A0A096M2R7_POEFO Loading...

Transmembrane p24 trafficking protein 2

AlphaFold DB , UniProt , Accession A0A096M2R7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 201 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	50.8	Low	67.3	Low	236 Å²	236	119.7 Å²	119.7	100%	1.163	64%	0.643	S	S	*	*				0	96	0	-81.2	173.7	177.1	0	0	106.4	T3	M1-T3 PolarHBondContact O-N 2.98Å
2	F	52.3	Low	67.2	Low	181 Å²	181	115.1 Å²	115.1	79%	0.794	63%	0.634	S	S	*	*			trans	-71.5	124.8	173.3	-69.8	-77	0	0	0	107.6	E6	F2-E6 WeakPolarHBondContact CA-OE2 3.32Å
3	T	70.8	Confident	67.2	Low	80 Å²	80	113.8 Å²	113.8	49%	0.491	63%	0.631	S	S	.	*			trans	-71.5	149	-178.1	59.2	0	0	0	0	109.2	M1 S5 E6 L7	M1-T3 PolarHBondContact O-N 2.98Å; T3-S5 PolarHBondContact O-N 3.17Å; T3-E6 PolarHBondContact N-OE2 3.2Å; T3-E6 WeakPolarHBondContact O-CB 3.47Å; T3-E6 PolarHBondContact O-N 3.34Å; T3-E6 WeakPolarHBondContact OG1-CG 3.3Å; T3-L7 PolarHBondContact O-N 3.15Å
4	V	71.4	Confident	66.8	Low	121 Å²	121	114.6 Å²	114.6	73%	0.733	63%	0.632	S	S	*	*	H	α-helix	trans	-52.7	-31.3	177.1	177.2	0	0	0	0	111.1	L7 V8	V4-L7 PolarHBondContact O-N 3.4Å; V4-V8 HydrophobicContact CG1-CG2 4.39Å; V4-V8 VanDerWaalsContact O-CG2 3.24Å; V4-V8 WeakPolarHBondContact O-CG2 3.48Å; V4-V8 PolarHBondContact O-N 3.26Å
5	S	65.7	Low	66.2	Low	82 Å²	82	114.3 Å²	114.3	57%	0.573	64%	0.64	S	S	*	*	H	α-helix	trans	-59.8	-44.2	172.2	-171.8	0	0	0	0	113.3	T3 L7 V8 V9	T3-S5 PolarHBondContact O-N 3.17Å; S5-L7 VanDerWaalsContact C-N 3.35Å; S5-V8 PolarHBondContact O-N 2.95Å; S5-V9 VanDerWaalsContact O-CG2 3.27Å; S5-V9 WeakPolarHBondContact O-CG2 3.48Å; S5-V9 PolarHBondContact O-N 2.04Å
6	E	69.8	Low	65.6	Low	102 Å²	102	112 Å²	112	48%	0.477	64%	0.64	S	S	.	*	H	α-helix	trans	-68.1	-35.8	178.9	-72.2	173.8	139.4	0	0	111.7	F2 T3 L10	F2-E6 WeakPolarHBondContact CA-OE2 3.32Å; T3-E6 PolarHBondContact N-OE2 3.2Å; T3-E6 WeakPolarHBondContact O-CB 3.47Å; T3-E6 PolarHBondContact O-N 3.34Å; T3-E6 WeakPolarHBondContact OG1-CG 3.3Å; E6-L10 WeakPolarHBondContact O-CB 3.4Å; E6-L10 PolarHBondContact O-N 2.99Å
7	L	70.8	Confident	64.8	Low	109 Å²	109	113 Å²	113	57%	0.571	65%	0.649	S	S	*	*	H	α-helix	trans	-68.3	-39	176.5	-152.3	93.4	0	0	0	111.8	T3 V4 S5 L10 L11	T3-L7 PolarHBondContact O-N 3.15Å; V4-L7 PolarHBondContact O-N 3.4Å; S5-L7 VanDerWaalsContact C-N 3.35Å; L7-L10 PolarHBondContact O-N 3.04Å; L7-L11 WeakPolarHBondContact O-CB 3.09Å; L7-L11 PolarHBondContact O-N 3.44Å
8	V	76.1	Confident	64.3	Low	93 Å²	93	111.6 Å²	111.6	56%	0.564	65%	0.653	S	S	*	*	H	α-helix	trans	-66.9	-41	176.7	170.2	0	0	0	0	111.1	V4 S5 L11 A12	V4-V8 HydrophobicContact CG1-CG2 4.39Å; V4-V8 VanDerWaalsContact O-CG2 3.24Å; V4-V8 WeakPolarHBondContact O-CG2 3.48Å; V4-V8 PolarHBondContact O-N 3.26Å; S5-V8 PolarHBondContact O-N 2.95Å; V8-L11 PolarHBondContact O-N 2.65Å; V8-A12 WeakPolarHBondContact O-CB 3.33Å; V8-A12 PolarHBondContact O-N 2.88Å
9	V	75	Confident	63.8	Low	87 Å²	87	111.9 Å²	111.9	53%	0.527	66%	0.662	S	S	.	*	H	α-helix	trans	-65.7	-42.6	175.9	172.3	0	0	0	0	110.9	S5 L11 A12 V13	S5-V9 VanDerWaalsContact O-CG2 3.27Å; S5-V9 WeakPolarHBondContact O-CG2 3.48Å; S5-V9 PolarHBondContact O-N 2.04Å; V9-L11 PolarHBondContact O-N 3.47Å; V9-A12 PolarHBondContact O-N 2.87Å; V9-V13 VanDerWaalsContact O-CG2 3.27Å; V9-V13 WeakPolarHBondContact O-CG2 3.41Å; V9-V13 PolarHBondContact O-N 2.64Å
10	L	71.4	Confident	63.7	Low	111 Å²	111	107.8 Å²	107.8	58%	0.581	64%	0.644	S	S	*	*	H	α-helix	trans	-63.4	-39.9	177	-164.2	77.7	0	0	0	112.2	E6 L7 V13 L14	E6-L10 WeakPolarHBondContact O-CB 3.4Å; E6-L10 PolarHBondContact O-N 2.99Å; L7-L10 PolarHBondContact O-N 3.04Å; L10-V13 PolarHBondContact O-N 2.91Å; L10-L14 PolarHBondContact O-N 2.83Å
11	L	66.1	Low	64.2	Low	115 Å²	115	110.5 Å²	110.5	60%	0.602	64%	0.644	S	S	*	*	H	α-helix	trans	-66.1	-39.3	176	-126.6	96.9	0	0	0	112.2	L7 V8 V9 V13 L14 C15	L7-L11 WeakPolarHBondContact O-CB 3.09Å; L7-L11 PolarHBondContact O-N 3.44Å; V8-L11 PolarHBondContact O-N 2.65Å; V9-L11 PolarHBondContact O-N 3.47Å; L11-V13 VanDerWaalsContact C-N 3.34Å; L11-L14 PolarHBondContact O-N 3.32Å; L11-C15 PolarHBondContact O-N 3.37Å
12	A	66.2	Low	65.9	Low	64 Å²	64	105 Å²	105	53%	0.529	61%	0.614	S	S	.	*	H	α-helix	trans	-66.4	-36.2	177.9	0	0	0	0	0	112.2	V8 V9 C15	V8-A12 WeakPolarHBondContact O-CB 3.33Å; V8-A12 PolarHBondContact O-N 2.88Å; V9-A12 PolarHBondContact O-N 2.87Å; A12-C15 PolarHBondContact O-N 3.17Å
13	V	67	Low	67.8	Low	98 Å²	98	97.3 Å²	97.3	59%	0.594	58%	0.581	S	S	*	*	H	α-helix	trans	-69	-34.8	177.5	172.3	0	0	0	0	111.9	V9 L10 L11 C15 A16	V9-V13 VanDerWaalsContact O-CG2 3.27Å; V9-V13 WeakPolarHBondContact O-CG2 3.41Å; V9-V13 PolarHBondContact O-N 2.64Å; L10-V13 PolarHBondContact O-N 2.91Å; L11-V13 VanDerWaalsContact C-N 3.34Å; V13-C15 VanDerWaalsContact C-N 3.34Å; V13-C15 PolarHBondContact O-N 2.77Å; V13-A16 PolarHBondContact O-N 3.33Å
14	L	61.7	Low	68.8	Low	125 Å²	125	97.1 Å²	97.1	65%	0.654	58%	0.584	S	S	*	*	H	α-helix	trans	-72.2	-22.4	178.7	-78.2	158.8	0	0	0	113.8	L10 L11 A16	L10-L14 PolarHBondContact O-N 2.83Å; L11-L14 PolarHBondContact O-N 3.32Å; L14-A16 VanDerWaalsContact C-N 3.32Å
15	C	57.5	Low	69.9	Low	111 Å²	111	91.4 Å²	91.4	75%	0.75	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-9.9	175.4	-79.8	0	0	0	0	114	L11 A12 V13 T17	L11-C15 PolarHBondContact O-N 3.37Å; A12-C15 PolarHBondContact O-N 3.17Å; V13-C15 VanDerWaalsContact C-N 3.34Å; V13-C15 PolarHBondContact O-N 2.77Å; C15-T17 PolarHBondContact O-N 3.25Å
16	A	56.3	Low	71.1	Confident	77 Å²	77	92.3 Å²	92.3	64%	0.636	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-0.6	-169.7	0	0	0	0	0	114.9	V13 L14 A18	V13-A16 PolarHBondContact O-N 3.33Å; L14-A16 VanDerWaalsContact C-N 3.32Å; A16-A18 PolarHBondContact O-N 2.84Å
17	T	51.9	Low	72	Confident	129 Å²	129	89.1 Å²	89.1	79%	0.791	54%	0.538	S	S	*	.			trans	-103.1	62.4	-175.1	64.6	0	0	0	0	112.1	C15	C15-T17 PolarHBondContact O-N 3.25Å
18	A	55.8	Low	72.8	Confident	88 Å²	88	90 Å²	90	73%	0.727	54%	0.539	S	S	*	.			trans	-123.6	103.4	160.2	0	0	0	0	0	107.7	A16 G20	A16-A18 PolarHBondContact O-N 2.84Å; A18-G20 PolarHBondContact O-N 2.94Å
19	S	54.8	Low	73.5	Confident	118 Å²	118	86.9 Å²	86.9	83%	0.825	52%	0.524	S	S	*	.			trans	-85	96.1	175.8	153.8	0	0	0	0	108
20	G	62	Low	74.4	Confident	28 Å²	28	86.8 Å²	86.8	29%	0.289	52%	0.517	S	S	.	.			trans	-104.4	143.2	164.5	0	0	0	0	0	109.6	A18 F22	A18-G20 PolarHBondContact O-N 2.94Å; G20-F22 WeakPolarHBondContact O-CD2 3.41Å; G20-F22 WeakPolarHBondContact O-CE2 3.28Å; G20-F22 PolarHBondContact O-N 2.9Å
21	Y	74.3	Confident	75.5	Confident	166 Å²	166	85.5 Å²	85.5	65%	0.651	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.2	118.6	166.9	-70.1	-81.4	0	0	0	108.1	M107 F108	Y21-M107 WeakPolarHBondContact O-CA 3.35Å; Y21-F108 PolarHBondContact O-N 3.24Å
22	F	87.9	Confident	76.9	Confident	121 Å²	121	81.4 Å²	81.4	53%	0.531	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	133.6	173.4	-62	-88	0	0	0	108.8	G20 A50 I105 V106 M107	G20-F22 WeakPolarHBondContact O-CD2 3.41Å; G20-F22 WeakPolarHBondContact O-CE2 3.28Å; G20-F22 PolarHBondContact O-N 2.9Å; F22-A50 HydrophobicContact CE1-CB 4.49Å; F22-I105 HydrophobicContact CB-CG2 4.24Å; F22-I105 HydrophobicContact CD1-CG2 4Å; F22-V106 WeakPolarHBondContact CA-O 3.26Å; F22-M107 HydrophobicContact CD1-CB 3.83Å; F22-M107 HydrophobicContact CD1-CG 4.22Å; F22-M107 HydrophobicContact CE1-CB 3.66Å; F22-M107 HydrophobicContact CE1-CG 3.81Å; F22-M107 HydrophobicContact CE1-SD 3.81Å; F22-M107 HydrophobicContact CZ-CB 4.45Å; F22-M107 HydrophobicContact CZ-CG 4.11Å; F22-M107 HydrophobicContact CZ-SD 3.74Å
23	V	92.1	Very high	78.2	Confident	18 Å²	18	81.2 Å²	81.2	11%	0.109	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	134.1	171.1	60.1	0	0	0	0	109.1	I25 E31 F33 I105 V106 F108	V23-I25 HydrophobicContact CG1-CD1 3.82Å; V23-I25 HydrophobicContact CG2-CD1 4.49Å; V23-I25 HydrophobicContact CG2-CG1 4.42Å; V23-E31 HydrophobicContact CG2-CB 4.02Å; V23-E31 HydrophobicContact CG2-CG 3.97Å; V23-F33 HydrophobicContact CB-CE2 4.45Å; V23-F33 HydrophobicContact CB-CZ 4.03Å; V23-F33 HydrophobicContact CG1-CE2 4.23Å; V23-F33 HydrophobicContact CG1-CZ 4.29Å; V23-F33 HydrophobicContact CG2-CE2 4.4Å; V23-F33 HydrophobicContact CG2-CZ 3.96Å; V23-I105 WeakPolarHBondContact O-CA 3.48Å; V23-V106 HydrophobicContact CG1-CB 4.14Å; V23-V106 PolarHBondContact N-O 2.75Å; V23-V106 PolarHBondContact O-N 3.21Å; V23-F108 HydrophobicContact CB-CE1 4.01Å; V23-F108 HydrophobicContact CG1-CD1 3.85Å; V23-F108 HydrophobicContact CG1-CE1 3.65Å
24	S	91.8	Very high	79.5	Confident	77 Å²	77	83.3 Å²	83.3	54%	0.538	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	115.5	170.9	56.4	0	0	0	0	109.1	K104	S24-K104 CarbonylContact C-O 3.59Å; S24-K104 WeakPolarHBondContact CA-O 3.48Å
25	I	92.8	Very high	81.1	Confident	0 Å²	0	80.9 Å²	80.9	0%	0	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	115.8	175.6	-53.4	96.6	0	0	0	108.7	V23 A29 E31 F94 N96 P103 K104 V106	V23-I25 HydrophobicContact CG1-CD1 3.82Å; V23-I25 HydrophobicContact CG2-CD1 4.49Å; V23-I25 HydrophobicContact CG2-CG1 4.42Å; I25-A29 HydrophobicContact CG2-CB 4.24Å; I25-A29 WeakPolarHBondContact CG2-O 3.31Å; I25-E31 HydrophobicContact CB-CG 4.44Å; I25-E31 HydrophobicContact CG1-CB 3.94Å; I25-E31 HydrophobicContact CG1-CG 3.87Å; I25-E31 HydrophobicContact CG2-CG 4.38Å; I25-F94 HydrophobicContact CD1-CB 4.04Å; I25-F94 HydrophobicContact CG1-CB 4.18Å; I25-N96 HydrophobicContact CB-CB 4.42Å; I25-N96 HydrophobicContact CG2-CB 3.79Å; I25-N96 PolarHBondContact O-ND2 3.32Å; I25-P103 CarbonylContact O-C 3.53Å; I25-P103 VanDerWaalsContact O-CA 3.25Å; I25-P103 WeakPolarHBondContact O-CA 3.33Å; I25-K104 PolarHBondContact N-O 3.28Å; I25-K104 PolarHBondContact O-N 2.84Å; I25-V106 HydrophobicContact CD1-CB 4.05Å; I25-V106 HydrophobicContact CD1-CG2 3.58Å
26	D	91	Very high	82.7	Confident	102 Å²	102	84.4 Å²	84.4	55%	0.545	46%	0.457	S	S	.	.			trans	-63	163.9	178	-79.9	-30	0	0	0	112.7	H28 A29 N96	D26-H28 PolarHBondContact O-N 2.92Å; D26-A29 HydrophobicContact CB-CB 3.94Å; D26-A29 WeakPolarHBondContact O-CB 3.46Å; D26-A29 PolarHBondContact O-N 2.79Å; D26-A29 VanDerWaalsContact O-N 3.15Å; D26-N96 WeakPolarHBondContact O-CB 3.48Å; D26-N96 PolarHBondContact O-ND2 2.82Å
27	A	89.3	Confident	84.5	Confident	35 Å²	35	81 Å²	81	29%	0.289	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	129.6	175.7	0	0	0	0	0	110.4	A29 T100	A27-A29 PolarHBondContact O-N 2.95Å; A27-T100 VanDerWaalsContact CB-O 3.22Å; A27-T100 WeakPolarHBondContact CB-O 3.2Å
28	H	87.9	Confident	86.3	Confident	126 Å²	126	79.5 Å²	79.5	58%	0.583	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	13.5	-178.9	-50.2	63.2	0	0	0	114.9	D26 N96	D26-H28 PolarHBondContact O-N 2.92Å; H28-N96 WeakPolarHBondContact CA-O 3.49Å; H28-N96 PolarHBondContact N-O 3.13Å
29	A	91.2	Very high	87.9	Confident	29 Å²	29	78.2 Å²	78.2	24%	0.24	40%	0.402	C	S	.	.			trans	-97.4	164.5	174.3	0	0	0	0	0	111.8	I25 D26 A27 N96	I25-A29 HydrophobicContact CG2-CB 4.24Å; I25-A29 WeakPolarHBondContact CG2-O 3.31Å; D26-A29 HydrophobicContact CB-CB 3.94Å; D26-A29 WeakPolarHBondContact O-CB 3.46Å; D26-A29 PolarHBondContact O-N 2.79Å; D26-A29 VanDerWaalsContact O-N 3.15Å; A27-A29 PolarHBondContact O-N 2.95Å; A29-N96 PolarHBondContact O-N 2.82Å
30	E	92.9	Very high	89.4	Confident	85 Å²	85	74 Å²	74	40%	0.397	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	138	167.5	69	-177.1	-156.8	0	0	109.3	F94 K97	E30-F94 CarbonylContact C-O 3.48Å; E30-F94 VanDerWaalsContact CA-O 3.27Å; E30-F94 WeakPolarHBondContact CA-O 3.4Å; E30-K97 VanDerWaalsContact OE2-CE 3.26Å; E30-K97 WeakPolarHBondContact OE2-CE 3.42Å; E30-K97 IonicContact OE2-NZ 2.95Å; E30-K97 PolarHBondContact OE2-NZ 2.78Å
31	E	94.8	Very high	90.6	Very high	83 Å²	83	73 Å²	73	39%	0.388	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	130.6	175.5	-72.2	-61.8	154.4	0	0	109.1	V23 I25 C93 F94	V23-E31 HydrophobicContact CG2-CB 4.02Å; V23-E31 HydrophobicContact CG2-CG 3.97Å; I25-E31 HydrophobicContact CB-CG 4.44Å; I25-E31 HydrophobicContact CG1-CB 3.94Å; I25-E31 HydrophobicContact CG1-CG 3.87Å; I25-E31 HydrophobicContact CG2-CG 4.38Å; E31-C93 CarbonylContact O-C 3.52Å; E31-C93 WeakPolarHBondContact O-CA 3.3Å; E31-F94 PolarHBondContact N-O 2.79Å; E31-F94 PolarHBondContact O-N 3.41Å
32	C	95.2	Very high	91.3	Very high	29 Å²	29	71.8 Å²	71.8	20%	0.196	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	136.1	-173.2	-61.8	0	0	0	0	112.4	Y34 K91 F92 C93	C32-Y34 HydrophobicContact CB-CE2 4.12Å; C32-K91 HydrophobicContact CB-CD 4.29Å; C32-K91 HydrophobicContact CB-CG 4.09Å; C32-F92 CarbonylContact C-O 3.53Å; C32-F92 VanDerWaalsContact CA-O 3.3Å; C32-F92 WeakPolarHBondContact CA-O 3.37Å; C32-C93 HydrophobicContact CB-CB 4.18Å; C32-C93 WeakPolarHBondContact CB-SG 3.22Å; C32-C93 WeakPolarHBondContact SG-CB 3.48Å; C32-C93 CovalentContact SG-SG 2.04Å; C32-C93 PolarHBondContact SG-SG 3.41Å
