A0A087XYG3_POEFO Loading...

Translocon-associated protein subunit delta

TRAP proteins are part of a complex whose function is to bind calcium to the ER membrane and thereby regulate the retention of ER resident proteins.

AlphaFold DB , UniProt , Accession A0A087XYG3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 167 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	55	Low	62.5	Low	206 Å²	206	127.7 Å²	127.7	100%	1.015	65%	0.654	S	S	*	*				0	-46.4	0	-58.5	-154.3	-68.7	0	0	112.8	R3 I4 A5	M1-R3 PolarHBondContact O-N 2.98Å; M1-I4 PolarHBondContact O-N 3.28Å; M1-A5 PolarHBondContact O-N 3.25Å
2	I	59.6	Low	62.3	Low	150 Å²	150	126.1 Å²	126.1	77%	0.769	65%	0.654	S	S	*	*	H	α-helix	trans	-59	-37.3	178.2	-72.9	155.3	0	0	0	114.4	I4 A5 A6	I2-I4 PolarHBondContact O-N 3.49Å; I2-A5 PolarHBondContact O-N 3.24Å; I2-A6 WeakPolarHBondContact O-CB 3.45Å; I2-A6 PolarHBondContact O-N 3.32Å
3	R	58.7	Low	62	Low	225 Å²	225	124.9 Å²	124.9	85%	0.849	66%	0.655	S	S	*	*	H	α-helix	trans	-70	-28.1	179.5	-66.6	-159	175.4	-163.2	-0.2	114.4	M1 F7	M1-R3 PolarHBondContact O-N 2.98Å; R3-F7 PolarHBondContact O-N 3.42Å
4	I	67.8	Low	61.6	Low	130 Å²	130	122.5 Å²	122.5	67%	0.667	66%	0.662	S	S	*	*	H	α-helix	trans	-77.1	-41.4	177.8	-59.7	171.7	0	0	0	109.5	M1 I2 A6 F7 L8	M1-I4 PolarHBondContact O-N 3.28Å; I2-I4 PolarHBondContact O-N 3.49Å; I4-A6 PolarHBondContact O-N 3.47Å; I4-F7 PolarHBondContact O-N 3.26Å; I4-L8 PolarHBondContact O-N 3.39Å
5	A	63.5	Low	60.9	Low	60 Å²	60	121.8 Å²	121.8	50%	0.496	67%	0.669	S	S	.	*	H	α-helix	trans	-61.1	-43.1	174.4	0	0	0	0	0	111.9	M1 I2 F7 L8 T9	M1-A5 PolarHBondContact O-N 3.25Å; I2-A5 PolarHBondContact O-N 3.24Å; A5-F7 PolarHBondContact O-N 3.34Å; A5-L8 PolarHBondContact O-N 3.46Å; A5-T9 PolarHBondContact O-N 3.39Å; A5-T9 PolarHBondContact O-OG1 2.84Å; A5-T9 VanDerWaalsContact O-OG1 3.09Å
6	A	64.9	Low	60.6	Low	45 Å²	45	120.1 Å²	120.1	37%	0.372	67%	0.668	S	S	.	*	H	α-helix	trans	-64	-38.5	177.4	0	0	0	0	0	112.9	I2 I4 T9 I10	I2-A6 WeakPolarHBondContact O-CB 3.45Å; I2-A6 PolarHBondContact O-N 3.32Å; I4-A6 PolarHBondContact O-N 3.47Å; A6-T9 WeakPolarHBondContact CA-OG1 3.31Å; A6-T9 PolarHBondContact O-OG1 3.09Å; A6-I10 WeakPolarHBondContact O-CD1 3.45Å; A6-I10 VanDerWaalsContact O-CG1 3.31Å; A6-I10 WeakPolarHBondContact O-CG1 3.36Å; A6-I10 PolarHBondContact O-N 3.04Å
