3	28.1	-32.5	0	0	0	110.7	E235	P233-E235 PolarHBondContact O-N 3.36Å
234	P	64.3	Low	62.9	Low	127 Å²	127	134 Å²	134	83%	0.825	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-70.1	122.9	175.8	27.9	-32.2	0	0	0	110.2	G236	P234-G236 PolarHBondContact O-N 3.32Å
235	E	62.1	Low	63.2	Low	190 Å²	190	133.9 Å²	133.9	89%	0.888	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-64.6	120.7	169.5	-74.9	-178.9	79	0	0	109.4	P233 G237	P233-E235 PolarHBondContact O-N 3.36Å; E235-G237 PolarHBondContact O-N 3.48Å
236	G	53.4	Low	63.4	Low	82 Å²	82	136.8 Å²	136.8	85%	0.845	84%	0.837	S	S	*	*			trans	-66.3	112.5	177.9	0	0	0	0	0	111.4	P234 A238	P234-G236 PolarHBondContact O-N 3.32Å; G236-A238 PolarHBondContact O-N 3.25Å
237	G	59.3	Low	64	Low	78 Å²	78	134.1 Å²	134.1	80%	0.804	84%	0.836	S	S	*	*			trans	-87.5	95.4	163	0	0	0	0	0	109.7	E235 Q239	E235-G237 PolarHBondContact O-N 3.48Å; G237-Q239 PolarHBondContact O-N 3.32Å
238	A	59.4	Low	64.2	Low	102 Å²	102	135.1 Å²	135.1	84%	0.843	84%	0.84	S	S	*	*			trans	-67.2	114.6	167	0	0	0	0	0	109.2	G236	G236-A238 PolarHBondContact O-N 3.25Å
239	Q	67.4	Low	64.4	Low	188 Å²	188	137.6 Å²	137.6	88%	0.879	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-89.2	130.1	163	-107.4	-177.6	-2.7	0	0	108.9	G237	G237-Q239 PolarHBondContact O-N 3.32Å
240	P	72.9	Confident	64.6	Low	110 Å²	110	139 Å²	139	71%	0.714	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-72.7	152.5	176	30.8	-33.3	0	0	0	110.8
241	P	74.2	Confident	64.9	Low	114 Å²	114	141.4 Å²	141.4	74%	0.74	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-70.4	151.7	177.6	30.5	-34.4	0	0	0	111	A243	P241-A243 PolarHBondContact O-N 3.31Å
242	P	67.7	Low	65.3	Low	132 Å²	132	137.3 Å²	137.3	86%	0.857	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-68.1	123.7	173.9	28.8	-32.2	0	0	0	109.5
243	A	67.2	Low	64.9	Low	93 Å²	93	133 Å²	133	77%	0.769	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-86.5	119.4	169.6	0	0	0	0	0	109.4	P241	P241-A243 PolarHBondContact O-N 3.31Å
244	Q	60	Low	64.3	Low	270 Å²	270	135.1 Å²	135.1	100%	1.262	86%	0.857	S	S	*	*			trans	53.9	0	153.1	-56.6	-159.1	-12.9	0	0	120.2

Retrieved 244 of 244 residues in 256 ms (Link to these results)

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