33	F	94.9	Very high	91.5	Very high	60 Å²	60	66.1 Å²	66.1	26%	0.263	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	145	177.1	-59.3	-84.8	0	0	0	110	V23 K91 F92 F94 F108 I110	V23-F33 HydrophobicContact CB-CE2 4.45Å; V23-F33 HydrophobicContact CB-CZ 4.03Å; V23-F33 HydrophobicContact CG1-CE2 4.23Å; V23-F33 HydrophobicContact CG1-CZ 4.29Å; V23-F33 HydrophobicContact CG2-CE2 4.4Å; V23-F33 HydrophobicContact CG2-CZ 3.96Å; F33-K91 CarbonylContact O-C 3.58Å; F33-K91 WeakPolarHBondContact O-CA 3.46Å; F33-F92 PolarHBondContact N-O 3.37Å; F33-F92 PolarHBondContact O-N 2.95Å; F33-F94 HydrophobicContact CD2-CD2 4.19Å; F33-F94 HydrophobicContact CD2-CE2 4.07Å; F33-F94 HydrophobicContact CE2-CD2 4Å; F33-F94 HydrophobicContact CE2-CE2 4.09Å; F33-F108 HydrophobicContact CD1-CE2 4.26Å; F33-F108 AromaticContact CD1-CZ 3.82Å; F33-F108 HydrophobicContact CD1-CZ 3.82Å; F33-F108 HydrophobicContact CD2-CE1 4.36Å; F33-F108 AromaticContact CD2-CE2 3.93Å; F33-F108 HydrophobicContact CD2-CE2 3.93Å; F33-F108 AromaticContact CD2-CZ 3.7Å; F33-F108 HydrophobicContact CD2-CZ 3.7Å; F33-F108 HydrophobicContact CE1-CE1 4.23Å; F33-F108 HydrophobicContact CE1-CE2 4.39Å; F33-F108 AromaticContact CE1-CZ 3.51Å; F33-F108 HydrophobicContact CE1-CZ 3.51Å; F33-F108 AromaticContact CE2-CE1 3.67Å; F33-F108 HydrophobicContact CE2-CE1 3.67Å; F33-F108 HydrophobicContact CE2-CE2 4.06Å; F33-F108 AromaticContact CE2-CZ 3.38Å; F33-F108 HydrophobicContact CE2-CZ 3.38Å; F33-F108 HydrophobicContact CG-CE2 4.04Å; F33-F108 AromaticContact CG-CZ 3.91Å; F33-F108 HydrophobicContact CG-CZ 3.91Å; F33-F108 AromaticContact CZ-CE1 3.6Å; F33-F108 HydrophobicContact CZ-CE1 3.6Å; F33-F108 HydrophobicContact CZ-CE2 4.3Å; F33-F108 AromaticContact CZ-CZ 3.29Å; F33-F108 HydrophobicContact CZ-CZ 3.29Å; F33-I110 HydrophobicContact CB-CD1 3.97Å
34	Y	94.4	Very high	91.5	Very high	143 Å²	143	65.8 Å²	65.8	56%	0.561	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.4	127.7	-171.4	-61.9	-90.3	0	0	0	110.6	C32 T89 Y90 K91	C32-Y34 HydrophobicContact CB-CE2 4.12Å; Y34-T89 HydrophobicContact CD1-CG2 3.94Å; Y34-T89 HydrophobicContact CG-CG2 4.33Å; Y34-Y90 WeakPolarHBondContact CA-O 3.27Å; Y34-K91 HydrophobicContact CD1-CB 4.02Å; Y34-K91 HydrophobicContact CD1-CG 3.97Å; Y34-K91 HydrophobicContact CE1-CB 3.93Å; Y34-K91 HydrophobicContact CE1-CD 3.66Å; Y34-K91 HydrophobicContact CE1-CG 3.51Å
35	E	93.3	Very high	91.6	Very high	73 Å²	73	62.2 Å²	62.2	34%	0.341	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	134.8	176.7	-75.6	-62.2	168.6	0	0	111.2	T89 Y90 F92 I110 I112	E35-T89 CarbonylContact O-C 3.51Å; E35-T89 WeakPolarHBondContact O-CA 3.43Å; E35-Y90 PolarHBondContact N-O 3.36Å; E35-Y90 PolarHBondContact O-N 2.94Å; E35-F92 HydrophobicContact CB-CE2 4.27Å; E35-I110 HydrophobicContact CG-CG2 4.14Å; E35-I112 HydrophobicContact CB-CD1 4.04Å; E35-I112 HydrophobicContact CG-CD1 3.88Å; E35-I112 WeakPolarHBondContact OE2-CD1 3.36Å
36	R	93	Very high	91.6	Very high	185 Å²	185	65.4 Å²	65.4	70%	0.698	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.9	116.3	179.6	-170	175.6	179.4	90.7	0.8	109.5	G88	R36-G88 WeakPolarHBondContact CA-O 3.19Å
37	V	92.3	Very high	91.8	Very high	6 Å²	6	61 Å²	61	4%	0.036	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	159.2	-177	-62.6	0	0	0	0	111.2	T41 M43 A84 G88 Y90 I112	V37-T41 HydrophobicContact CB-CG2 4.22Å; V37-T41 HydrophobicContact CG1-CG2 4.22Å; V37-M43 HydrophobicContact CB-SD 4.3Å; V37-M43 HydrophobicContact CG1-CG 4.05Å; V37-M43 HydrophobicContact CG1-SD 3.87Å; V37-M43 HydrophobicContact CG2-CE 4.07Å; V37-M43 HydrophobicContact CG2-CG 4.39Å; V37-M43 HydrophobicContact CG2-SD 3.52Å; V37-M43 VanDerWaalsContact CG2-SD 3.52Å; V37-A84 HydrophobicContact CG2-CB 3.65Å; V37-G88 PolarHBondContact N-O 2.83Å; V37-G88 PolarHBondContact O-N 2.86Å; V37-Y90 HydrophobicContact CG2-CD2 3.35Å; V37-Y90 HydrophobicContact CG2-CE2 3.44Å; V37-Y90 VanDerWaalsContact CG2-CE2 3.44Å; V37-Y90 HydrophobicContact CG2-CG 4.36Å; V37-I112 HydrophobicContact CG1-CD1 4.2Å; V37-I112 HydrophobicContact CG1-CG1 4.45Å; V37-I112 HydrophobicContact CG1-CG2 3.77Å
38	N	91	Very high	92	Very high	98 Å²	98	64.6 Å²	64.6	52%	0.524	32%	0.316	S	S	.	.			trans	-89.7	159.4	172.3	-63.9	-6.7	0	0	0	109.8	T41 A84 D87 A115	N38-T41 WeakPolarHBondContact O-CB 3.27Å; N38-T41 PolarHBondContact O-N 2.84Å; N38-T41 VanDerWaalsContact O-N 3.15Å; N38-T41 PolarHBondContact O-OG1 2.94Å; N38-A84 VanDerWaalsContact O-CB 3.29Å; N38-A84 WeakPolarHBondContact O-CB 3.44Å; N38-D87 WeakPolarHBondContact CA-OD1 3.22Å; N38-A115 HydrophobicContact CB-CB 4.5Å
39	S	89.3	Confident	92.2	Very high	61 Å²	61	59.1 Å²	59.1	43%	0.427	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	135.4	175.8	-175.2	0	0	0	0	110.1	T41 D87	S39-T41 VanDerWaalsContact C-N 3.27Å; S39-T41 PolarHBondContact O-N 2.82Å; S39-D87 WeakPolarHBondContact CA-OD1 3.4Å; S39-D87 WeakPolarHBondContact CB-OD1 3.16Å; S39-D87 PolarHBondContact N-OD1 3.04Å
40	G	85.1	Confident	92.2	Very high	30 Å²	30	60.4 Å²	60.4	31%	0.309	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	-10.1	-176.7	0	0	0	0	0	115	K42 A84	G40-K42 PolarHBondContact O-N 2.85Å; G40-A84 PolarHBondContact N-O 2.92Å
41	T	88.3	Confident	92	Very high	6 Å²	6	62.4 Å²	62.4	4%	0.037	31%	0.312	C	S	.	.			trans	-66.6	129.6	174.4	-66.3	0	0	0	0	110.9	V37 N38 S39 A83 A84 I112 G113 A115	V37-T41 HydrophobicContact CB-CG2 4.22Å; V37-T41 HydrophobicContact CG1-CG2 4.22Å; N38-T41 WeakPolarHBondContact O-CB 3.27Å; N38-T41 PolarHBondContact O-N 2.84Å; N38-T41 VanDerWaalsContact O-N 3.15Å; N38-T41 PolarHBondContact O-OG1 2.94Å; S39-T41 VanDerWaalsContact C-N 3.27Å; S39-T41 PolarHBondContact O-N 2.82Å; T41-A83 WeakPolarHBondContact O-CA 3.36Å; T41-A84 PolarHBondContact O-N 3.23Å; T41-I112 HydrophobicContact CG2-CG2 3.63Å; T41-G113 WeakPolarHBondContact CG2-O 3.26Å; T41-A115 WeakPolarHBondContact OG1-CB 3.39Å
42	K	89.6	Confident	91.4	Very high	141 Å²	141	59.1 Å²	59.1	61%	0.613	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	128.4	173.6	-67.4	-175.3	178.9	179.1	0	110.3	G40 G113	G40-K42 PolarHBondContact O-N 2.85Å; K42-G113 WeakPolarHBondContact O-CA 3.33Å; K42-G113 PolarHBondContact O-N 3.35Å
43	M	92.1	Very high	90.7	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	135.2	173.4	-63.6	172.6	-69.9	0	0	109.5	V37 S81 V82 A84 Y90 F92 D111	V37-M43 HydrophobicContact CB-SD 4.3Å; V37-M43 HydrophobicContact CG1-CG 4.05Å; V37-M43 HydrophobicContact CG1-SD 3.87Å; V37-M43 HydrophobicContact CG2-CE 4.07Å; V37-M43 HydrophobicContact CG2-CG 4.39Å; V37-M43 HydrophobicContact CG2-SD 3.52Å; V37-M43 VanDerWaalsContact CG2-SD 3.52Å; M43-S81 CarbonylContact O-C 3.59Å; M43-S81 VanDerWaalsContact O-CA 3.29Å; M43-S81 WeakPolarHBondContact O-CA 3.3Å; M43-V82 HydrophobicContact CE-CG1 4.2Å; M43-V82 PolarHBondContact N-O 2.83Å; M43-V82 PolarHBondContact O-N 3.07Å; M43-A84 HydrophobicContact CE-CB 3.94Å; M43-Y90 HydrophobicContact CE-CD1 3.54Å; M43-Y90 HydrophobicContact CE-CD2 3.96Å; M43-Y90 HydrophobicContact CE-CE1 3.7Å; M43-Y90 HydrophobicContact CE-CE2 4.11Å; M43-Y90 HydrophobicContact CE-CG 3.68Å; M43-Y90 HydrophobicContact SD-CD1 4.32Å; M43-Y90 HydrophobicContact SD-CD2 4.06Å; M43-Y90 HydrophobicContact SD-CG 3.87Å; M43-F92 HydrophobicContact CB-CZ 4.39Å; M43-F92 HydrophobicContact SD-CZ 4.12Å; M43-D111 CarbonylContact C-O 3.54Å; M43-D111 WeakPolarHBondContact CA-O 3.4Å
44	G	91.6	Very high	90.2	Very high	12 Å²	12	64.2 Å²	64.2	12%	0.124	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	135.1	174.4	0	0	0	0	0	110.9	Y80 I110 D111	G44-Y80 CarbonylContact C-O 3.58Å; G44-Y80 VanDerWaalsContact CA-O 3.27Å; G44-Y80 WeakPolarHBondContact CA-O 3.35Å; G44-I110 CarbonylContact O-C 3.59Å; G44-I110 VanDerWaalsContact O-CA 3.3Å; G44-I110 WeakPolarHBondContact O-CA 3.22Å; G44-D111 PolarHBondContact N-O 3.37Å; G44-D111 PolarHBondContact O-N 3.3Å
45	L	93.7	Very high	89.9	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.005	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	124.7	167.7	176.8	70.4	0	0	0	108.2	F47 V59 I61 K79 Y80 F92 F94 I110	L45-F47 HydrophobicContact CD2-CD1 4.21Å; L45-F47 HydrophobicContact CG-CD1 4.38Å; L45-V59 HydrophobicContact CD2-CG1 3.75Å; L45-I61 HydrophobicContact CD2-CD1 4.1Å; L45-I61 HydrophobicContact CD2-CG1 4.45Å; L45-K79 CarbonylContact O-C 3.59Å; L45-K79 WeakPolarHBondContact O-CA 3.33Å; L45-Y80 PolarHBondContact N-O 2.76Å; L45-Y80 PolarHBondContact O-N 3.18Å; L45-F92 HydrophobicContact CB-CD1 4.3Å; L45-F92 HydrophobicContact CB-CE1 4.27Å; L45-F92 HydrophobicContact CD1-CD1 4.29Å; L45-F92 HydrophobicContact CD2-CD1 4.17Å; L45-F92 HydrophobicContact CG-CD1 4.48Å; L45-F94 HydrophobicContact CD1-CZ 4.14Å; L45-I110 HydrophobicContact CD1-CG1 3.91Å
46	M	93.2	Very high	89.8	Confident	68 Å²	68	58.4 Å²	58.4	34%	0.335	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	132.6	166.8	-58.1	-164.8	-144.1	0	0	108.7	G78 K79 F108 T109	M46-G78 WeakPolarHBondContact CA-O 3.25Å; M46-K79 HydrophobicContact CE-CD 3.96Å; M46-K79 VanDerWaalsContact CE-CE 3.49Å; M46-K79 HydrophobicContact CE-CG 4.45Å; M46-K79 HydrophobicContact CG-CB 4.24Å; M46-K79 HydrophobicContact CG-CD 4.21Å; M46-K79 HydrophobicContact CG-CG 3.89Å; M46-K79 HydrophobicContact SD-CD 3.79Å; M46-K79 HydrophobicContact SD-CG 4.17Å; M46-F108 CarbonylContact O-C 3.5Å; M46-F108 WeakPolarHBondContact O-CA 3.43Å; M46-F108 WeakPolarHBondContact O-CB 3.4Å; M46-T109 PolarHBondContact N-O 3.14Å; M46-T109 PolarHBondContact O-N 2.91Å
47	F	94.3	Very high	89.8	Confident	9 Å²	9	49.6 Å²	49.6	4%	0.039	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	154.5	175.6	73.2	-86.1	0	0	0	112.4	L45 I57 V59 E75 S77 G78 Y80 F94 V106 M107 F108	L45-F47 HydrophobicContact CD2-CD1 4.21Å; L45-F47 HydrophobicContact CG-CD1 4.38Å; F47-I57 HydrophobicContact CD2-CG2 4.1Å; F47-I57 HydrophobicContact CE2-CG2 3.84Å; F47-V59 HydrophobicContact CD1-CG2 4.25Å; F47-V59 HydrophobicContact CD2-CG2 4.27Å; F47-V59 HydrophobicContact CE1-CB 4.37Å; F47-V59 HydrophobicContact CE1-CG1 4.32Å; F47-V59 HydrophobicContact CE1-CG2 3.73Å; F47-V59 HydrophobicContact CE2-CG2 3.78Å; F47-V59 HydrophobicContact CG-CG2 4.5Å; F47-V59 HydrophobicContact CZ-CB 4.42Å; F47-V59 HydrophobicContact CZ-CG2 3.5Å; F47-V59 VanDerWaalsContact CZ-CG2 3.5Å; F47-E75 HydrophobicContact CE2-CB 4.14Å; F47-E75 HydrophobicContact CZ-CB 3.81Å; F47-S77 VanDerWaalsContact O-CA 3.24Å; F47-S77 WeakPolarHBondContact O-CA 3.41Å; F47-G78 PolarHBondContact N-O 3.34Å; F47-G78 PolarHBondContact O-N 3.15Å; F47-Y80 HydrophobicContact CE1-CD2 4.05Å; F47-Y80 AromaticContact CE1-CE2 3.76Å; F47-Y80 HydrophobicContact CE1-CE2 3.76Å; F47-Y80 HydrophobicContact CZ-CE2 4.42Å; F47-F94 HydrophobicContact CB-CE1 3.86Å; F47-F94 HydrophobicContact CB-CZ 4.14Å; F47-F94 HydrophobicContact CD1-CE1 4.35Å; F47-F94 HydrophobicContact CD2-CE1 4.35Å; F47-F94 AromaticContact CG-CE1 3.93Å; F47-F94 HydrophobicContact CG-CE1 3.93Å; F47-V106 HydrophobicContact CB-CG1 4.11Å; F47-V106 HydrophobicContact CD2-CG1 4.46Å; F47-M107 CarbonylContact C-O 3.55Å; F47-M107 WeakPolarHBondContact CA-O 3.24Å; F47-F108 HydrophobicContact CB-CB 3.92Å
48	E	94.5	Very high	89.9	Confident	110 Å²	110	50.5 Å²	50.5	51%	0.514	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	132.3	174.8	-173.7	172.1	-179	0	0	109.6	A50 M107	E48-A50 PolarHBondContact O-N 3.42Å; E48-M107 HydrophobicContact CB-CE 4.34Å; E48-M107 PolarHBondContact N-O 2.91Å; E48-M107 PolarHBondContact O-N 3.42Å
49	V	92.3	Very high	90	Very high	11 Å²	11	46 Å²	46	7%	0.067	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	111.8	176.5	-174.6	0	0	0	0	108.8	L55 I57 S76 V106	V49-L55 HydrophobicContact CG1-CB 4.43Å; V49-L55 HydrophobicContact CG1-CD2 4.34Å; V49-I57 HydrophobicContact CG2-CB 3.97Å; V49-I57 HydrophobicContact CG2-CG2 3.69Å; V49-S76 WeakPolarHBondContact CG2-O 3.4Å; V49-S76 PolarHBondContact N-O 3.26Å; V49-V106 HydrophobicContact CG2-CG2 4.33Å
50	A	90.1	Very high	90.3	Very high	57 Å²	57	45.9 Å²	45.9	47%	0.471	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	-40.8	-178.1	0	0	0	0	0	112.1	F22 E48 I105	F22-A50 HydrophobicContact CE1-CB 4.49Å; E48-A50 PolarHBondContact O-N 3.42Å; A50-I105 HydrophobicContact CB-CB 4.47Å; A50-I105 HydrophobicContact CB-CG2 4.22Å; A50-I105 PolarHBondContact N-O 2.81Å
51	E	88.2	Confident	90.8	Very high	127 Å²	127	44.6 Å²	44.6	59%	0.593	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-153	151.5	-175.7	-160.3	172.8	-179.7	0	0	112.3	K104 I105	E51-K104 CarbonylContact O-C 3.47Å; E51-K104 WeakPolarHBondContact O-CA 3.5Å; E51-I105 HydrophobicContact CB-CB 4.2Å; E51-I105 HydrophobicContact CB-CD1 4.2Å; E51-I105 HydrophobicContact CB-CG1 4.32Å; E51-I105 PolarHBondContact N-O 3.23Å; E51-I105 PolarHBondContact O-N 3.44Å
52	G	82.7	Confident	91.1	Very high	14 Å²	14	45 Å²	45	14%	0.144	24%	0.24	C	C	.	.	S	Bend	trans	114	133.6	170.8	0	0	0	0	0	114.8	F54 L55	G52-F54 PolarHBondContact O-N 2.88Å; G52-L55 PolarHBondContact O-N 2.84Å