7	F	65.8	Low	60.4	Low	147 Å²	147	117.2 Å²	117.2	65%	0.645	67%	0.672	S	S	*	*	H	α-helix	trans	-68.9	-38.2	177.3	-151	-92.8	0	0	0	111.7	R3 I4 A5 I10 L11	R3-F7 PolarHBondContact O-N 3.42Å; I4-F7 PolarHBondContact O-N 3.26Å; A5-F7 PolarHBondContact O-N 3.34Å; F7-I10 PolarHBondContact O-N 3.47Å; F7-L11 HydrophobicContact CD1-CD1 4.39Å; F7-L11 HydrophobicContact CE1-CD1 4.1Å; F7-L11 PolarHBondContact O-N 3.3Å; F7-L11 VanDerWaalsContact O-N 3.12Å
8	L	64.3	Low	60.8	Low	123 Å²	123	117.6 Å²	117.6	64%	0.644	67%	0.667	S	S	*	*	H	α-helix	trans	-66.9	-38.6	177.3	-154	76.7	0	0	0	111.9	I4 A5 L11 V12	I4-L8 PolarHBondContact O-N 3.39Å; A5-L8 PolarHBondContact O-N 3.46Å; L8-L11 PolarHBondContact O-N 3.19Å; L8-V12 WeakPolarHBondContact O-CG2 3.48Å; L8-V12 PolarHBondContact O-N 3.33Å
9	T	62.2	Low	61.4	Low	89 Å²	89	114.4 Å²	114.4	55%	0.546	65%	0.653	S	S	.	*	H	α-helix	trans	-68.3	-33.7	175.7	44.4	0	0	0	0	113.3	A5 A6	A5-T9 PolarHBondContact O-N 3.39Å; A5-T9 PolarHBondContact O-OG1 2.84Å; A5-T9 VanDerWaalsContact O-OG1 3.09Å; A6-T9 WeakPolarHBondContact CA-OG1 3.31Å; A6-T9 PolarHBondContact O-OG1 3.09Å
10	I	64.8	Low	62.3	Low	118 Å²	118	109.2 Å²	109.2	61%	0.605	62%	0.624	S	S	*	*	H	α-helix	trans	-71.4	-37.2	177	-69.9	165.3	0	0	0	110.9	A6 F7 V12 V13 A14	A6-I10 WeakPolarHBondContact O-CD1 3.45Å; A6-I10 VanDerWaalsContact O-CG1 3.31Å; A6-I10 WeakPolarHBondContact O-CG1 3.36Å; A6-I10 PolarHBondContact O-N 3.04Å; F7-I10 PolarHBondContact O-N 3.47Å; I10-V12 VanDerWaalsContact C-N 3.31Å; I10-V12 PolarHBondContact O-N 3.22Å; I10-V13 PolarHBondContact O-N 3.49Å; I10-A14 PolarHBondContact O-N 3.32Å
11	L	60.6	Low	63.1	Low	112 Å²	112	110.7 Å²	110.7	59%	0.586	62%	0.623	S	S	*	*	H	α-helix	trans	-66.5	-33.6	179.4	-139.1	103.9	0	0	0	112.6	F7 L8	F7-L11 HydrophobicContact CD1-CD1 4.39Å; F7-L11 HydrophobicContact CE1-CD1 4.1Å; F7-L11 PolarHBondContact O-N 3.3Å; F7-L11 VanDerWaalsContact O-N 3.12Å; L8-L11 PolarHBondContact O-N 3.19Å
12	V	61	Low	64.4	Low	108 Å²	108	106.9 Å²	106.9	66%	0.655	61%	0.607	S	S	*	*	H	α-helix	trans	-70.6	-33.6	179	172.3	0	0	0	0	111.9	L8 I10	L8-V12 WeakPolarHBondContact O-CG2 3.48Å; L8-V12 PolarHBondContact O-N 3.33Å; I10-V12 VanDerWaalsContact C-N 3.31Å; I10-V12 PolarHBondContact O-N 3.22Å
13	V	58.5	Low	65.5	Low	111 Å²	111	101.6 Å²	101.6	67%	0.673	58%	0.582	S	S	*	*	H	α-helix	trans	-73.5	-31.8	178.7	175.1	0	0	0	0	112	I10 C15 S16	I10-V13 PolarHBondContact O-N 3.49Å; V13-C15 PolarHBondContact O-N 3.05Å; V13-S16 PolarHBondContact O-OG 3.46Å
14	A	55.7	Low	66.7	Low	91 Å²	91	95.2 Å²	95.2	75%	0.752	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-6.5	-178.9	0	0	0	0	0	114.4	I10	I10-A14 PolarHBondContact O-N 3.32Å