53	G	81.6	Confident	91.3	Very high	42 Å²	42	38.6 Å²	38.6	43%	0.433	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	-127.9	172.8	0	0	0	0	0	115	L55	G53-L55 VanDerWaalsContact C-N 3.28Å
54	F	84.1	Confident	91.4	Very high	154 Å²	154	40.9 Å²	40.9	68%	0.675	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.9	13.7	177.5	-64.6	-74.6	0	0	0	113.7	G52 D56	G52-F54 PolarHBondContact O-N 2.88Å; F54-D56 PolarHBondContact O-N 2.83Å
55	L	88.4	Confident	91.5	Very high	84 Å²	84	44 Å²	44	44%	0.44	24%	0.243	S	C	.	.	S	Bend	trans	56.7	36.7	-175.3	-54.7	172.6	0	0	0	112.9	V49 G52 G53 S76	V49-L55 HydrophobicContact CG1-CB 4.43Å; V49-L55 HydrophobicContact CG1-CD2 4.34Å; G52-L55 PolarHBondContact O-N 2.84Å; G53-L55 VanDerWaalsContact C-N 3.28Å; L55-S76 WeakPolarHBondContact O-CA 3.11Å; L55-S76 WeakPolarHBondContact O-CB 3.33Å
56	D	90.8	Very high	91.2	Very high	9 Å²	9	46.7 Å²	46.7	5%	0.048	27%	0.271	C	S	.	.			trans	-117.7	155.2	177.3	59.7	-1.3	0	0	0	110.9	F54 R74 E75 K104	F54-D56 PolarHBondContact O-N 2.83Å; D56-R74 HydrophobicContact CB-CB 4.06Å; D56-R74 IonicContact OD2-CZ 3.87Å; D56-R74 IonicContact OD2-NE 3.87Å; D56-R74 PolarHBondContact OD2-NE 2.64Å; D56-R74 IonicContact OD2-NH2 3.59Å; D56-R74 PolarHBondContact OD2-NH2 2.98Å; D56-E75 CarbonylContact C-O 3.52Å; D56-K104 WeakPolarHBondContact O-CD 3.11Å; D56-K104 WeakPolarHBondContact O-CE 3.18Å; D56-K104 PolarHBondContact O-NZ 3.5Å; D56-K104 IonicContact OD1-NZ 3.34Å; D56-K104 PolarHBondContact OD1-NZ 3.28Å
57	I	92.4	Very high	91.2	Very high	1 Å²	1	50 Å²	50	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	150.6	171.3	-164.6	69.9	0	0	0	110.1	F47 V49 V59 R74 E75 F94 S95 N96 K104 V106	F47-I57 HydrophobicContact CD2-CG2 4.1Å; F47-I57 HydrophobicContact CE2-CG2 3.84Å; V49-I57 HydrophobicContact CG2-CB 3.97Å; V49-I57 HydrophobicContact CG2-CG2 3.69Å; I57-V59 HydrophobicContact CG2-CG2 3.86Å; I57-R74 PolarHBondContact O-N 2.82Å; I57-E75 PolarHBondContact N-O 2.82Å; I57-E75 PolarHBondContact O-N 2.82Å; I57-F94 HydrophobicContact CG1-CB 4.18Å; I57-F94 HydrophobicContact CG1-CD1 4.48Å; I57-F94 HydrophobicContact CG2-CD1 4.4Å; I57-S95 WeakPolarHBondContact CD1-O 3.42Å; I57-N96 HydrophobicContact CD1-CB 4.1Å; I57-K104 HydrophobicContact CD1-CD 3.8Å; I57-V106 HydrophobicContact CB-CG2 4.43Å; I57-V106 HydrophobicContact CG1-CG2 4.22Å; I57-V106 HydrophobicContact CG2-CG2 4.41Å
58	D	93.8	Very high	91.1	Very high	25 Å²	25	53.9 Å²	53.9	13%	0.134	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	128.6	171.8	-56.2	-33.5	0	0	0	108.9	G72 D73 R74 F94 S95	D58-G72 CarbonylContact C-O 3.51Å; D58-G72 WeakPolarHBondContact CA-O 3.31Å; D58-D73 WeakPolarHBondContact OD1-CA 3.43Å; D58-R74 PolarHBondContact OD1-N 2.79Å; D58-F94 CarbonylContact O-C 3.59Å; D58-F94 WeakPolarHBondContact O-CA 3.29Å; D58-S95 PolarHBondContact N-O 3.02Å; D58-S95 PolarHBondContact O-N 2.91Å
59	V	94.6	Very high	91	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.012	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	130.7	-177.7	-175.7	0	0	0	0	109.8	L45 F47 I57 Y70 K71 G72 C93 F94	L45-V59 HydrophobicContact CD2-CG1 3.75Å; F47-V59 HydrophobicContact CD1-CG2 4.25Å; F47-V59 HydrophobicContact CD2-CG2 4.27Å; F47-V59 HydrophobicContact CE1-CB 4.37Å; F47-V59 HydrophobicContact CE1-CG1 4.32Å; F47-V59 HydrophobicContact CE1-CG2 3.73Å; F47-V59 HydrophobicContact CE2-CG2 3.78Å; F47-V59 HydrophobicContact CG-CG2 4.5Å; F47-V59 HydrophobicContact CZ-CB 4.42Å; F47-V59 HydrophobicContact CZ-CG2 3.5Å; F47-V59 VanDerWaalsContact CZ-CG2 3.5Å; I57-V59 HydrophobicContact CG2-CG2 3.86Å; V59-Y70 HydrophobicContact CB-CE1 4.38Å; V59-Y70 HydrophobicContact CG1-CE1 4.35Å; V59-K71 CarbonylContact O-C 3.58Å; V59-K71 WeakPolarHBondContact O-CA 3.46Å; V59-G72 PolarHBondContact N-O 3.14Å; V59-G72 PolarHBondContact O-N 2.72Å; V59-C93 WeakPolarHBondContact CA-O 3.27Å; V59-F94 HydrophobicContact CG1-CE1 4.27Å; V59-F94 HydrophobicContact CG2-CD1 3.82Å; V59-F94 HydrophobicContact CG2-CE1 3.94Å
60	E	95.2	Very high	91	Very high	60 Å²	60	52.9 Å²	52.9	28%	0.28	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	131.6	178.5	-177.8	171.9	-166.9	0	0	111.1	Q68 C93	E60-Q68 VanDerWaalsContact CD-NE2 3.27Å; E60-Q68 HydrophobicContact CG-CG 4.3Å; E60-Q68 PolarHBondContact OE1-NE2 2.95Å; E60-C93 PolarHBondContact N-O 3.02Å; E60-C93 PolarHBondContact O-N 2.76Å
61	I	95.4	Very high	91.2	Very high	3 Å²	3	55.1 Å²	55.1	2%	0.015	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	120	173.3	-52.4	176.9	0	0	0	108.2	L45 I69 Y70 K91 F92	L45-I61 HydrophobicContact CD2-CD1 4.1Å; L45-I61 HydrophobicContact CD2-CG1 4.45Å; I61-I69 HydrophobicContact CB-CB 4.49Å; I61-I69 HydrophobicContact CG2-CB 4.35Å; I61-I69 HydrophobicContact CG2-CD1 4.37Å; I61-I69 PolarHBondContact O-N 3.04Å; I61-Y70 HydrophobicContact CD1-CD1 4.06Å; I61-Y70 HydrophobicContact CD1-CG 4.43Å; I61-Y70 HydrophobicContact CG1-CD1 4.15Å; I61-Y70 PolarHBondContact N-O 2.85Å; I61-Y70 PolarHBondContact O-N 2.88Å; I61-K91 CarbonylContact C-O 3.57Å; I61-K91 WeakPolarHBondContact CA-O 2.99Å; I61-F92 HydrophobicContact CB-CD1 4.49Å; I61-F92 HydrophobicContact CD1-CD1 3.96Å; I61-F92 HydrophobicContact CD1-CE1 3.94Å; I61-F92 HydrophobicContact CG1-CD1 3.81Å; I61-F92 HydrophobicContact CG1-CE1 4.18Å; I61-F92 HydrophobicContact CG2-CD1 4.04Å; I61-F92 HydrophobicContact CG2-CE1 3.89Å; I61-F92 HydrophobicContact CG2-CZ 4.45Å
62	T	95.5	Very high	91.4	Very high	13 Å²	13	49.2 Å²	49.2	8%	0.08	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	136.7	179.5	-37.2	0	0	0	0	110.6	K67 K91	T62-K67 WeakPolarHBondContact CA-O 3.36Å; T62-K67 WeakPolarHBondContact CG2-O 3.29Å; T62-K91 PolarHBondContact N-O 2.76Å; T62-K91 PolarHBondContact O-N 2.93Å; T62-K91 VanDerWaalsContact OG1-CE 3.31Å; T62-K91 WeakPolarHBondContact OG1-CE 3.16Å
63	G	93.5	Very high	91.9	Very high	7 Å²	7	53 Å²	53	7%	0.072	29%	0.285	C	S	.	.			trans	-77.5	170.6	172.5	0	0	0	0	0	113.7	D65 G66 K67	G63-D65 PolarHBondContact O-N 2.82Å; G63-G66 PolarHBondContact O-N 2.62Å; G63-K67 PolarHBondContact N-O 3.45Å
64	P	94.2	Very high	92.2	Very high	49 Å²	49	58.2 Å²	58.2	32%	0.318	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-19	176.9	26.4	-34.8	0	0	0	113.8	M86 T89 Y90	P64-M86 HydrophobicContact CG-CE 4.19Å; P64-M86 HydrophobicContact CG-CG 3.5Å; P64-M86 HydrophobicContact CG-SD 3.8Å; P64-T89 WeakPolarHBondContact CA-O 3.15Å; P64-T89 WeakPolarHBondContact CB-O 3.18Å; P64-Y90 HydrophobicContact CG-CE2 4.17Å
65	D	92.4	Very high	92.6	Very high	78 Å²	78	53.1 Å²	53.1	42%	0.417	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-1.6	171.5	55.8	-12.6	0	0	0	113.5	G63 K67 H85 M86	G63-D65 PolarHBondContact O-N 2.82Å; D65-K67 VanDerWaalsContact CG-CB 3.48Å; D65-K67 PolarHBondContact O-N 3.35Å; D65-K67 WeakPolarHBondContact OD1-CB 3.22Å; D65-K67 PolarHBondContact OD1-N 3.35Å; D65-K67 VanDerWaalsContact OD1-N 3.17Å; D65-K67 VanDerWaalsContact OD2-CB 3.3Å; D65-K67 WeakPolarHBondContact OD2-CB 3.48Å; D65-H85 VanDerWaalsContact CG-NE2 3.33Å; D65-H85 IonicContact OD1-CE1 2.74Å; D65-H85 IonicContact OD1-NE2 2.82Å; D65-H85 PolarHBondContact OD1-NE2 3.39Å; D65-H85 IonicContact OD2-CD2 3.39Å; D65-H85 IonicContact OD2-CE1 2.75Å; D65-H85 IonicContact OD2-NE2 2.9Å; D65-H85 PolarHBondContact OD2-NE2 2.74Å; D65-M86 HydrophobicContact CB-SD 3.78Å
66	G	89.1	Confident	92.8	Very high	58 Å²	58	52.3 Å²	52.3	60%	0.598	27%	0.271	S	S	*	.	S	Bend	trans	75.4	7.3	-173.1	0	0	0	0	0	113.3	G63	G63-G66 PolarHBondContact O-N 2.62Å
67	K	91.4	Very high	93	Very high	137 Å²	137	55 Å²	55	60%	0.596	29%	0.291	S	S	*	.			trans	-76.8	131.2	177.2	-172.3	179.2	177.2	-176.1	0	109.9	T62 G63 D65 I69	T62-K67 WeakPolarHBondContact CA-O 3.36Å; T62-K67 WeakPolarHBondContact CG2-O 3.29Å; G63-K67 PolarHBondContact N-O 3.45Å; D65-K67 VanDerWaalsContact CG-CB 3.48Å; D65-K67 PolarHBondContact O-N 3.35Å; D65-K67 WeakPolarHBondContact OD1-CB 3.22Å; D65-K67 PolarHBondContact OD1-N 3.35Å; D65-K67 VanDerWaalsContact OD1-N 3.17Å; D65-K67 VanDerWaalsContact OD2-CB 3.3Å; D65-K67 WeakPolarHBondContact OD2-CB 3.48Å; K67-I69 PolarHBondContact O-N 3.44Å
68	Q	92.8	Very high	92.8	Very high	90 Å²	90	55.8 Å²	55.8	42%	0.421	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	117	171.6	-171.6	174.1	56.4	0	0	109.3	E60 K71	E60-Q68 VanDerWaalsContact CD-NE2 3.27Å; E60-Q68 HydrophobicContact CG-CG 4.3Å; E60-Q68 PolarHBondContact OE1-NE2 2.95Å; Q68-K71 HydrophobicContact CG-CB 4.3Å
69	I	92.5	Very high	92.7	Very high	53 Å²	53	61.9 Å²	61.9	27%	0.272	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-40.7	-178.9	-64.6	167.1	0	0	0	109.6	I61 K67 V82 Y90	I61-I69 HydrophobicContact CB-CB 4.49Å; I61-I69 HydrophobicContact CG2-CB 4.35Å; I61-I69 HydrophobicContact CG2-CD1 4.37Å; I61-I69 PolarHBondContact O-N 3.04Å; K67-I69 PolarHBondContact O-N 3.44Å; I69-V82 HydrophobicContact CG2-CB 4.39Å; I69-V82 HydrophobicContact CG2-CG1 4.33Å; I69-V82 HydrophobicContact CG2-CG2 3.72Å; I69-Y90 HydrophobicContact CD1-CD1 3.54Å; I69-Y90 HydrophobicContact CD1-CE1 3.34Å
70	Y	93.1	Very high	92.5	Very high	48 Å²	48	64.7 Å²	64.7	19%	0.188	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	144.3	-179.8	173.1	-97.4	0	0	0	110.1	V59 I61 G72 E75 Y80	V59-Y70 HydrophobicContact CB-CE1 4.38Å; V59-Y70 HydrophobicContact CG1-CE1 4.35Å; I61-Y70 HydrophobicContact CD1-CD1 4.06Å; I61-Y70 HydrophobicContact CD1-CG 4.43Å; I61-Y70 HydrophobicContact CG1-CD1 4.15Å; I61-Y70 PolarHBondContact N-O 2.85Å; I61-Y70 PolarHBondContact O-N 2.88Å; Y70-G72 WeakPolarHBondContact OH-CA 3.4Å; Y70-E75 PolarHBondContact OH-OE1 2.77Å; Y70-E75 PolarHBondContact OH-OE2 2.79Å; Y70-Y80 HydrophobicContact CD1-CG 4.49Å; Y70-Y80 HydrophobicContact CD2-CD1 4.1Å; Y70-Y80 HydrophobicContact CD2-CE1 4.08Å; Y70-Y80 HydrophobicContact CE1-CD1 4.37Å; Y70-Y80 AromaticContact CE1-CD2 3.98Å; Y70-Y80 HydrophobicContact CE1-CD2 3.98Å; Y70-Y80 HydrophobicContact CE1-CE1 4.2Å; Y70-Y80 AromaticContact CE1-CE2 3.75Å; Y70-Y80 HydrophobicContact CE1-CE2 3.75Å; Y70-Y80 HydrophobicContact CE1-CG 4.29Å; Y70-Y80 AromaticContact CE1-CZ 3.9Å; Y70-Y80 AromaticContact CE2-CD1 3.83Å; Y70-Y80 HydrophobicContact CE2-CD1 3.83Å; Y70-Y80 AromaticContact CE2-CE1 3.35Å; Y70-Y80 HydrophobicContact CE2-CE1 3.35Å; Y70-Y80 HydrophobicContact CE2-CE2 4.35Å; Y70-Y80 AromaticContact CE2-CZ 3.66Å; Y70-Y80 AromaticContact CZ-CD1 3.99Å; Y70-Y80 AromaticContact CZ-CE1 3.44Å; Y70-Y80 VanDerWaalsContact CZ-CE1 3.44Å; Y70-Y80 AromaticContact CZ-CE2 3.57Å; Y70-Y80 AromaticContact CZ-CZ 3.22Å; Y70-Y80 WeakPolarHBondContact OH-CE2 3.35Å; Y70-Y80 PolarHBondContact OH-OH 2.85Å
71	K	93.9	Very high	92.3	Very high	104 Å²	104	66.2 Å²	66.2	45%	0.452	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	117.9	174.7	-164.1	-168.1	-175.2	-122	0	108.5	V59 Q68 D73	V59-K71 CarbonylContact O-C 3.58Å; V59-K71 WeakPolarHBondContact O-CA 3.46Å; Q68-K71 HydrophobicContact CG-CB 4.3Å; K71-D73 WeakPolarHBondContact CE-OD1 3.47Å; K71-D73 VanDerWaalsContact NZ-CG 3.26Å; K71-D73 IonicContact NZ-OD1 3.73Å; K71-D73 PolarHBondContact NZ-OD1 3.45Å; K71-D73 IonicContact NZ-OD2 3.06Å; K71-D73 PolarHBondContact NZ-OD2 3.06Å
72	G	92.6	Very high	91.9	Very high	3 Å²	3	68.1 Å²	68.1	3%	0.031	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	122.9	171.9	0	0	0	0	0	108.8	D58 V59 Y70	D58-G72 CarbonylContact C-O 3.51Å; D58-G72 WeakPolarHBondContact CA-O 3.31Å; V59-G72 PolarHBondContact N-O 3.14Å; V59-G72 PolarHBondContact O-N 2.72Å; Y70-G72 WeakPolarHBondContact OH-CA 3.4Å
73	D	92	Very high	91.6	Very high	94 Å²	94	70 Å²	70	50%	0.503	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	129.1	175.7	-64.9	-52.4	0	0	0	108.5	D58 K71	D58-D73 WeakPolarHBondContact OD1-CA 3.43Å; K71-D73 WeakPolarHBondContact CE-OD1 3.47Å; K71-D73 VanDerWaalsContact NZ-CG 3.26Å; K71-D73 IonicContact NZ-OD1 3.73Å; K71-D73 PolarHBondContact NZ-OD1 3.45Å; K71-D73 IonicContact NZ-OD2 3.06Å; K71-D73 PolarHBondContact NZ-OD2 3.06Å
74	R	89.6	Confident	91.5	Very high	151 Å²	151	69.9 Å²	69.9	57%	0.57	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	54.8	50.1	176.8	-53.6	-175.9	66.6	-172	-0.7	115.8	D56 I57 D58	D56-R74 HydrophobicContact CB-CB 4.06Å; D56-R74 IonicContact OD2-CZ 3.87Å; D56-R74 IonicContact OD2-NE 3.87Å; D56-R74 PolarHBondContact OD2-NE 2.64Å; D56-R74 IonicContact OD2-NH2 3.59Å; D56-R74 PolarHBondContact OD2-NH2 2.98Å; I57-R74 PolarHBondContact O-N 2.82Å; D58-R74 PolarHBondContact OD1-N 2.79Å
75	E	92.1	Very high	91.3	Very high	47 Å²	47	71.7 Å²	71.7	22%	0.22	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	138.6	175.6	-63.2	-164.2	175.9	0	0	111.7	F47 D56 I57 Y70 Y80	F47-E75 HydrophobicContact CE2-CB 4.14Å; F47-E75 HydrophobicContact CZ-CB 3.81Å; D56-E75 CarbonylContact C-O 3.52Å; I57-E75 PolarHBondContact N-O 2.82Å; I57-E75 PolarHBondContact O-N 2.82Å; Y70-E75 PolarHBondContact OH-OE1 2.77Å; Y70-E75 PolarHBondContact OH-OE2 2.79Å; E75-Y80 PolarHBondContact OE1-OH 3.03Å; E75-Y80 WeakPolarHBondContact OE2-CE2 3.17Å; E75-Y80 PolarHBondContact OE2-OH 2.68Å
76	S	92.2	Very high	91.2	Very high	67 Å²	67	71.4 Å²	71.4	47%	0.469	38%	0.381	S	S	.	.	S	Bend	trans	-86.7	-30.8	176.2	59.4	0	0	0	0	113.1	V49 L55	V49-S76 WeakPolarHBondContact CG2-O 3.4Å; V49-S76 PolarHBondContact N-O 3.26Å; L55-S76 WeakPolarHBondContact O-CA 3.11Å; L55-S76 WeakPolarHBondContact O-CB 3.33Å
77	S	94	Very high	91.4	Very high	66 Å²	66	73.5 Å²	73.5	46%	0.462	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	147.7	-179.7	59.9	0	0	0	0	109.5	F47	F47-S77 VanDerWaalsContact O-CA 3.24Å; F47-S77 WeakPolarHBondContact O-CA 3.41Å
78	G	89.3	Confident	91.5	Very high	17 Å²	17	67.3 Å²	67.3	18%	0.175	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	154.5	178.8	0	0	0	0	0	113.2	M46 F47	M46-G78 WeakPolarHBondContact CA-O 3.25Å; F47-G78 PolarHBondContact N-O 3.34Å; F47-G78 PolarHBondContact O-N 3.15Å
79	K	92.3	Very high	91.6	Very high	153 Å²	153	65.5 Å²	65.5	67%	0.665	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.8	116.9	170.5	175.5	172.1	-179.6	173.2	0	108.8	L45 M46	L45-K79 CarbonylContact O-C 3.59Å; L45-K79 WeakPolarHBondContact O-CA 3.33Å; M46-K79 HydrophobicContact CE-CD 3.96Å; M46-K79 VanDerWaalsContact CE-CE 3.49Å; M46-K79 HydrophobicContact CE-CG 4.45Å; M46-K79 HydrophobicContact CG-CB 4.24Å; M46-K79 HydrophobicContact CG-CD 4.21Å; M46-K79 HydrophobicContact CG-CG 3.89Å; M46-K79 HydrophobicContact SD-CD 3.79Å; M46-K79 HydrophobicContact SD-CG 4.17Å
80	Y	90.4	Very high	91.7	Very high	61 Å²	61	63 Å²	63	24%	0.239	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	135.2	-177.6	-65.6	-71.5	0	0	0	109.8	G44 L45 F47 Y70 E75	G44-Y80 CarbonylContact C-O 3.58Å; G44-Y80 VanDerWaalsContact CA-O 3.27Å; G44-Y80 WeakPolarHBondContact CA-O 3.35Å; L45-Y80 PolarHBondContact N-O 2.76Å; L45-Y80 PolarHBondContact O-N 3.18Å; F47-Y80 HydrophobicContact CE1-CD2 4.05Å; F47-Y80 AromaticContact CE1-CE2 3.76Å; F47-Y80 HydrophobicContact CE1-CE2 3.76Å; F47-Y80 HydrophobicContact CZ-CE2 4.42Å; Y70-Y80 HydrophobicContact CD1-CG 4.49Å; Y70-Y80 HydrophobicContact CD2-CD1 4.1Å; Y70-Y80 HydrophobicContact CD2-CE1 4.08Å; Y70-Y80 HydrophobicContact CE1-CD1 4.37Å; Y70-Y80 AromaticContact CE1-CD2 3.98Å; Y70-Y80 HydrophobicContact CE1-CD2 3.98Å; Y70-Y80 HydrophobicContact CE1-CE1 4.2Å; Y70-Y80 AromaticContact CE1-CE2 3.75Å; Y70-Y80 HydrophobicContact CE1-CE2 3.75Å; Y70-Y80 HydrophobicContact CE1-CG 4.29Å; Y70-Y80 AromaticContact CE1-CZ 3.9Å; Y70-Y80 AromaticContact CE2-CD1 3.83Å; Y70-Y80 HydrophobicContact CE2-CD1 3.83Å; Y70-Y80 AromaticContact CE2-CE1 3.35Å; Y70-Y80 HydrophobicContact CE2-CE1 3.35Å; Y70-Y80 HydrophobicContact CE2-CE2 4.35Å; Y70-Y80 AromaticContact CE2-CZ 3.66Å; Y70-Y80 AromaticContact CZ-CD1 3.99Å; Y70-Y80 AromaticContact CZ-CE1 3.44Å; Y70-Y80 VanDerWaalsContact CZ-CE1 3.44Å; Y70-Y80 AromaticContact CZ-CE2 3.57Å; Y70-Y80 AromaticContact CZ-CZ 3.22Å; Y70-Y80 WeakPolarHBondContact OH-CE2 3.35Å; Y70-Y80 PolarHBondContact OH-OH 2.85Å; E75-Y80 PolarHBondContact OE1-OH 3.03Å; E75-Y80 WeakPolarHBondContact OE2-CE2 3.17Å; E75-Y80 PolarHBondContact OE2-OH 2.68Å
81	S	89.4	Confident	91.8	Very high	91 Å²	91	63.3 Å²	63.3	64%	0.636	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131	124.6	175.2	-177.6	0	0	0	0	108.8	M43	M43-S81 CarbonylContact O-C 3.59Å; M43-S81 VanDerWaalsContact O-CA 3.29Å; M43-S81 WeakPolarHBondContact O-CA 3.3Å
82	V	87.9	Confident	91.9	Very high	43 Å²	43	58.4 Å²	58.4	26%	0.261	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	141.7	-179.8	64.9	0	0	0	0	110.7	M43 I69	M43-V82 HydrophobicContact CE-CG1 4.2Å; M43-V82 PolarHBondContact N-O 2.83Å; M43-V82 PolarHBondContact O-N 3.07Å; I69-V82 HydrophobicContact CG2-CB 4.39Å; I69-V82 HydrophobicContact CG2-CG1 4.33Å; I69-V82 HydrophobicContact CG2-CG2 3.72Å
83	A	89.9	Confident	92	Very high	54 Å²	54	58.5 Å²	58.5	45%	0.446	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	137.4	172	0	0	0	0	0	110.1	T41 H85	T41-A83 WeakPolarHBondContact O-CA 3.36Å; A83-H85 PolarHBondContact O-N 2.93Å
84	A	91.3	Very high	92.2	Very high	4 Å²	4	54 Å²	54	3%	0.033	29%	0.293	C	S	.	.			trans	-62.7	119	175	0	0	0	0	0	110.1	V37 N38 G40 T41 M43 M86 Y90	V37-A84 HydrophobicContact CG2-CB 3.65Å; N38-A84 VanDerWaalsContact O-CB 3.29Å; N38-A84 WeakPolarHBondContact O-CB 3.44Å; G40-A84 PolarHBondContact N-O 2.92Å; T41-A84 PolarHBondContact O-N 3.23Å; M43-A84 HydrophobicContact CE-CB 3.94Å; A84-M86 VanDerWaalsContact C-N 3.33Å; A84-Y90 VanDerWaalsContact CA-OH 3.3Å; A84-Y90 WeakPolarHBondContact CA-OH 3.41Å; A84-Y90 HydrophobicContact CB-CE2 3.82Å
85	H	89.8	Confident	92.3	Very high	87 Å²	87	47.6 Å²	47.6	40%	0.403	27%	0.271	S	S	.	.	S	Bend	trans	-76.4	-20.2	177.3	64.9	-75.8	0	0	0	113.6	D65 A83 Y90	D65-H85 VanDerWaalsContact CG-NE2 3.33Å; D65-H85 IonicContact OD1-CE1 2.74Å; D65-H85 IonicContact OD1-NE2 2.82Å; D65-H85 PolarHBondContact OD1-NE2 3.39Å; D65-H85 IonicContact OD2-CD2 3.39Å; D65-H85 IonicContact OD2-CE1 2.75Å; D65-H85 IonicContact OD2-NE2 2.9Å; D65-H85 PolarHBondContact OD2-NE2 2.74Å; A83-H85 PolarHBondContact O-N 2.93Å; H85-Y90 AromaticContact CE1-CE1 3.94Å; H85-Y90 PolarHBondContact CE1-OH 2.83Å; H85-Y90 PolarHBondContact N-OH 2.86Å; H85-Y90 AromaticContact ND1-CE1 3.75Å; H85-Y90 AromaticContact ND1-CZ 3.72Å; H85-Y90 PolarHBondContact ND1-OH 2.86Å
86	M	90.2	Very high	92.3	Very high	72 Å²	72	45.4 Å²	45.4	36%	0.355	26%	0.261	S	S	.	.	S	Bend	trans	-155.7	158.8	179.9	63.7	-175.2	-68.6	0	0	111.1	P64 D65 A84 G88 Y90	P64-M86 HydrophobicContact CG-CE 4.19Å; P64-M86 HydrophobicContact CG-CG 3.5Å; P64-M86 HydrophobicContact CG-SD 3.8Å; D65-M86 HydrophobicContact CB-SD 3.78Å; A84-M86 VanDerWaalsContact C-N 3.33Å; M86-G88 PolarHBondContact O-N 3.36Å; M86-Y90 PolarHBondContact N-OH 2.82Å; M86-Y90 WeakPolarHBondContact O-CE2 3.29Å; M86-Y90 PolarHBondContact O-OH 3.43Å
87	D	92.4	Very high	91.7	Very high	101 Å²	101	47.6 Å²	47.6	54%	0.54	26%	0.262	S	S	.	.	S	Bend	trans	-65.7	129.4	174.3	-61.3	-11.6	0	0	0	110.1	N38 S39	N38-D87 WeakPolarHBondContact CA-OD1 3.22Å; S39-D87 WeakPolarHBondContact CA-OD1 3.4Å; S39-D87 WeakPolarHBondContact CB-OD1 3.16Å; S39-D87 PolarHBondContact N-OD1 3.04Å
88	G	93.3	Very high	90.4	Very high	7 Å²	7	52.3 Å²	52.3	7%	0.072	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.8	-168.3	174.5	0	0	0	0	0	114.3	R36 V37 M86	R36-G88 WeakPolarHBondContact CA-O 3.19Å; V37-G88 PolarHBondContact N-O 2.83Å; V37-G88 PolarHBondContact O-N 2.86Å; M86-G88 PolarHBondContact O-N 3.36Å
89	T	95	Very high	89.1	Confident	53 Å²	53	52.6 Å²	52.6	33%	0.325	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	118.1	178.9	-58.2	0	0	0	0	109.9	Y34 E35 P64	Y34-T89 HydrophobicContact CD1-CG2 3.94Å; Y34-T89 HydrophobicContact CG-CG2 4.33Å; E35-T89 CarbonylContact O-C 3.51Å; E35-T89 WeakPolarHBondContact O-CA 3.43Å; P64-T89 WeakPolarHBondContact CA-O 3.15Å; P64-T89 WeakPolarHBondContact CB-O 3.18Å
90	Y	95	Very high	87.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	144.2	172.7	-73.4	-103.8	0	0	0	109.5	Y34 E35 V37 M43 P64 I69 A84 H85 M86	Y34-Y90 WeakPolarHBondContact CA-O 3.27Å; E35-Y90 PolarHBondContact N-O 3.36Å; E35-Y90 PolarHBondContact O-N 2.94Å; V37-Y90 HydrophobicContact CG2-CD2 3.35Å; V37-Y90 HydrophobicContact CG2-CE2 3.44Å; V37-Y90 VanDerWaalsContact CG2-CE2 3.44Å; V37-Y90 HydrophobicContact CG2-CG 4.36Å; M43-Y90 HydrophobicContact CE-CD1 3.54Å; M43-Y90 HydrophobicContact CE-CD2 3.96Å; M43-Y90 HydrophobicContact CE-CE1 3.7Å; M43-Y90 HydrophobicContact CE-CE2 4.11Å; M43-Y90 HydrophobicContact CE-CG 3.68Å; M43-Y90 HydrophobicContact SD-CD1 4.32Å; M43-Y90 HydrophobicContact SD-CD2 4.06Å; M43-Y90 HydrophobicContact SD-CG 3.87Å; P64-Y90 HydrophobicContact CG-CE2 4.17Å; I69-Y90 HydrophobicContact CD1-CD1 3.54Å; I69-Y90 HydrophobicContact CD1-CE1 3.34Å; A84-Y90 VanDerWaalsContact CA-OH 3.3Å; A84-Y90 WeakPolarHBondContact CA-OH 3.41Å; A84-Y90 HydrophobicContact CB-CE2 3.82Å; H85-Y90 AromaticContact CE1-CE1 3.94Å; H85-Y90 PolarHBondContact CE1-OH 2.83Å; H85-Y90 PolarHBondContact N-OH 2.86Å; H85-Y90 AromaticContact ND1-CE1 3.75Å; H85-Y90 AromaticContact ND1-CZ 3.72Å; H85-Y90 PolarHBondContact ND1-OH 2.86Å; M86-Y90 PolarHBondContact N-OH 2.82Å; M86-Y90 WeakPolarHBondContact O-CE2 3.29Å; M86-Y90 PolarHBondContact O-OH 3.43Å
91	K	95.4	Very high	87.1	Confident	54 Å²	54	52.1 Å²	52.1	24%	0.235	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	125.8	-175.9	-175.2	-175	67.2	158.4	0	109.7	C32 F33 Y34 I61 T62 C93	C32-K91 HydrophobicContact CB-CD 4.29Å; C32-K91 HydrophobicContact CB-CG 4.09Å; F33-K91 CarbonylContact O-C 3.58Å; F33-K91 WeakPolarHBondContact O-CA 3.46Å; Y34-K91 HydrophobicContact CD1-CB 4.02Å; Y34-K91 HydrophobicContact CD1-CG 3.97Å; Y34-K91 HydrophobicContact CE1-CB 3.93Å; Y34-K91 HydrophobicContact CE1-CD 3.66Å; Y34-K91 HydrophobicContact CE1-CG 3.51Å; I61-K91 CarbonylContact C-O 3.57Å; I61-K91 WeakPolarHBondContact CA-O 2.99Å; T62-K91 PolarHBondContact N-O 2.76Å; T62-K91 PolarHBondContact O-N 2.93Å; T62-K91 VanDerWaalsContact OG1-CE 3.31Å; T62-K91 WeakPolarHBondContact OG1-CE 3.16Å; K91-C93 WeakPolarHBondContact CD-SG 3.42Å; K91-C93 WeakPolarHBondContact CE-SG 3.15Å; K91-C93 VanDerWaalsContact CG-SG 3.53Å
92	F	95.5	Very high	86.9	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.009	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	112.1	176.3	-58.8	-95.5	0	0	0	108.5	C32 F33 E35 M43 L45 I61 I110	C32-F92 CarbonylContact C-O 3.53Å; C32-F92 VanDerWaalsContact CA-O 3.3Å; C32-F92 WeakPolarHBondContact CA-O 3.37Å; F33-F92 PolarHBondContact N-O 3.37Å; F33-F92 PolarHBondContact O-N 2.95Å; E35-F92 HydrophobicContact CB-CE2 4.27Å; M43-F92 HydrophobicContact CB-CZ 4.39Å; M43-F92 HydrophobicContact SD-CZ 4.12Å; L45-F92 HydrophobicContact CB-CD1 4.3Å; L45-F92 HydrophobicContact CB-CE1 4.27Å; L45-F92 HydrophobicContact CD1-CD1 4.29Å; L45-F92 HydrophobicContact CD2-CD1 4.17Å; L45-F92 HydrophobicContact CG-CD1 4.48Å; I61-F92 HydrophobicContact CB-CD1 4.49Å; I61-F92 HydrophobicContact CD1-CD1 3.96Å; I61-F92 HydrophobicContact CD1-CE1 3.94Å; I61-F92 HydrophobicContact CG1-CD1 3.81Å; I61-F92 HydrophobicContact CG1-CE1 4.18Å; I61-F92 HydrophobicContact CG2-CD1 4.04Å; I61-F92 HydrophobicContact CG2-CE1 3.89Å; I61-F92 HydrophobicContact CG2-CZ 4.45Å; F92-I110 HydrophobicContact CB-CD1 4.31Å; F92-I110 HydrophobicContact CD2-CD1 4Å; F92-I110 HydrophobicContact CE2-CG2 4.22Å; F92-I110 HydrophobicContact CG-CD1 4.13Å; F92-I110 HydrophobicContact CZ-CG2 4.26Å
93	C	95.3	Very high	86.9	Confident	4 Å²	4	52 Å²	52	3%	0.027	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	140.4	-176.2	-63.9	0	0	0	0	112	E31 C32 V59 E60 K91	E31-C93 CarbonylContact O-C 3.52Å; E31-C93 WeakPolarHBondContact O-CA 3.3Å; C32-C93 HydrophobicContact CB-CB 4.18Å; C32-C93 WeakPolarHBondContact CB-SG 3.22Å; C32-C93 WeakPolarHBondContact SG-CB 3.48Å; C32-C93 CovalentContact SG-SG 2.04Å; C32-C93 PolarHBondContact SG-SG 3.41Å; V59-C93 WeakPolarHBondContact CA-O 3.27Å; E60-C93 PolarHBondContact N-O 3.02Å; E60-C93 PolarHBondContact O-N 2.76Å; K91-C93 WeakPolarHBondContact CD-SG 3.42Å; K91-C93 WeakPolarHBondContact CE-SG 3.15Å; K91-C93 VanDerWaalsContact CG-SG 3.53Å
94	F	95.1	Very high	87	Confident	1 Å²	1	49.5 Å²	49.5	0%	0.004	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	121.7	170.5	-60.5	-80.3	0	0	0	109	I25 E30 E31 F33 L45 F47 I57 D58 V59 V106 F108	I25-F94 HydrophobicContact CD1-CB 4.04Å; I25-F94 HydrophobicContact CG1-CB 4.18Å; E30-F94 CarbonylContact C-O 3.48Å; E30-F94 VanDerWaalsContact CA-O 3.27Å; E30-F94 WeakPolarHBondContact CA-O 3.4Å; E31-F94 PolarHBondContact N-O 2.79Å; E31-F94 PolarHBondContact O-N 3.41Å; F33-F94 HydrophobicContact CD2-CD2 4.19Å; F33-F94 HydrophobicContact CD2-CE2 4.07Å; F33-F94 HydrophobicContact CE2-CD2 4Å; F33-F94 HydrophobicContact CE2-CE2 4.09Å; L45-F94 HydrophobicContact CD1-CZ 4.14Å; F47-F94 HydrophobicContact CB-CE1 3.86Å; F47-F94 HydrophobicContact CB-CZ 4.14Å; F47-F94 HydrophobicContact CD1-CE1 4.35Å; F47-F94 HydrophobicContact CD2-CE1 4.35Å; F47-F94 AromaticContact CG-CE1 3.93Å; F47-F94 HydrophobicContact CG-CE1 3.93Å; I57-F94 HydrophobicContact CG1-CB 4.18Å; I57-F94 HydrophobicContact CG1-CD1 4.48Å; I57-F94 HydrophobicContact CG2-CD1 4.4Å; D58-F94 CarbonylContact O-C 3.59Å; D58-F94 WeakPolarHBondContact O-CA 3.29Å; V59-F94 HydrophobicContact CG1-CE1 4.27Å; V59-F94 HydrophobicContact CG2-CD1 3.82Å; V59-F94 HydrophobicContact CG2-CE1 3.94Å; F94-V106 HydrophobicContact CD1-CG1 4.16Å; F94-V106 HydrophobicContact CE1-CG1 4.03Å; F94-V106 HydrophobicContact CZ-CG1 4.44Å; F94-F108 HydrophobicContact CE2-CB 4.28Å; F94-F108 HydrophobicContact CE2-CD1 4.1Å; F94-F108 HydrophobicContact CE2-CD2 4.11Å; F94-F108 AromaticContact CE2-CG 3.88Å; F94-F108 HydrophobicContact CE2-CG 3.88Å; F94-F108 HydrophobicContact CZ-CB 3.8Å; F94-F108 HydrophobicContact CZ-CD1 4.43Å; F94-F108 HydrophobicContact CZ-CD2 4.3Å; F94-F108 AromaticContact CZ-CG 3.92Å; F94-F108 HydrophobicContact CZ-CG 3.92Å
95	S	93.4	Very high	87	Confident	16 Å²	16	51.9 Å²	51.9	11%	0.112	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	130.6	-173.5	157.3	0	0	0	0	111.5	I57 D58 K97	I57-S95 WeakPolarHBondContact CD1-O 3.42Å; D58-S95 PolarHBondContact N-O 3.02Å; D58-S95 PolarHBondContact O-N 2.91Å; S95-K97 WeakPolarHBondContact OG-CD 3.21Å; S95-K97 VanDerWaalsContact OG-CG 3.28Å; S95-K97 WeakPolarHBondContact OG-CG 3.33Å; S95-K97 PolarHBondContact OG-N 3.02Å
96	N	91.2	Very high	87.2	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	25%	0.253	C	S	.	.			trans	-110.6	41.5	174.5	-172.1	22.9	0	0	0	111.1	I25 D26 H28 A29 I57 T102 K104	I25-N96 HydrophobicContact CB-CB 4.42Å; I25-N96 HydrophobicContact CG2-CB 3.79Å; I25-N96 PolarHBondContact O-ND2 3.32Å; D26-N96 WeakPolarHBondContact O-CB 3.48Å; D26-N96 PolarHBondContact O-ND2 2.82Å; H28-N96 WeakPolarHBondContact CA-O 3.49Å; H28-N96 PolarHBondContact N-O 3.13Å; A29-N96 PolarHBondContact O-N 2.82Å; I57-N96 HydrophobicContact CD1-CB 4.1Å; N96-T102 PolarHBondContact ND2-O 2.88Å; N96-K104 HydrophobicContact CB-CD 4.43Å; N96-K104 WeakPolarHBondContact OD1-CD 3.44Å; N96-K104 VanDerWaalsContact OD1-CE 3.31Å; N96-K104 WeakPolarHBondContact OD1-CE 3.39Å; N96-K104 PolarHBondContact OD1-NZ 3.39Å
97	K	80.1	Confident	87.3	Confident	112 Å²	112	47.4 Å²	47.4	49%	0.487	25%	0.251	S	S	.	.	S	Bend	trans	-72	-29.4	-175.4	-75.2	173.9	-171.3	167	0	114.4	E30 S95	E30-K97 VanDerWaalsContact OE2-CE 3.26Å; E30-K97 WeakPolarHBondContact OE2-CE 3.42Å; E30-K97 IonicContact OE2-NZ 2.95Å; E30-K97 PolarHBondContact OE2-NZ 2.78Å; S95-K97 WeakPolarHBondContact OG-CD 3.21Å; S95-K97 VanDerWaalsContact OG-CG 3.28Å; S95-K97 WeakPolarHBondContact OG-CG 3.33Å; S95-K97 PolarHBondContact OG-N 3.02Å
98	M	66.5	Low	87.3	Confident	166 Å²	166	43.2 Å²	43.2	82%	0.818	23%	0.228	S	C	*	.	S	Bend	trans	-108.2	-22.7	-165	-152.4	106.2	-167.5	0	0	115.4
99	S	60.7	Low	87.2	Confident	23 Å²	23	46 Å²	46	16%	0.161	24%	0.243	C	C	.	.	S	Bend	trans	-120.2	-13.2	-150.7	-67.5	0	0	0	0	118.3
100	T	63.2	Low	87	Confident	30 Å²	30	45.1 Å²	45.1	18%	0.184	24%	0.236	C	C	.	.			trans	-164.3	147	-177.8	-2.9	0	0	0	0	116.5	A27 T102 K104	A27-T100 VanDerWaalsContact CB-O 3.22Å; A27-T100 WeakPolarHBondContact CB-O 3.2Å; T100-T102 WeakPolarHBondContact CG2-OG1 3.3Å; T100-T102 PolarHBondContact O-N 2.84Å; T100-K104 WeakPolarHBondContact OG1-CE 3.15Å
101	M	78.3	Confident	86.8	Confident	173 Å²	173	48.8 Å²	48.8	85%	0.852	26%	0.256	S	S	*	.	S	Bend	trans	-72.3	-9.6	168.7	-71.1	-69.8	-178.3	0	0	113.6
102	T	84.9	Confident	86.4	Confident	66 Å²	66	50 Å²	50	41%	0.405	26%	0.264	S	S	.	.	S	Bend	trans	-104.6	150.2	180	57.8	0	0	0	0	111	N96 T100	N96-T102 PolarHBondContact ND2-O 2.88Å; T100-T102 WeakPolarHBondContact CG2-OG1 3.3Å; T100-T102 PolarHBondContact O-N 2.84Å
103	P	88.4	Confident	85.7	Confident	65 Å²	65	51.7 Å²	51.7	42%	0.422	28%	0.282	S	S	.	.			trans	-62.6	152.9	170.1	28.1	-34.5	0	0	0	110.8	I25	I25-P103 CarbonylContact O-C 3.53Å; I25-P103 VanDerWaalsContact O-CA 3.25Å; I25-P103 WeakPolarHBondContact O-CA 3.33Å
104	K	91.3	Very high	84.7	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.009	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	138	174.7	-71.5	-179.3	173.2	173.3	0	110.1	S24 I25 E51 D56 I57 N96 T100	S24-K104 CarbonylContact C-O 3.59Å; S24-K104 WeakPolarHBondContact CA-O 3.48Å; I25-K104 PolarHBondContact N-O 3.28Å; I25-K104 PolarHBondContact O-N 2.84Å; E51-K104 CarbonylContact O-C 3.47Å; E51-K104 WeakPolarHBondContact O-CA 3.5Å; D56-K104 WeakPolarHBondContact O-CD 3.11Å; D56-K104 WeakPolarHBondContact O-CE 3.18Å; D56-K104 PolarHBondContact O-NZ 3.5Å; D56-K104 IonicContact OD1-NZ 3.34Å; D56-K104 PolarHBondContact OD1-NZ 3.28Å; I57-K104 HydrophobicContact CD1-CD 3.8Å; N96-K104 HydrophobicContact CB-CD 4.43Å; N96-K104 WeakPolarHBondContact OD1-CD 3.44Å; N96-K104 VanDerWaalsContact OD1-CE 3.31Å; N96-K104 WeakPolarHBondContact OD1-CE 3.39Å; N96-K104 PolarHBondContact OD1-NZ 3.39Å; T100-K104 WeakPolarHBondContact OG1-CE 3.15Å
105	I	91.6	Very high	83.2	Confident	55 Å²	55	61.3 Å²	61.3	28%	0.282	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	118	176.8	-56.1	-179.7	0	0	0	108	F22 V23 A50 E51	F22-I105 HydrophobicContact CB-CG2 4.24Å; F22-I105 HydrophobicContact CD1-CG2 4Å; V23-I105 WeakPolarHBondContact O-CA 3.48Å; A50-I105 HydrophobicContact CB-CB 4.47Å; A50-I105 HydrophobicContact CB-CG2 4.22Å; A50-I105 PolarHBondContact N-O 2.81Å; E51-I105 HydrophobicContact CB-CB 4.2Å; E51-I105 HydrophobicContact CB-CD1 4.2Å; E51-I105 HydrophobicContact CB-CG1 4.32Å; E51-I105 PolarHBondContact N-O 3.23Å; E51-I105 PolarHBondContact O-N 3.44Å
106	V	93.6	Very high	81.6	Confident	0 Å²	0	65 Å²	65	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	126.7	179.2	-177	0	0	0	0	109.2	F22 V23 I25 F47 V49 I57 F94	F22-V106 WeakPolarHBondContact CA-O 3.26Å; V23-V106 HydrophobicContact CG1-CB 4.14Å; V23-V106 PolarHBondContact N-O 2.75Å; V23-V106 PolarHBondContact O-N 3.21Å; I25-V106 HydrophobicContact CD1-CB 4.05Å; I25-V106 HydrophobicContact CD1-CG2 3.58Å; F47-V106 HydrophobicContact CB-CG1 4.11Å; F47-V106 HydrophobicContact CD2-CG1 4.46Å; V49-V106 HydrophobicContact CG2-CG2 4.33Å; I57-V106 HydrophobicContact CB-CG2 4.43Å; I57-V106 HydrophobicContact CG1-CG2 4.22Å; I57-V106 HydrophobicContact CG2-CG2 4.41Å; F94-V106 HydrophobicContact CD1-CG1 4.16Å; F94-V106 HydrophobicContact CE1-CG1 4.03Å; F94-V106 HydrophobicContact CZ-CG1 4.44Å
107	M	93	Very high	79.8	Confident	64 Å²	64	73.9 Å²	73.9	32%	0.315	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	129.1	168.5	-174.6	173.7	58.9	0	0	108.4	Y21 F22 F47 E48	Y21-M107 WeakPolarHBondContact O-CA 3.35Å; F22-M107 HydrophobicContact CD1-CB 3.83Å; F22-M107 HydrophobicContact CD1-CG 4.22Å; F22-M107 HydrophobicContact CE1-CB 3.66Å; F22-M107 HydrophobicContact CE1-CG 3.81Å; F22-M107 HydrophobicContact CE1-SD 3.81Å; F22-M107 HydrophobicContact CZ-CB 4.45Å; F22-M107 HydrophobicContact CZ-CG 4.11Å; F22-M107 HydrophobicContact CZ-SD 3.74Å; F47-M107 CarbonylContact C-O 3.55Å; F47-M107 WeakPolarHBondContact CA-O 3.24Å; E48-M107 HydrophobicContact CB-CE 4.34Å; E48-M107 PolarHBondContact N-O 2.91Å; E48-M107 PolarHBondContact O-N 3.42Å
108	F	93.3	Very high	78.5	Confident	14 Å²	14	72.3 Å²	72.3	6%	0.061	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	158.3	179.5	74.1	-79	0	0	0	113.3	Y21 V23 F33 M46 F47 F94 I110	Y21-F108 PolarHBondContact O-N 3.24Å; V23-F108 HydrophobicContact CB-CE1 4.01Å; V23-F108 HydrophobicContact CG1-CD1 3.85Å; V23-F108 HydrophobicContact CG1-CE1 3.65Å; F33-F108 HydrophobicContact CD1-CE2 4.26Å; F33-F108 AromaticContact CD1-CZ 3.82Å; F33-F108 HydrophobicContact CD1-CZ 3.82Å; F33-F108 HydrophobicContact CD2-CE1 4.36Å; F33-F108 AromaticContact CD2-CE2 3.93Å; F33-F108 HydrophobicContact CD2-CE2 3.93Å; F33-F108 AromaticContact CD2-CZ 3.7Å; F33-F108 HydrophobicContact CD2-CZ 3.7Å; F33-F108 HydrophobicContact CE1-CE1 4.23Å; F33-F108 HydrophobicContact CE1-CE2 4.39Å; F33-F108 AromaticContact CE1-CZ 3.51Å; F33-F108 HydrophobicContact CE1-CZ 3.51Å; F33-F108 AromaticContact CE2-CE1 3.67Å; F33-F108 HydrophobicContact CE2-CE1 3.67Å; F33-F108 HydrophobicContact CE2-CE2 4.06Å; F33-F108 AromaticContact CE2-CZ 3.38Å; F33-F108 HydrophobicContact CE2-CZ 3.38Å; F33-F108 HydrophobicContact CG-CE2 4.04Å; F33-F108 AromaticContact CG-CZ 3.91Å; F33-F108 HydrophobicContact CG-CZ 3.91Å; F33-F108 AromaticContact CZ-CE1 3.6Å; F33-F108 HydrophobicContact CZ-CE1 3.6Å; F33-F108 HydrophobicContact CZ-CE2 4.3Å; F33-F108 AromaticContact CZ-CZ 3.29Å; F33-F108 HydrophobicContact CZ-CZ 3.29Å; M46-F108 CarbonylContact O-C 3.5Å; M46-F108 WeakPolarHBondContact O-CA 3.43Å; M46-F108 WeakPolarHBondContact O-CB 3.4Å; F47-F108 HydrophobicContact CB-CB 3.92Å; F94-F108 HydrophobicContact CE2-CB 4.28Å; F94-F108 HydrophobicContact CE2-CD1 4.1Å; F94-F108 HydrophobicContact CE2-CD2 4.11Å; F94-F108 AromaticContact CE2-CG 3.88Å; F94-F108 HydrophobicContact CE2-CG 3.88Å; F94-F108 HydrophobicContact CZ-CB 3.8Å; F94-F108 HydrophobicContact CZ-CD1 4.43Å; F94-F108 HydrophobicContact CZ-CD2 4.3Å; F94-F108 AromaticContact CZ-CG 3.92Å; F94-F108 HydrophobicContact CZ-CG 3.92Å; F108-I110 HydrophobicContact CD2-CD1 4.23Å; F108-I110 HydrophobicContact CD2-CG1 3.98Å; F108-I110 HydrophobicContact CE2-CD1 3.91Å; F108-I110 HydrophobicContact CE2-CG1 4.09Å
109	T	90.9	Very high	77.5	Confident	64 Å²	64	73.6 Å²	73.6	39%	0.393	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	134.5	174.5	-54.4	0	0	0	0	108.9	M46	M46-T109 PolarHBondContact N-O 3.14Å; M46-T109 PolarHBondContact O-N 2.91Å
110	I	91	Very high	76.8	Confident	35 Å²	35	79.5 Å²	79.5	18%	0.179	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	115	173.5	-55.8	173.6	0	0	0	107.7	F33 E35 G44 L45 F92 F108	F33-I110 HydrophobicContact CB-CD1 3.97Å; E35-I110 HydrophobicContact CG-CG2 4.14Å; G44-I110 CarbonylContact O-C 3.59Å; G44-I110 VanDerWaalsContact O-CA 3.3Å; G44-I110 WeakPolarHBondContact O-CA 3.22Å; L45-I110 HydrophobicContact CD1-CG1 3.91Å; F92-I110 HydrophobicContact CB-CD1 4.31Å; F92-I110 HydrophobicContact CD2-CD1 4Å; F92-I110 HydrophobicContact CE2-CG2 4.22Å; F92-I110 HydrophobicContact CG-CD1 4.13Å; F92-I110 HydrophobicContact CZ-CG2 4.26Å; F108-I110 HydrophobicContact CD2-CD1 4.23Å; F108-I110 HydrophobicContact CD2-CG1 3.98Å; F108-I110 HydrophobicContact CE2-CD1 3.91Å; F108-I110 HydrophobicContact CE2-CG1 4.09Å
111	D	89.4	Confident	75.9	Confident	77 Å²	77	85.5 Å²	85.5	41%	0.412	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	129.7	179.5	-66	-47.4	0	0	0	110	M43 G44	M43-D111 CarbonylContact C-O 3.54Å; M43-D111 WeakPolarHBondContact CA-O 3.4Å; G44-D111 PolarHBondContact N-O 3.37Å; G44-D111 PolarHBondContact O-N 3.3Å
112	I	88.1	Confident	74.4	Confident	80 Å²	80	87.1 Å²	87.1	41%	0.41	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	119.3	177.5	-56	174.1	0	0	0	108.7	E35 V37 T41	E35-I112 HydrophobicContact CB-CD1 4.04Å; E35-I112 HydrophobicContact CG-CD1 3.88Å; E35-I112 WeakPolarHBondContact OE2-CD1 3.36Å; V37-I112 HydrophobicContact CG1-CD1 4.2Å; V37-I112 HydrophobicContact CG1-CG1 4.45Å; V37-I112 HydrophobicContact CG1-CG2 3.77Å; T41-I112 HydrophobicContact CG2-CG2 3.63Å
113	G	81.3	Confident	72.6	Confident	38 Å²	38	90.2 Å²	90.2	39%	0.392	50%	0.497	S	S	.	.			trans	-79.4	178.6	176.3	0	0	0	0	0	113.6	T41 K42	T41-G113 WeakPolarHBondContact CG2-O 3.26Å; K42-G113 WeakPolarHBondContact O-CA 3.33Å; K42-G113 PolarHBondContact O-N 3.35Å
114	E	73.5	Confident	70.7	Confident	170 Å²	170	92 Å²	92	79%	0.794	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-85.8	142.5	178.4	-156.5	170.2	175.3	0	0	111.5
115	A	62.6	Low	68.9	Low	36 Å²	36	96 Å²	96	30%	0.298	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-77.3	141	179.2	0	0	0	0	0	111.5	N38 T41 K117	N38-A115 HydrophobicContact CB-CB 4.5Å; T41-A115 WeakPolarHBondContact OG1-CB 3.39Å; A115-K117 PolarHBondContact O-N 3.3Å
116	P	61.2	Low	66.8	Low	95 Å²	95	101.6 Å²	101.6	62%	0.617	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-66.9	125.8	176	26	-31.1	0	0	0	110.8
117	K	53.5	Low	64.9	Low	186 Å²	186	108.5 Å²	108.5	81%	0.809	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-79.1	119.1	172	-69.8	178.5	-178.3	168.4	0	108.8	A115	A115-K117 PolarHBondContact O-N 3.3Å
118	G	52.5	Low	63.4	Low	79 Å²	79	108.1 Å²	108.1	81%	0.814	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-65.5	130.6	177.9	0	0	0	0	0	112
119	Q	44.3	Very low	62.2	Low	193 Å²	193	113.8 Å²	113.8	90%	0.902	61%	0.614	S	S	*	*			trans	-120.5	116.5	162.6	-86.1	-177.9	-29.2	0	0	108.7
120	D	46.9	Very low	61.5	Low	147 Å²	147	115.7 Å²	115.7	79%	0.786	62%	0.621	S	S	*	*			trans	-69.4	141.9	166.5	-59.7	-52.2	0	0	0	110.2
121	M	44.1	Very low	60.9	Low	156 Å²	156	119 Å²	119	77%	0.768	64%	0.636	S	S	*	*				165.1	125.2	121.8	-90	177.3	-110	0	0	113.3	T123	M121-T123 VanDerWaalsContact C-N 3.32Å; M121-T123 PolarHBondContact O-N 2.93Å
122	E	47.6	Very low	60.5	Low	207 Å²	207	121.5 Å²	121.5	97%	0.967	65%	0.645	S	S	*	*	S	Bend	trans	-77.8	37.2	-170	-63.5	-176.8	120.2	0	0	116
123	T	46.3	Very low	60.1	Low	131 Å²	131	122.8 Å²	122.8	80%	0.804	65%	0.65	S	S	*	*	S	Bend	trans	-122.4	10.7	-174.6	-24.2	0	0	0	0	116.5	M121	M121-T123 VanDerWaalsContact C-N 3.32Å; M121-T123 PolarHBondContact O-N 2.93Å
124	E	49.1	Very low	60.4	Low	102 Å²	102	125.6 Å²	125.6	48%	0.477	66%	0.656	S	S	.	*			trans	-127.9	26.2	-166.8	-72.5	177.3	149.7	0	0	114.7	H126 Q127 N128	E124-H126 PolarHBondContact O-N 2.69Å; E124-Q127 PolarHBondContact O-N 3.47Å; E124-Q127 VanDerWaalsContact O-N 3.07Å; E124-N128 HydrophobicContact CB-CB 4.27Å; E124-N128 VanDerWaalsContact CB-ND2 3.27Å; E124-N128 WeakPolarHBondContact CB-ND2 3.44Å; E124-N128 WeakPolarHBondContact CB-OD1 3.19Å; E124-N128 WeakPolarHBondContact O-CB 3.39Å; E124-N128 PolarHBondContact O-N 3.38Å; E124-N128 PolarHBondContact OE2-OD1 3.48Å
125	A	52.4	Low	61	Low	86 Å²	86	122 Å²	122	71%	0.711	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54	-20.1	-167.5	0	0	0	0	0	117.7
126	H	49	Very low	62.2	Low	174 Å²	174	127 Å²	127	81%	0.806	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	-26.5	176.1	-97.9	-74.9	0	0	0	115	E124	E124-H126 PolarHBondContact O-N 2.69Å
127	Q	53.6	Low	63.6	Low	145 Å²	145	128.4 Å²	128.4	68%	0.678	66%	0.661	S	S	*	*	H	α-helix	trans	-83.7	-37.2	170.8	-66.5	-144.4	-79.6	0	0	110.8	E124 K129 L130 E131	E124-Q127 PolarHBondContact O-N 3.47Å; E124-Q127 VanDerWaalsContact O-N 3.07Å; Q127-K129 VanDerWaalsContact C-N 3.29Å; Q127-K129 PolarHBondContact O-N 2.81Å; Q127-L130 PolarHBondContact O-N 2.97Å; Q127-L130 VanDerWaalsContact O-N 3.14Å; Q127-E131 WeakPolarHBondContact O-CB 3.48Å; Q127-E131 PolarHBondContact O-N 2.97Å
128	N	60.8	Low	65.3	Low	55 Å²	55	121.7 Å²	121.7	29%	0.294	64%	0.64	S	S	.	*	H	α-helix	trans	-56.8	-39.8	172	-77.7	-6	0	0	0	112.5	E124 L130 E131 E132	E124-N128 HydrophobicContact CB-CB 4.27Å; E124-N128 VanDerWaalsContact CB-ND2 3.27Å; E124-N128 WeakPolarHBondContact CB-ND2 3.44Å; E124-N128 WeakPolarHBondContact CB-OD1 3.19Å; E124-N128 WeakPolarHBondContact O-CB 3.39Å; E124-N128 PolarHBondContact O-N 3.38Å; E124-N128 PolarHBondContact OE2-OD1 3.48Å; N128-L130 VanDerWaalsContact C-N 3.27Å; N128-L130 PolarHBondContact O-N 3.32Å; N128-E131 CarbonylContact O-C 3.55Å; N128-E131 PolarHBondContact O-N 2.89Å; N128-E132 WeakPolarHBondContact O-CA 3.32Å; N128-E132 WeakPolarHBondContact O-CB 3.4Å; N128-E132 PolarHBondContact O-N 2.83Å
129	K	69	Low	67.1	Low	134 Å²	134	122.7 Å²	122.7	58%	0.583	63%	0.63	S	S	*	*	H	α-helix	trans	-66.6	-32.9	-178.4	-159.5	171.7	-173.4	176.7	0	112.3	Q127 M133	Q127-K129 VanDerWaalsContact C-N 3.29Å; Q127-K129 PolarHBondContact O-N 2.81Å; K129-M133 VanDerWaalsContact O-CG 3.29Å; K129-M133 WeakPolarHBondContact O-CG 3.33Å; K129-M133 PolarHBondContact O-N 3.43Å
130	L	75	Confident	69.4	Low	103 Å²	103	115.9 Å²	115.9	54%	0.539	61%	0.607	S	S	.	*	H	α-helix	trans	-75.3	-42.4	174	-176.9	64.3	0	0	0	110.9	Q127 N128 E132 M133 I134	Q127-L130 PolarHBondContact O-N 2.97Å; Q127-L130 VanDerWaalsContact O-N 3.14Å; N128-L130 VanDerWaalsContact C-N 3.27Å; N128-L130 PolarHBondContact O-N 3.32Å; L130-E132 VanDerWaalsContact C-N 3.34Å; L130-M133 HydrophobicContact CD1-CE 4.05Å; L130-M133 PolarHBondContact O-N 3.04Å; L130-I134 HydrophobicContact CD1-CD1 4.37Å; L130-I134 HydrophobicContact CG-CD1 3.99Å; L130-I134 WeakPolarHBondContact O-CB 3.23Å; L130-I134 VanDerWaalsContact O-CG1 3.23Å; L130-I134 WeakPolarHBondContact O-CG1 3.23Å; L130-I134 PolarHBondContact O-N 2.99Å
131	E	77.8	Confident	71.5	Confident	104 Å²	104	115.6 Å²	115.6	49%	0.486	60%	0.602	S	S	.	*	H	α-helix	trans	-67.7	-34	178.9	-164.1	157	-170.8	0	0	112.4	Q127 N128 I134 N135	Q127-E131 WeakPolarHBondContact O-CB 3.48Å; Q127-E131 PolarHBondContact O-N 2.97Å; N128-E131 CarbonylContact O-C 3.55Å; N128-E131 PolarHBondContact O-N 2.89Å; E131-I134 PolarHBondContact O-N 3.41Å; E131-N135 VanDerWaalsContact O-CB 3.26Å; E131-N135 WeakPolarHBondContact O-CB 3.46Å; E131-N135 VanDerWaalsContact O-CG 3.29Å; E131-N135 PolarHBondContact O-N 2.99Å; E131-N135 PolarHBondContact O-ND2 2.92Å; E131-N135 VanDerWaalsContact O-ND2 3.13Å
132	E	80.9	Confident	73.8	Confident	131 Å²	131	112.6 Å²	112.6	61%	0.612	59%	0.593	S	S	*	*	H	α-helix	trans	-66.8	-46.7	172.5	-175.9	176.4	-165.4	0	0	110.7	N128 L130 I134 N135 E136	N128-E132 WeakPolarHBondContact O-CA 3.32Å; N128-E132 WeakPolarHBondContact O-CB 3.4Å; N128-E132 PolarHBondContact O-N 2.83Å; L130-E132 VanDerWaalsContact C-N 3.34Å; E132-I134 VanDerWaalsContact C-N 3.32Å; E132-I134 PolarHBondContact O-N 3.45Å; E132-N135 PolarHBondContact O-N 3.23Å; E132-E136 WeakPolarHBondContact O-CB 3.49Å; E132-E136 PolarHBondContact O-N 3.49Å
133	M	81.8	Confident	75.9	Confident	106 Å²	106	105.6 Å²	105.6	52%	0.522	57%	0.571	S	S	.	*	H	α-helix	trans	-63.5	-37.5	173.6	-74.1	-171.3	-56.1	0	0	112.4	K129 L130 L137	K129-M133 VanDerWaalsContact O-CG 3.29Å; K129-M133 WeakPolarHBondContact O-CG 3.33Å; K129-M133 PolarHBondContact O-N 3.43Å; L130-M133 HydrophobicContact CD1-CE 4.05Å; L130-M133 PolarHBondContact O-N 3.04Å; M133-L137 VanDerWaalsContact O-CB 3.32Å; M133-L137 WeakPolarHBondContact O-CB 3.26Å; M133-L137 PolarHBondContact O-N 3.43Å
134	I	86.9	Confident	78.2	Confident	98 Å²	98	103.4 Å²	103.4	50%	0.503	56%	0.557	S	S	.	*	H	α-helix	trans	-67.1	-42.5	175.8	-71.9	167.3	0	0	0	110.4	L130 E131 E132 L137 A138	L130-I134 HydrophobicContact CD1-CD1 4.37Å; L130-I134 HydrophobicContact CG-CD1 3.99Å; L130-I134 WeakPolarHBondContact O-CB 3.23Å; L130-I134 VanDerWaalsContact O-CG1 3.23Å; L130-I134 WeakPolarHBondContact O-CG1 3.23Å; L130-I134 PolarHBondContact O-N 2.99Å; E131-I134 PolarHBondContact O-N 3.41Å; E132-I134 VanDerWaalsContact C-N 3.32Å; E132-I134 PolarHBondContact O-N 3.45Å; I134-L137 PolarHBondContact O-N 3.47Å; I134-A138 VanDerWaalsContact O-CB 3.26Å; I134-A138 WeakPolarHBondContact O-CB 3.48Å; I134-A138 PolarHBondContact O-N 3.2Å
135	N	86.2	Confident	80.2	Confident	95 Å²	95	104.3 Å²	104.3	51%	0.508	56%	0.559	S	S	.	*	H	α-helix	trans	-67.1	-40.9	176.7	-81.4	-37.4	0	0	0	111.7	E131 E132 L137 A138 V139	E131-N135 VanDerWaalsContact O-CB 3.26Å; E131-N135 WeakPolarHBondContact O-CB 3.46Å; E131-N135 VanDerWaalsContact O-CG 3.29Å; E131-N135 PolarHBondContact O-N 2.99Å; E131-N135 PolarHBondContact O-ND2 2.92Å; E131-N135 VanDerWaalsContact O-ND2 3.13Å; E132-N135 PolarHBondContact O-N 3.23Å; N135-L137 PolarHBondContact O-N 3.44Å; N135-A138 PolarHBondContact O-N 3.31Å; N135-V139 WeakPolarHBondContact O-CB 3.45Å; N135-V139 VanDerWaalsContact O-CG2 3.22Å; N135-V139 WeakPolarHBondContact O-CG2 3.34Å; N135-V139 PolarHBondContact O-N 3.4Å
136	E	88.3	Confident	82.1	Confident	141 Å²	141	106.5 Å²	106.5	66%	0.659	56%	0.555	S	S	*	*	H	α-helix	trans	-61.2	-45.3	174.8	-170	-177.2	178.6	0	0	110.9	E132 V139 A140	E132-E136 WeakPolarHBondContact O-CB 3.49Å; E132-E136 PolarHBondContact O-N 3.49Å; E136-V139 PolarHBondContact O-N 2.91Å; E136-A140 WeakPolarHBondContact O-CB 3.42Å; E136-A140 PolarHBondContact O-N 3.38Å
137	L	88.8	Confident	84.2	Confident	123 Å²	123	103.6 Å²	103.6	64%	0.644	54%	0.541	S	S	*	.	H	α-helix	trans	-64.6	-41	175.4	-175.4	66.6	0	0	0	112	M133 I134 N135 A140 M141	M133-L137 VanDerWaalsContact O-CB 3.32Å; M133-L137 WeakPolarHBondContact O-CB 3.26Å; M133-L137 PolarHBondContact O-N 3.43Å; I134-L137 PolarHBondContact O-N 3.47Å; N135-L137 PolarHBondContact O-N 3.44Å; L137-A140 PolarHBondContact O-N 3.31Å; L137-M141 VanDerWaalsContact O-CB 3.23Å; L137-M141 WeakPolarHBondContact O-CB 3.32Å; L137-M141 PolarHBondContact O-N 3.47Å
138	A	90.8	Very high	85.9	Confident	45 Å²	45	102.6 Å²	102.6	37%	0.372	54%	0.536	S	S	.	.	H	α-helix	trans	-64.7	-40.9	177.7	0	0	0	0	0	111.5	I134 N135 M141 T142	I134-A138 VanDerWaalsContact O-CB 3.26Å; I134-A138 WeakPolarHBondContact O-CB 3.48Å; I134-A138 PolarHBondContact O-N 3.2Å; N135-A138 PolarHBondContact O-N 3.31Å; A138-M141 PolarHBondContact O-N 3.41Å; A138-T142 WeakPolarHBondContact O-CB 3.41Å; A138-T142 PolarHBondContact O-N 2.91Å; A138-T142 PolarHBondContact O-OG1 2.92Å
139	V	89.9	Confident	87.5	Confident	100 Å²	100	104.4 Å²	104.4	61%	0.606	54%	0.543	S	S	*	.	H	α-helix	trans	-65	-46.3	174.7	170.2	0	0	0	0	110.5	N135 E136 M141 T142 A143	N135-V139 WeakPolarHBondContact O-CB 3.45Å; N135-V139 VanDerWaalsContact O-CG2 3.22Å; N135-V139 WeakPolarHBondContact O-CG2 3.34Å; N135-V139 PolarHBondContact O-N 3.4Å; E136-V139 PolarHBondContact O-N 2.91Å; V139-M141 PolarHBondContact O-N 2.88Å; V139-T142 PolarHBondContact O-N 3.42Å; V139-A143 PolarHBondContact O-N 3.4Å
140	A	91.4	Very high	88.5	Confident	50 Å²	50	104.4 Å²	104.4	41%	0.413	54%	0.541	S	S	.	.	H	α-helix	trans	-61.8	-42.6	176.8	0	0	0	0	0	112.1	E136 L137 A143 V144	E136-A140 WeakPolarHBondContact O-CB 3.42Å; E136-A140 PolarHBondContact O-N 3.38Å; L137-A140 PolarHBondContact O-N 3.31Å; A140-A143 WeakPolarHBondContact O-CB 3.46Å; A140-A143 PolarHBondContact O-N 3.4Å; A140-V144 WeakPolarHBondContact O-CG2 3.44Å; A140-V144 PolarHBondContact O-N 3.01Å
141	M	92.4	Very high	89.2	Confident	141 Å²	141	104.4 Å²	104.4	70%	0.695	54%	0.539	S	S	*	.	H	α-helix	trans	-67.3	-38	178	-173.3	166.7	-176.7	0	0	112	L137 A138 V139 A143 V144 K145	L137-M141 VanDerWaalsContact O-CB 3.23Å; L137-M141 WeakPolarHBondContact O-CB 3.32Å; L137-M141 PolarHBondContact O-N 3.47Å; A138-M141 PolarHBondContact O-N 3.41Å; V139-M141 PolarHBondContact O-N 2.88Å; M141-A143 VanDerWaalsContact C-N 3.34Å; M141-V144 PolarHBondContact O-N 2.95Å; M141-K145 WeakPolarHBondContact O-CB 3.45Å; M141-K145 PolarHBondContact O-N 3.27Å
142	T	91.6	Very high	90	Very high	93 Å²	93	104.8 Å²	104.8	57%	0.571	54%	0.541	S	S	*	.	H	α-helix	trans	-65.4	-39.6	174.6	-55.4	0	0	0	0	110.9	A138 V139 K145 H146	A138-T142 WeakPolarHBondContact O-CB 3.41Å; A138-T142 PolarHBondContact O-N 2.91Å; A138-T142 PolarHBondContact O-OG1 2.92Å; V139-T142 PolarHBondContact O-N 3.42Å; T142-K145 PolarHBondContact O-N 3.18Å; T142-H146 WeakPolarHBondContact O-CB 3.27Å; T142-H146 PolarHBondContact O-N 3.47Å
143	A	91.8	Very high	90.6	Very high	61 Å²	61	101.9 Å²	101.9	50%	0.504	53%	0.532	S	S	.	.	H	α-helix	trans	-62.8	-45.1	174.3	0	0	0	0	0	112	V139 A140 M141 K145 H146 E147	V139-A143 PolarHBondContact O-N 3.4Å; A140-A143 WeakPolarHBondContact O-CB 3.46Å; A140-A143 PolarHBondContact O-N 3.4Å; M141-A143 VanDerWaalsContact C-N 3.34Å; A143-K145 PolarHBondContact O-N 3.05Å; A143-H146 PolarHBondContact O-N 3.24Å; A143-E147 PolarHBondContact O-N 3.44Å
144	V	94.1	Very high	91.2	Very high	85 Å²	85	102.8 Å²	102.8	52%	0.515	53%	0.529	S	S	.	.	H	α-helix	trans	-62.7	-42.5	176.1	171.8	0	0	0	0	111.6	A140 M141 H146 E147 Q148	A140-V144 WeakPolarHBondContact O-CG2 3.44Å; A140-V144 PolarHBondContact O-N 3.01Å; M141-V144 PolarHBondContact O-N 2.95Å; V144-H146 VanDerWaalsContact C-N 3.31Å; V144-H146 PolarHBondContact O-N 3.41Å; V144-E147 PolarHBondContact O-N 2.96Å; V144-Q148 HydrophobicContact CG1-CG 4.49Å; V144-Q148 WeakPolarHBondContact O-CG 3.29Å; V144-Q148 PolarHBondContact O-N 3.4Å
145	K	92.6	Very high	91.5	Very high	121 Å²	121	103.6 Å²	103.6	53%	0.526	53%	0.531	S	S	.	.	H	α-helix	trans	-60.3	-43.7	177.2	-175.5	-177.3	175.9	-171.8	0	111.2	M141 T142 A143 E147 Q148 E149	M141-K145 WeakPolarHBondContact O-CB 3.45Å; M141-K145 PolarHBondContact O-N 3.27Å; T142-K145 PolarHBondContact O-N 3.18Å; A143-K145 PolarHBondContact O-N 3.05Å; K145-E147 VanDerWaalsContact C-N 3.31Å; K145-E147 PolarHBondContact O-N 3.42Å; K145-Q148 PolarHBondContact O-N 3.44Å; K145-E149 VanDerWaalsContact CE-OE1 3.29Å; K145-E149 WeakPolarHBondContact CE-OE1 3.38Å; K145-E149 PolarHBondContact O-N 2.8Å
146	H	92.5	Very high	91.8	Very high	132 Å²	132	106.9 Å²	106.9	61%	0.611	54%	0.536	S	S	*	.	H	α-helix	trans	-62.7	-40.1	177.8	-166.9	60.1	0	0	0	111.8	T142 A143 V144 E149 Y150	T142-H146 WeakPolarHBondContact O-CB 3.27Å; T142-H146 PolarHBondContact O-N 3.47Å; A143-H146 PolarHBondContact O-N 3.24Å; V144-H146 VanDerWaalsContact C-N 3.31Å; V144-H146 PolarHBondContact O-N 3.41Å; H146-E149 PolarHBondContact O-N 3.47Å; H146-Y150 PolarHBondContact O-N 3.37Å
147	E	91.3	Very high	92	Very high	113 Å²	113	104.9 Å²	104.9	53%	0.528	53%	0.529	S	S	.	.	H	α-helix	trans	-66.1	-38.3	176	-162.3	67.6	-168.2	0	0	112.3	A143 V144 K145 Y150 M151	A143-E147 PolarHBondContact O-N 3.44Å; V144-E147 PolarHBondContact O-N 2.96Å; K145-E147 VanDerWaalsContact C-N 3.31Å; K145-E147 PolarHBondContact O-N 3.42Å; E147-Y150 PolarHBondContact O-N 3.29Å; E147-M151 WeakPolarHBondContact O-CB 3.43Å; E147-M151 VanDerWaalsContact O-CG 3.32Å; E147-M151 WeakPolarHBondContact O-CG 3.42Å; E147-M151 PolarHBondContact O-N 2.98Å
148	Q	90.7	Very high	92	Very high	123 Å²	123	104.4 Å²	104.4	58%	0.575	52%	0.523	S	S	*	.	H	α-helix	trans	-64.3	-46.1	174.4	-75.4	-179.2	-21.2	0	0	111.9	V144 K145 Y150 M151 E152	V144-Q148 HydrophobicContact CG1-CG 4.49Å; V144-Q148 WeakPolarHBondContact O-CG 3.29Å; V144-Q148 PolarHBondContact O-N 3.4Å; K145-Q148 PolarHBondContact O-N 3.44Å; Q148-Y150 VanDerWaalsContact C-N 3.29Å; Q148-Y150 PolarHBondContact O-N 2.89Å; Q148-M151 PolarHBondContact O-N 3.38Å; Q148-E152 WeakPolarHBondContact O-CG 3.35Å; Q148-E152 PolarHBondContact O-N 3.15Å
149	E	93.3	Very high	92.2	Very high	93 Å²	93	109.6 Å²	109.6	44%	0.435	53%	0.533	S	S	.	.	H	α-helix	trans	-59.6	-41.4	175.7	-77.7	178.3	-175.2	0	0	111.2	K145 H146 E152 V153	K145-E149 VanDerWaalsContact CE-OE1 3.29Å; K145-E149 WeakPolarHBondContact CE-OE1 3.38Å; K145-E149 PolarHBondContact O-N 2.8Å; H146-E149 PolarHBondContact O-N 3.47Å; E149-E152 PolarHBondContact O-N 3.06Å; E149-V153 WeakPolarHBondContact O-CG2 3.45Å; E149-V153 PolarHBondContact O-N 2.99Å
150	Y	91.4	Very high	92.2	Very high	135 Å²	135	107.1 Å²	107.1	53%	0.529	52%	0.523	S	S	.	.	H	α-helix	trans	-61.5	-46.1	174.2	176.1	-104.1	0	0	0	112.2	H146 E147 Q148 E152 V153 R154	H146-Y150 PolarHBondContact O-N 3.37Å; E147-Y150 PolarHBondContact O-N 3.29Å; Q148-Y150 VanDerWaalsContact C-N 3.29Å; Q148-Y150 PolarHBondContact O-N 2.89Å; Y150-E152 VanDerWaalsContact C-N 3.35Å; Y150-E152 PolarHBondContact O-N 3.2Å; Y150-V153 PolarHBondContact O-N 3.36Å; Y150-R154 WeakPolarHBondContact O-CB 3.49Å; Y150-R154 PolarHBondContact O-N 3.32Å
151	M	88.9	Confident	92	Very high	103 Å²	103	108.7 Å²	108.7	51%	0.507	53%	0.528	S	S	.	.	H	α-helix	trans	-64.1	-37.6	178.4	-74.7	-74.2	-86.4	0	0	112.3	E147 Q148 R154 E155	E147-M151 WeakPolarHBondContact O-CB 3.43Å; E147-M151 VanDerWaalsContact O-CG 3.32Å; E147-M151 WeakPolarHBondContact O-CG 3.42Å; E147-M151 PolarHBondContact O-N 2.98Å; Q148-M151 PolarHBondContact O-N 3.38Å; M151-R154 PolarHBondContact O-N 2.97Å; M151-E155 WeakPolarHBondContact O-CB 3.26Å; M151-E155 PolarHBondContact O-N 2.82Å
152	E	95.6	Very high	91.9	Very high	111 Å²	111	107 Å²	107	52%	0.519	52%	0.521	S	S	.	.	H	α-helix	trans	-66.3	-41.6	174.5	-76.3	-175.1	175	0	0	112.6	Q148 E149 Y150 R154 E155 R156	Q148-E152 WeakPolarHBondContact O-CG 3.35Å; Q148-E152 PolarHBondContact O-N 3.15Å; E149-E152 PolarHBondContact O-N 3.06Å; Y150-E152 VanDerWaalsContact C-N 3.35Å; Y150-E152 PolarHBondContact O-N 3.2Å; E152-R154 VanDerWaalsContact C-N 3.34Å; E152-E155 PolarHBondContact O-N 3.29Å; E152-R156 WeakPolarHBondContact O-CB 3.38Å; E152-R156 WeakPolarHBondContact O-CG 3.35Å; E152-R156 PolarHBondContact O-N 3Å
153	V	93.2	Very high	91.9	Very high	70 Å²	70	106.7 Å²	106.7	42%	0.424	52%	0.516	S	S	.	.	H	α-helix	trans	-63.2	-45.3	175.2	171.2	0	0	0	0	109.9	E149 Y150 R156 I157	E149-V153 WeakPolarHBondContact O-CG2 3.45Å; E149-V153 PolarHBondContact O-N 2.99Å; Y150-V153 PolarHBondContact O-N 3.36Å; V153-R156 PolarHBondContact O-N 3.46Å; V153-I157 HydrophobicContact CG1-CD1 3.98Å; V153-I157 WeakPolarHBondContact O-CG1 3.36Å; V153-I157 PolarHBondContact O-N 3Å
154	R	93.9	Very high	91.4	Very high	126 Å²	126	108.6 Å²	108.6	48%	0.475	52%	0.518	S	S	.	.	H	α-helix	trans	-58.8	-49.7	175	-177.6	178.4	178.2	-177.9	5.2	111.1	Y150 M151 E152 R156 I157 H158	Y150-R154 WeakPolarHBondContact O-CB 3.49Å; Y150-R154 PolarHBondContact O-N 3.32Å; M151-R154 PolarHBondContact O-N 2.97Å; E152-R154 VanDerWaalsContact C-N 3.34Å; R154-R156 VanDerWaalsContact C-N 3.31Å; R154-R156 PolarHBondContact O-N 3.43Å; R154-I157 PolarHBondContact O-N 3.46Å; R154-I157 VanDerWaalsContact O-N 3.15Å; R154-H158 VanDerWaalsContact CG-CD2 3.44Å; R154-H158 WeakPolarHBondContact CG-CD2 3.21Å; R154-H158 PolarHBondContact O-CD2 3.44Å; R154-H158 PolarHBondContact O-N 2.76Å
155	E	93.1	Very high	91	Very high	115 Å²	115	108.1 Å²	108.1	54%	0.537	52%	0.515	S	S	.	.	H	α-helix	trans	-57.8	-44.3	178.8	-170.7	-170.3	157.4	0	0	111.3	M151 E152 I157 H158 R159	M151-E155 WeakPolarHBondContact O-CB 3.26Å; M151-E155 PolarHBondContact O-N 2.82Å; E152-E155 PolarHBondContact O-N 3.29Å; E155-I157 VanDerWaalsContact C-N 3.31Å; E155-I157 PolarHBondContact O-N 2.98Å; E155-H158 PolarHBondContact O-N 3.25Å; E155-R159 VanDerWaalsContact O-CB 3.26Å; E155-R159 WeakPolarHBondContact O-CB 3.27Å; E155-R159 PolarHBondContact O-N 2.81Å; E155-R159 IonicContact OE1-NH2 2.65Å
156	R	92.6	Very high	90.9	Very high	164 Å²	164	106.8 Å²	106.8	62%	0.619	51%	0.514	S	S	*	.	H	α-helix	trans	-58.6	-43.1	177.1	-80.6	-170.4	-80.2	-173.4	-7.2	112.2	E152 V153 R154 A160	E152-R156 WeakPolarHBondContact O-CB 3.38Å; E152-R156 WeakPolarHBondContact O-CG 3.35Å; E152-R156 PolarHBondContact O-N 3Å; V153-R156 PolarHBondContact O-N 3.46Å; R154-R156 VanDerWaalsContact C-N 3.31Å; R154-R156 PolarHBondContact O-N 3.43Å; R156-A160 WeakPolarHBondContact O-CB 3.47Å; R156-A160 PolarHBondContact O-N 3.42Å
157	I	91.4	Very high	90.6	Very high	99 Å²	99	104.2 Å²	104.2	51%	0.508	51%	0.511	S	S	.	.	H	α-helix	trans	-65.7	-49.4	177.3	-65.9	166.5	0	0	0	110.6	V153 R154 E155 R159 A160 V161	V153-I157 HydrophobicContact CG1-CD1 3.98Å; V153-I157 WeakPolarHBondContact O-CG1 3.36Å; V153-I157 PolarHBondContact O-N 3Å; R154-I157 PolarHBondContact O-N 3.46Å; R154-I157 VanDerWaalsContact O-N 3.15Å; E155-I157 VanDerWaalsContact C-N 3.31Å; E155-I157 PolarHBondContact O-N 2.98Å; I157-R159 VanDerWaalsContact C-N 3.32Å; I157-R159 PolarHBondContact O-N 3.21Å; I157-A160 PolarHBondContact O-N 3.04Å; I157-V161 WeakPolarHBondContact O-CG2 3.48Å; I157-V161 PolarHBondContact O-N 3.33Å
158	H	90.4	Very high	90.4	Very high	113 Å²	113	107.2 Å²	107.2	52%	0.523	52%	0.518	S	S	.	.	H	α-helix	trans	-60	-42.4	179.4	-84.4	-84.2	0	0	0	111.8	R154 E155 V161 N162	R154-H158 VanDerWaalsContact CG-CD2 3.44Å; R154-H158 WeakPolarHBondContact CG-CD2 3.21Å; R154-H158 PolarHBondContact O-CD2 3.44Å; R154-H158 PolarHBondContact O-N 2.76Å; E155-H158 PolarHBondContact O-N 3.25Å; H158-V161 PolarHBondContact O-N 2.94Å; H158-N162 WeakPolarHBondContact O-CB 3.34Å; H158-N162 PolarHBondContact O-N 2.85Å
159	R	93.3	Very high	90.5	Very high	153 Å²	153	105.3 Å²	105.3	58%	0.577	51%	0.514	S	S	*	.	H	α-helix	trans	-62.9	-45.2	175.5	-175.5	-178.6	-79.7	-128.4	4.1	111.4	E155 I157 V161 N162 D163	E155-R159 VanDerWaalsContact O-CB 3.26Å; E155-R159 WeakPolarHBondContact O-CB 3.27Å; E155-R159 PolarHBondContact O-N 2.81Å; E155-R159 IonicContact OE1-NH2 2.65Å; I157-R159 VanDerWaalsContact C-N 3.32Å; I157-R159 PolarHBondContact O-N 3.21Å; R159-V161 VanDerWaalsContact C-N 3.35Å; R159-V161 PolarHBondContact O-N 3.08Å; R159-N162 PolarHBondContact O-N 2.85Å; R159-D163 WeakPolarHBondContact O-CB 3.49Å; R159-D163 PolarHBondContact O-N 3.03Å
160	A	90.3	Very high	90.4	Very high	48 Å²	48	105 Å²	105	40%	0.397	52%	0.518	S	S	.	.	H	α-helix	trans	-62.4	-40.2	178.5	0	0	0	0	0	112.6	R156 I157 N164	R156-A160 WeakPolarHBondContact O-CB 3.47Å; R156-A160 PolarHBondContact O-N 3.42Å; I157-A160 PolarHBondContact O-N 3.04Å; A160-N164 WeakPolarHBondContact O-CB 3.49Å; A160-N164 VanDerWaalsContact O-CG 3.28Å; A160-N164 PolarHBondContact O-N 3.43Å; A160-N164 VanDerWaalsContact O-N 3.08Å; A160-N164 PolarHBondContact O-ND2 3.26Å
161	V	88.6	Confident	90.2	Very high	84 Å²	84	104.4 Å²	104.4	51%	0.509	52%	0.524	S	S	.	.	H	α-helix	trans	-64.8	-43.2	174.7	173.5	0	0	0	0	110.9	I157 H158 R159 T165	I157-V161 WeakPolarHBondContact O-CG2 3.48Å; I157-V161 PolarHBondContact O-N 3.33Å; H158-V161 PolarHBondContact O-N 2.94Å; R159-V161 VanDerWaalsContact C-N 3.35Å; R159-V161 PolarHBondContact O-N 3.08Å; V161-T165 WeakPolarHBondContact O-CB 3.25Å; V161-T165 PolarHBondContact O-N 3.26Å; V161-T165 PolarHBondContact O-OG1 2.95Å
162	N	89.6	Confident	90.3	Very high	105 Å²	105	108 Å²	108	56%	0.561	53%	0.532	S	S	*	.	H	α-helix	trans	-63.4	-47	178.5	-171.5	42.3	0	0	0	111.7	H158 R159 N164 T165 N166	H158-N162 WeakPolarHBondContact O-CB 3.34Å; H158-N162 PolarHBondContact O-N 2.85Å; R159-N162 PolarHBondContact O-N 2.85Å; N162-N164 PolarHBondContact O-N 3.42Å; N162-T165 PolarHBondContact O-N 3.49Å; N162-N166 WeakPolarHBondContact O-CB 3.24Å; N162-N166 PolarHBondContact O-N 3.04Å
163	D	91.1	Very high	89.9	Confident	87 Å²	87	105.9 Å²	105.9	47%	0.465	53%	0.529	S	S	.	.	H	α-helix	trans	-62.4	-43.3	179.7	-73.2	-15.5	0	0	0	111.5	R159 N166 S167	R159-D163 WeakPolarHBondContact O-CB 3.49Å; R159-D163 PolarHBondContact O-N 3.03Å; D163-N166 PolarHBondContact O-N 3.46Å; D163-S167 WeakPolarHBondContact O-CB 3.42Å; D163-S167 PolarHBondContact O-N 2.76Å
164	N	81.3	Confident	90	Very high	100 Å²	100	109.4 Å²	109.4	54%	0.535	54%	0.539	S	S	.	.	H	α-helix	trans	-64.7	-40	176.4	-76.7	-20.9	0	0	0	112.4	A160 N162 R168	A160-N164 WeakPolarHBondContact O-CB 3.49Å; A160-N164 VanDerWaalsContact O-CG 3.28Å; A160-N164 PolarHBondContact O-N 3.43Å; A160-N164 VanDerWaalsContact O-N 3.08Å; A160-N164 PolarHBondContact O-ND2 3.26Å; N162-N164 PolarHBondContact O-N 3.42Å; N164-R168 VanDerWaalsContact O-CG 3.25Å; N164-R168 WeakPolarHBondContact O-CG 3.47Å; N164-R168 PolarHBondContact O-N 3.38Å
165	T	86.9	Confident	89.9	Confident	75 Å²	75	109 Å²	109	46%	0.46	54%	0.541	S	S	.	.	H	α-helix	trans	-67.9	-48	177.8	-57.8	0	0	0	0	110.4	V161 N162 S167 R168 V169	V161-T165 WeakPolarHBondContact O-CB 3.25Å; V161-T165 PolarHBondContact O-N 3.26Å; V161-T165 PolarHBondContact O-OG1 2.95Å; N162-T165 PolarHBondContact O-N 3.49Å; T165-S167 PolarHBondContact O-N 2.93Å; T165-R168 PolarHBondContact O-N 3.32Å; T165-V169 HydrophobicContact CG2-CG2 4.35Å; T165-V169 VanDerWaalsContact O-CG2 3.32Å; T165-V169 WeakPolarHBondContact O-CG2 3.37Å; T165-V169 PolarHBondContact O-N 3.4Å
166	N	90	Very high	89.9	Confident	93 Å²	93	109.5 Å²	109.5	50%	0.497	54%	0.543	S	S	.	.	H	α-helix	trans	-57.7	-47.1	178.9	-176.8	44.3	0	0	0	111.4	N162 D163 R168 V169 V170	N162-N166 WeakPolarHBondContact O-CB 3.24Å; N162-N166 PolarHBondContact O-N 3.04Å; D163-N166 PolarHBondContact O-N 3.46Å; N166-R168 PolarHBondContact O-N 2.98Å; N166-V169 PolarHBondContact O-N 3.24Å; N166-V170 WeakPolarHBondContact O-CB 3.32Å; N166-V170 VanDerWaalsContact O-CG2 3.26Å; N166-V170 WeakPolarHBondContact O-CG2 3.37Å; N166-V170 PolarHBondContact O-N 3.03Å
167	S	85.4	Confident	90	Very high	79 Å²	79	104 Å²	104	55%	0.552	53%	0.533	S	S	*	.	H	α-helix	trans	-60.8	-43	178.8	-177.4	0	0	0	0	112.7	D163 T165 V170 L171	D163-S167 WeakPolarHBondContact O-CB 3.42Å; D163-S167 PolarHBondContact O-N 2.76Å; T165-S167 PolarHBondContact O-N 2.93Å; S167-V170 PolarHBondContact O-N 3.44Å; S167-L171 WeakPolarHBondContact O-CB 3.48Å; S167-L171 PolarHBondContact O-N 2.92Å
168	R	88.6	Confident	90.2	Very high	176 Å²	176	104 Å²	104	66%	0.664	53%	0.534	S	S	*	.	H	α-helix	trans	-64.4	-44.7	177.7	-69.8	172	-171.7	-143.8	3.2	111.8	N164 T165 N166 L171 W172	N164-R168 VanDerWaalsContact O-CG 3.25Å; N164-R168 WeakPolarHBondContact O-CG 3.47Å; N164-R168 PolarHBondContact O-N 3.38Å; T165-R168 PolarHBondContact O-N 3.32Å; N166-R168 PolarHBondContact O-N 2.98Å; R168-L171 PolarHBondContact O-N 3.02Å; R168-W172 VanDerWaalsContact O-CD1 3.27Å; R168-W172 PolarHBondContact O-N 3.39Å
169	V	91.6	Very high	90.3	Very high	82 Å²	82	101.6 Å²	101.6	50%	0.497	53%	0.527	S	S	.	.	H	α-helix	trans	-63.7	-42.5	179.4	171.6	0	0	0	0	111.3	T165 N166 W172 S173	T165-V169 HydrophobicContact CG2-CG2 4.35Å; T165-V169 VanDerWaalsContact O-CG2 3.32Å; T165-V169 WeakPolarHBondContact O-CG2 3.37Å; T165-V169 PolarHBondContact O-N 3.4Å; N166-V169 PolarHBondContact O-N 3.24Å; V169-W172 PolarHBondContact O-N 3.41Å; V169-S173 WeakPolarHBondContact O-CB 3.26Å; V169-S173 PolarHBondContact O-N 2.96Å; V169-S173 PolarHBondContact O-OG 3.48Å
170	V	90.5	Very high	90.4	Very high	86 Å²	86	99.1 Å²	99.1	52%	0.521	52%	0.524	S	S	.	.	H	α-helix	trans	-64.4	-43.2	178	170.9	0	0	0	0	111.1	N166 S167 S173 F174	N166-V170 WeakPolarHBondContact O-CB 3.32Å; N166-V170 VanDerWaalsContact O-CG2 3.26Å; N166-V170 WeakPolarHBondContact O-CG2 3.37Å; N166-V170 PolarHBondContact O-N 3.03Å; S167-V170 PolarHBondContact O-N 3.44Å; V170-S173 PolarHBondContact O-N 3.02Å; V170-F174 PolarHBondContact O-N 3.27Å
171	L	88.3	Confident	90.7	Very high	124 Å²	124	100.9 Å²	100.9	65%	0.649	53%	0.53	S	S	*	.	H	α-helix	trans	-63.4	-45.3	178	-174.4	68.1	0	0	0	112	S167 R168 F174 F175	S167-L171 WeakPolarHBondContact O-CB 3.48Å; S167-L171 PolarHBondContact O-N 2.92Å; R168-L171 PolarHBondContact O-N 3.02Å; L171-F174 PolarHBondContact O-N 3.01Å; L171-F175 PolarHBondContact O-N 3.41Å
172	W	91.3	Very high	91	Very high	178 Å²	178	99.5 Å²	99.5	67%	0.674	53%	0.527	S	S	*	.	H	α-helix	trans	-63.1	-42.3	176.6	-86.5	109.9	0	0	0	112.2	R168 V169 F174 F175 E176	R168-W172 VanDerWaalsContact O-CD1 3.27Å; R168-W172 PolarHBondContact O-N 3.39Å; V169-W172 PolarHBondContact O-N 3.41Å; W172-F174 VanDerWaalsContact C-N 3.32Å; W172-F174 PolarHBondContact O-N 3.05Å; W172-F175 HydrophobicContact CE3-CD1 4.1Å; W172-F175 AromaticContact CZ3-CD1 3.99Å; W172-F175 HydrophobicContact CZ3-CD1 3.99Å; W172-F175 HydrophobicContact CZ3-CE1 4.25Å; W172-F175 PolarHBondContact O-N 3.33Å; W172-E176 WeakPolarHBondContact O-CB 3.47Å; W172-E176 PolarHBondContact O-N 3.28Å
173	S	87.4	Confident	91.2	Very high	67 Å²	67	99.8 Å²	99.8	47%	0.469	53%	0.527	S	S	.	.	H	α-helix	trans	-59.7	-41.4	175.5	-59.1	0	0	0	0	112.2	V169 V170 A177	V169-S173 WeakPolarHBondContact O-CB 3.26Å; V169-S173 PolarHBondContact O-N 2.96Å; V169-S173 PolarHBondContact O-OG 3.48Å; V170-S173 PolarHBondContact O-N 3.02Å; S173-A177 WeakPolarHBondContact O-CB 3.47Å; S173-A177 PolarHBondContact O-N 3.4Å; S173-A177 VanDerWaalsContact O-N 3.08Å
174	F	95	Very high	91.4	Very high	144 Å²	144	99 Å²	99	63%	0.632	53%	0.525	S	S	*	.	H	α-helix	trans	-67.8	-42.1	177.4	-175.1	-95.9	0	0	0	112.1	V170 L171 W172 A177 L178	V170-F174 PolarHBondContact O-N 3.27Å; L171-F174 PolarHBondContact O-N 3.01Å; W172-F174 VanDerWaalsContact C-N 3.32Å; W172-F174 PolarHBondContact O-N 3.05Å; F174-A177 PolarHBondContact O-N 3.08Å; F174-L178 HydrophobicContact CE1-CD1 4.37Å; F174-L178 PolarHBondContact O-N 3.35Å
175	F	92.6	Very high	92.1	Very high	117 Å²	117	99.4 Å²	99.4	51%	0.513	53%	0.527	S	S	.	.	H	α-helix	trans	-61.3	-46.3	176.1	176.1	-100.8	0	0	0	111.8	L171 W172 A177 L178 V179	L171-F175 PolarHBondContact O-N 3.41Å; W172-F175 HydrophobicContact CE3-CD1 4.1Å; W172-F175 AromaticContact CZ3-CD1 3.99Å; W172-F175 HydrophobicContact CZ3-CD1 3.99Å; W172-F175 HydrophobicContact CZ3-CE1 4.25Å; W172-F175 PolarHBondContact O-N 3.33Å; F175-A177 PolarHBondContact O-N 2.88Å; F175-L178 WeakPolarHBondContact O-CB 3.41Å; F175-L178 PolarHBondContact O-N 3.17Å; F175-V179 HydrophobicContact CD1-CG2 4.32Å; F175-V179 HydrophobicContact CE1-CG2 3.87Å; F175-V179 HydrophobicContact CE2-CG2 4.23Å; F175-V179 HydrophobicContact CZ-CG2 3.82Å; F175-V179 WeakPolarHBondContact O-CG2 3.48Å; F175-V179 PolarHBondContact O-N 3.36Å
176	E	91.6	Very high	92.4	Very high	125 Å²	125	97.6 Å²	97.6	58%	0.584	52%	0.523	S	S	*	.	H	α-helix	trans	-59.3	-45.8	176.9	-175	179.7	171.1	0	0	111.8	W172 L178 V179 L180	W172-E176 WeakPolarHBondContact O-CB 3.47Å; W172-E176 PolarHBondContact O-N 3.28Å; E176-L178 VanDerWaalsContact C-N 3.3Å; E176-L178 PolarHBondContact O-N 3.49Å; E176-V179 PolarHBondContact O-N 3.19Å; E176-L180 WeakPolarHBondContact O-CG 3.33Å; E176-L180 PolarHBondContact O-N 3.13Å
177	A	94.6	Very high	92.4	Very high	49 Å²	49	98.5 Å²	98.5	41%	0.405	52%	0.524	S	S	.	.	H	α-helix	trans	-58.5	-41.9	176	0	0	0	0	0	112.1	S173 F174 F175 L180 V181	S173-A177 WeakPolarHBondContact O-CB 3.47Å; S173-A177 PolarHBondContact O-N 3.4Å; S173-A177 VanDerWaalsContact O-N 3.08Å; F174-A177 PolarHBondContact O-N 3.08Å; F175-A177 PolarHBondContact O-N 2.88Å; A177-L180 PolarHBondContact O-N 2.97Å; A177-V181 WeakPolarHBondContact O-CG2 3.42Å; A177-V181 PolarHBondContact O-N 2.97Å
178	L	95.3	Very high	92.8	Very high	99 Å²	99	99.1 Å²	99.1	52%	0.518	52%	0.52	S	S	.	.	H	α-helix	trans	-63.7	-42.2	177	-167.1	155.6	0	0	0	111.5	F174 F175 E176 V181 A182	F174-L178 HydrophobicContact CE1-CD1 4.37Å; F174-L178 PolarHBondContact O-N 3.35Å; F175-L178 WeakPolarHBondContact O-CB 3.41Å; F175-L178 PolarHBondContact O-N 3.17Å; E176-L178 VanDerWaalsContact C-N 3.3Å; E176-L178 PolarHBondContact O-N 3.49Å; L178-V181 PolarHBondContact O-N 3Å; L178-A182 WeakPolarHBondContact O-CB 3.36Å; L178-A182 PolarHBondContact O-N 3.36Å
179	V	94	Very high	93	Very high	62 Å²	62	97.4 Å²	97.4	38%	0.376	52%	0.515	S	S	.	.	H	α-helix	trans	-61.8	-43.1	176.3	172.2	0	0	0	0	111.3	F175 E176 V181 A182 M183	F175-V179 HydrophobicContact CD1-CG2 4.32Å; F175-V179 HydrophobicContact CE1-CG2 3.87Å; F175-V179 HydrophobicContact CE2-CG2 4.23Å; F175-V179 HydrophobicContact CZ-CG2 3.82Å; F175-V179 WeakPolarHBondContact O-CG2 3.48Å; F175-V179 PolarHBondContact O-N 3.36Å; E176-V179 PolarHBondContact O-N 3.19Å; V179-V181 PolarHBondContact O-N 3.05Å; V179-A182 PolarHBondContact O-N 3.46Å; V179-M183 HydrophobicContact CG1-CG 4.42Å; V179-M183 WeakPolarHBondContact O-CB 3.31Å; V179-M183 WeakPolarHBondContact O-CG 3.29Å; V179-M183 PolarHBondContact O-N 3.41Å
180	L	95.1	Very high	92.9	Very high	102 Å²	102	100.8 Å²	100.8	53%	0.534	52%	0.52	S	S	.	.	H	α-helix	trans	-62.7	-41.8	176.4	-69.9	175.5	0	0	0	112.1	E176 A177 M183 T184	E176-L180 WeakPolarHBondContact O-CG 3.33Å; E176-L180 PolarHBondContact O-N 3.13Å; A177-L180 PolarHBondContact O-N 2.97Å; L180-M183 PolarHBondContact O-N 2.87Å; L180-T184 WeakPolarHBondContact O-CG2 3.49Å; L180-T184 PolarHBondContact O-N 3.03Å; L180-T184 PolarHBondContact O-OG1 2.84Å; L180-T184 VanDerWaalsContact O-OG1 3.13Å
181	V	96.4	Very high	92.8	Very high	85 Å²	85	101.2 Å²	101.2	52%	0.515	52%	0.518	S	S	.	.	H	α-helix	trans	-63.3	-44.6	174.7	173.2	0	0	0	0	110.9	A177 L178 V179 M183 T184 L185	A177-V181 WeakPolarHBondContact O-CG2 3.42Å; A177-V181 PolarHBondContact O-N 2.97Å; L178-V181 PolarHBondContact O-N 3Å; V179-V181 PolarHBondContact O-N 3.05Å; V181-M183 VanDerWaalsContact C-N 3.34Å; V181-M183 PolarHBondContact O-N 3.44Å; V181-T184 WeakPolarHBondContact CA-OG1 3.34Å; V181-T184 PolarHBondContact O-N 3.49Å; V181-T184 PolarHBondContact O-OG1 3.31Å; V181-L185 HydrophobicContact CG1-CD1 4.07Å; V181-L185 HydrophobicContact CG1-CG 4.46Å; V181-L185 WeakPolarHBondContact O-CG 3.34Å; V181-L185 PolarHBondContact O-N 3.01Å
182	A	94.1	Very high	92.7	Very high	55 Å²	55	102.2 Å²	102.2	46%	0.455	52%	0.517	S	S	.	.	H	α-helix	trans	-61.9	-41.9	177.3	0	0	0	0	0	112.1	L178 V179 L185 G186	L178-A182 WeakPolarHBondContact O-CB 3.36Å; L178-A182 PolarHBondContact O-N 3.36Å; V179-A182 PolarHBondContact O-N 3.46Å; A182-L185 PolarHBondContact O-N 3.25Å; A182-G186 PolarHBondContact O-N 2.88Å
183	M	94.5	Very high	92.3	Very high	111 Å²	111	101 Å²	101	55%	0.547	51%	0.513	S	S	.	.	H	α-helix	trans	-62.3	-46.5	176.5	-78.7	-68.8	-70.8	0	0	112.1	V179 L180 V181 G186 Q187	V179-M183 HydrophobicContact CG1-CG 4.42Å; V179-M183 WeakPolarHBondContact O-CB 3.31Å; V179-M183 WeakPolarHBondContact O-CG 3.29Å; V179-M183 PolarHBondContact O-N 3.41Å; L180-M183 PolarHBondContact O-N 2.87Å; V181-M183 VanDerWaalsContact C-N 3.34Å; V181-M183 PolarHBondContact O-N 3.44Å; M183-G186 PolarHBondContact O-N 3.39Å; M183-Q187 VanDerWaalsContact O-CG 3.31Å; M183-Q187 WeakPolarHBondContact O-CG 3.46Å; M183-Q187 PolarHBondContact O-N 3.37Å
184	T	95.5	Very high	92	Very high	69 Å²	69	103.7 Å²	103.7	42%	0.423	52%	0.516	S	S	.	.	H	α-helix	trans	-65.2	-41.1	179	53.8	0	0	0	0	112	L180 V181 Q187 I188	L180-T184 WeakPolarHBondContact O-CG2 3.49Å; L180-T184 PolarHBondContact O-N 3.03Å; L180-T184 PolarHBondContact O-OG1 2.84Å; L180-T184 VanDerWaalsContact O-OG1 3.13Å; V181-T184 WeakPolarHBondContact CA-OG1 3.34Å; V181-T184 PolarHBondContact O-N 3.49Å; V181-T184 PolarHBondContact O-OG1 3.31Å; T184-Q187 PolarHBondContact O-N 3.29Å; T184-I188 VanDerWaalsContact O-CG1 3.29Å; T184-I188 WeakPolarHBondContact O-CG1 3.49Å; T184-I188 PolarHBondContact O-N 2.89Å
185	L	94.6	Very high	91.1	Very high	110 Å²	110	104.6 Å²	104.6	58%	0.576	52%	0.52	S	S	*	.	H	α-helix	trans	-63.1	-42	172.8	-69.8	176.3	0	0	0	111.9	V181 A182 I188 Y189	V181-L185 HydrophobicContact CG1-CD1 4.07Å; V181-L185 HydrophobicContact CG1-CG 4.46Å; V181-L185 WeakPolarHBondContact O-CG 3.34Å; V181-L185 PolarHBondContact O-N 3.01Å; A182-L185 PolarHBondContact O-N 3.25Å; L185-I188 PolarHBondContact O-N 3Å; L185-Y189 WeakPolarHBondContact O-CB 3.37Å; L185-Y189 PolarHBondContact O-N 2.84Å
186	G	93.4	Very high	90.1	Very high	37 Å²	37	106.4 Å²	106.4	38%	0.381	53%	0.53	S	S	.	.	H	α-helix	trans	-60.8	-43.9	175.1	0	0	0	0	0	112.5	A182 M183 Y189 Y190	A182-G186 PolarHBondContact O-N 2.88Å; M183-G186 PolarHBondContact O-N 3.39Å; G186-Y189 PolarHBondContact O-N 3.3Å; G186-Y190 WeakPolarHBondContact O-CB 3.12Å; G186-Y190 PolarHBondContact O-N 2.91Å
187	Q	91.1	Very high	88.6	Confident	112 Å²	112	105.8 Å²	105.8	52%	0.523	54%	0.535	S	S	.	.	H	α-helix	trans	-60.2	-45.8	174.8	-74.9	173.3	-19.5	0	0	111.7	M183 T184 Y190 L191	M183-Q187 VanDerWaalsContact O-CG 3.31Å; M183-Q187 WeakPolarHBondContact O-CG 3.46Å; M183-Q187 PolarHBondContact O-N 3.37Å; T184-Q187 PolarHBondContact O-N 3.29Å; Q187-Y190 PolarHBondContact O-N 3.36Å; Q187-L191 WeakPolarHBondContact O-CB 3.37Å; Q187-L191 WeakPolarHBondContact O-CG 3.5Å; Q187-L191 PolarHBondContact O-N 2.88Å
188	I	93.5	Very high	87	Confident	91 Å²	91	113.9 Å²	113.9	47%	0.467	56%	0.555	S	S	.	*	H	α-helix	trans	-63.8	-44	177.7	-66.8	164.8	0	0	0	110.9	T184 L185 L191 K192	T184-I188 VanDerWaalsContact O-CG1 3.29Å; T184-I188 WeakPolarHBondContact O-CG1 3.49Å; T184-I188 PolarHBondContact O-N 2.89Å; L185-I188 PolarHBondContact O-N 3Å; I188-L191 PolarHBondContact O-N 3.32Å; I188-K192 HydrophobicContact CG2-CD 4.3Å; I188-K192 WeakPolarHBondContact O-CB 3.33Å; I188-K192 WeakPolarHBondContact O-CG 3.35Å; I188-K192 PolarHBondContact O-N 3.03Å
189	Y	92.4	Very high	85.4	Confident	141 Å²	141	120.6 Å²	120.6	55%	0.553	57%	0.573	S	S	*	*	H	α-helix	trans	-61.1	-46.4	177.1	176.7	-96	0	0	0	111.6	L185 G186 K192 R193	L185-Y189 WeakPolarHBondContact O-CB 3.37Å; L185-Y189 PolarHBondContact O-N 2.84Å; G186-Y189 PolarHBondContact O-N 3.3Å; Y189-K192 PolarHBondContact O-N 3.4Å; Y189-R193 WeakPolarHBondContact O-CB 3.41Å; Y189-R193 PolarHBondContact O-N 2.86Å; Y189-R193 PolarHBondContact OH-NH1 2.87Å
190	Y	89.9	Confident	83.5	Confident	153 Å²	153	124 Å²	124	60%	0.6	59%	0.594	S	S	*	*	H	α-helix	trans	-59.7	-48.5	177.8	-179.5	-93.4	0	0	0	111.5	G186 Q187 R193 F194	G186-Y190 WeakPolarHBondContact O-CB 3.12Å; G186-Y190 PolarHBondContact O-N 2.91Å; Q187-Y190 PolarHBondContact O-N 3.36Å; Y190-R193 PolarHBondContact O-N 3.35Å; Y190-F194 WeakPolarHBondContact O-CB 3.42Å; Y190-F194 PolarHBondContact O-N 3.41Å
191	L	88.4	Confident	81.3	Confident	94 Å²	94	128.2 Å²	128.2	49%	0.492	62%	0.624	S	S	.	*	H	α-helix	trans	-61.3	-45.9	177.4	-72.7	174.5	0	0	0	111.6	Q187 I188 R193 F194 F195	Q187-L191 WeakPolarHBondContact O-CB 3.37Å; Q187-L191 WeakPolarHBondContact O-CG 3.5Å; Q187-L191 PolarHBondContact O-N 2.88Å; I188-L191 PolarHBondContact O-N 3.32Å; L191-R193 VanDerWaalsContact C-N 3.34Å; L191-R193 PolarHBondContact O-N 3.45Å; L191-F194 PolarHBondContact O-N 3.35Å; L191-F195 HydrophobicContact CD2-CE2 4.49Å; L191-F195 WeakPolarHBondContact O-CD2 3.44Å; L191-F195 PolarHBondContact O-N 2.92Å
192	K	85.3	Confident	80.6	Confident	145 Å²	145	130.4 Å²	130.4	63%	0.63	63%	0.629	S	S	*	*	H	α-helix	trans	-58.1	-46	176.3	-79.3	-174.7	175.8	-178.2	0	111.6	I188 Y189 F195 E196	I188-K192 HydrophobicContact CG2-CD 4.3Å; I188-K192 WeakPolarHBondContact O-CB 3.33Å; I188-K192 WeakPolarHBondContact O-CG 3.35Å; I188-K192 PolarHBondContact O-N 3.03Å; Y189-K192 PolarHBondContact O-N 3.4Å; K192-F195 PolarHBondContact O-N 3.33Å; K192-E196 WeakPolarHBondContact O-CB 3.35Å; K192-E196 PolarHBondContact O-N 3.42Å
193	R	83	Confident	79.9	Confident	154 Å²	154	134.4 Å²	134.4	58%	0.581	64%	0.638	S	S	*	*	H	α-helix	trans	-69.6	-32.6	180	-172	163.3	179.3	165.6	-2.2	113.3	Y189 Y190 L191 E196	Y189-R193 WeakPolarHBondContact O-CB 3.41Å; Y189-R193 PolarHBondContact O-N 2.86Å; Y189-R193 PolarHBondContact OH-NH1 2.87Å; Y190-R193 PolarHBondContact O-N 3.35Å; L191-R193 VanDerWaalsContact C-N 3.34Å; L191-R193 PolarHBondContact O-N 3.45Å; R193-E196 CarbonylContact O-C 3.51Å; R193-E196 PolarHBondContact O-N 2.95Å
194	F	81.6	Confident	79.1	Confident	122 Å²	122	135.7 Å²	135.7	54%	0.535	64%	0.644	S	S	.	*	H	α-helix	trans	-65.9	-40.8	173.6	-177.5	-95.7	0	0	0	111.7	Y190 L191 E196 V197	Y190-F194 WeakPolarHBondContact O-CB 3.42Å; Y190-F194 PolarHBondContact O-N 3.41Å; L191-F194 PolarHBondContact O-N 3.35Å; F194-E196 VanDerWaalsContact C-N 3.33Å; F194-V197 WeakPolarHBondContact O-CG2 3.32Å; F194-V197 PolarHBondContact O-N 2.88Å
195	F	76	Confident	78.1	Confident	163 Å²	163	139.6 Å²	139.6	72%	0.715	66%	0.657	S	S	*	*	H	α-helix	trans	-78.4	-16.6	173.7	-69.8	-65.7	0	0	0	113.6	L191 K192 V197	L191-F195 HydrophobicContact CD2-CE2 4.49Å; L191-F195 WeakPolarHBondContact O-CD2 3.44Å; L191-F195 PolarHBondContact O-N 2.92Å; K192-F195 PolarHBondContact O-N 3.33Å; F195-V197 PolarHBondContact O-N 3.35Å
196	E	72	Confident	77.1	Confident	155 Å²	155	141.4 Å²	141.4	72%	0.724	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	22.1	168.6	-155.1	-179	168.9	0	0	112.4	K192 R193 F194 R198	K192-E196 WeakPolarHBondContact O-CB 3.35Å; K192-E196 PolarHBondContact O-N 3.42Å; R193-E196 CarbonylContact O-C 3.51Å; R193-E196 PolarHBondContact O-N 2.95Å; F194-E196 VanDerWaalsContact C-N 3.33Å; E196-R198 PolarHBondContact O-N 2.87Å
197	V	59.3	Low	76	Confident	113 Å²	113	148.4 Å²	148.4	69%	0.685	68%	0.68	S	S	*	*	S	Bend	trans	-77.9	107.5	163.9	176.3	0	0	0	0	108.2	F194 F195 R199	F194-V197 WeakPolarHBondContact O-CG2 3.32Å; F194-V197 PolarHBondContact O-N 2.88Å; F195-V197 PolarHBondContact O-N 3.35Å; V197-R199 PolarHBondContact O-N 3.45Å
198	R	60.6	Low	74.9	Confident	218 Å²	218	151 Å²	151	82%	0.823	69%	0.691	S	S	*	*			trans	-21.6	121.1	175.3	-66.2	178.8	172.7	-150.5	-3.1	113.7	E196 V200	E196-R198 PolarHBondContact O-N 2.87Å; R198-V200 VanDerWaalsContact C-N 3.26Å; R198-V200 HydrophobicContact CB-CG2 4.41Å; R198-V200 PolarHBondContact O-N 3.24Å
199	R	62.2	Low	73.5	Confident	240 Å²	240	155.6 Å²	155.6	91%	0.906	71%	0.709	S	S	*	*			trans	-58.1	100.1	148.2	-69.9	-165.2	-155.2	172.7	6.7	106.6	V197 V201	V197-R199 PolarHBondContact O-N 3.45Å; R199-V201 VanDerWaalsContact C-N 3.31Å; R199-V201 HydrophobicContact CB-CG2 4.4Å; R199-V201 PolarHBondContact O-N 3.19Å
200	V	55.5	Low	71.9	Confident	135 Å²	135	156.8 Å²	156.8	82%	0.818	72%	0.722	S	S	*	*			trans	-74.6	97.1	159.3	-174.8	0	0	0	0	104.4	R198	R198-V200 VanDerWaalsContact C-N 3.26Å; R198-V200 HydrophobicContact CB-CG2 4.41Å; R198-V200 PolarHBondContact O-N 3.24Å
201	V	48.9	Very low	70.3	Confident	190 Å²	190	157.2 Å²	157.2	100%	1.152	73%	0.733	S	S	*	*			trans	-96.7	0	155.8	-174.5	0	0	0	0	106.1	R199	R199-V201 VanDerWaalsContact C-N 3.31Å; R199-V201 HydrophobicContact CB-CG2 4.4Å; R199-V201 PolarHBondContact O-N 3.19Å

Retrieved 201 of 201 residues in 41.5 ms (Link to these results)

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