15	C	51.6	Low	67.6	Low	112 Å²	112	91.4 Å²	91.4	76%	0.757	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	36.9	-177.1	-139.7	0	0	0	0	112.4	V13 G17	V13-C15 PolarHBondContact O-N 3.05Å; C15-G17 PolarHBondContact O-N 3.48Å
16	S	55.3	Low	68.8	Low	94 Å²	94	92.5 Å²	92.5	66%	0.657	55%	0.549	S	S	*	.			trans	-83.1	104.6	168.7	-51	0	0	0	0	107.6	V13 E18	V13-S16 PolarHBondContact O-OG 3.46Å; S16-E18 PolarHBondContact O-N 3.13Å
17	G	58.6	Low	70	Confident	72 Å²	72	93.7 Å²	93.7	74%	0.742	55%	0.553	S	S	*	*			trans	-59.4	128.1	168.9	0	0	0	0	0	109.3	C15 S19	C15-G17 PolarHBondContact O-N 3.48Å; G17-S19 PolarHBondContact O-N 3.32Å; G17-S19 VanDerWaalsContact O-N 3.13Å
18	E	66.4	Low	71.2	Confident	123 Å²	123	88.9 Å²	88.9	58%	0.575	54%	0.538	S	S	*	.			trans	-69.4	108.6	175.4	-85.8	-179.4	83.5	0	0	109.8	S16 A55	S16-E18 PolarHBondContact O-N 3.13Å; E18-A55 HydrophobicContact CB-CB 4.1Å
19	S	72.5	Confident	72.5	Confident	58 Å²	58	85.2 Å²	85.2	41%	0.406	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-79.4	139.9	166.9	53.7	0	0	0	0	110.1	G17 K21 N53	G17-S19 PolarHBondContact O-N 3.32Å; G17-S19 VanDerWaalsContact O-N 3.13Å; S19-K21 PolarHBondContact O-N 2.81Å; S19-N53 PolarHBondContact O-ND2 2.9Å
20	C	78.6	Confident	73.9	Confident	9 Å²	9	87.4 Å²	87.4	6%	0.061	53%	0.525	C	S	.	.	P	Polyproline II helix	trans	-72.7	116.7	178.1	-176.5	0	0	0	0	109.5	C51 V58 L125	C20-C51 HydrophobicContact CB-CB 4.03Å; C20-C51 WeakPolarHBondContact CB-SG 3.01Å; C20-C51 WeakPolarHBondContact SG-CB 3.04Å; C20-C51 CovalentContact SG-SG 2.02Å; C20-C51 PolarHBondContact SG-SG 2.02Å; C20-V58 HydrophobicContact CB-CG2 4.26Å; C20-L125 HydrophobicContact CB-CD2 4.38Å
21	K	80.9	Confident	75.1	Confident	141 Å²	141	83.6 Å²	83.6	61%	0.613	51%	0.507	S	S	*	.	S	Bend	trans	-94.7	135.6	170.6	-75.9	-166.7	177	-179.3	0	110.5	S19 A52 N53	S19-K21 PolarHBondContact O-N 2.81Å; K21-A52 PolarHBondContact O-N 3.24Å; K21-N53 PolarHBondContact N-OD1 3.13Å; K21-N53 VanDerWaalsContact N-OD1 3.13Å
22	D	80.8	Confident	76.4	Confident	127 Å²	127	81.1 Å²	81.1	68%	0.679	50%	0.497	S	S	*	.	S	Bend	trans	49.6	71.8	-179.8	-59.9	-45.4	0	0	0	112.8	V24 A52	D22-V24 PolarHBondContact O-N 3.23Å; D22-A52 HydrophobicContact CB-CB 4.17Å
23	P	82.3	Confident	77.4	Confident	38 Å²	38	78.4 Å²	78.4	25%	0.247	48%	0.482	C	S	.	.			trans	-68.9	118.5	-178	28.9	-35	0	0	0	111.2	L49 L125 F126	P23-L49 HydrophobicContact CB-CD1 3.57Å; P23-L125 HydrophobicContact CG-CD1 4.42Å; P23-L125 HydrophobicContact CG-CG 4.24Å; P23-F126 HydrophobicContact CB-CD1 4.13Å; P23-F126 HydrophobicContact CG-CD1 4.16Å
24	V	85.2	Confident	78.3	Confident	92 Å²	92	78 Å²	78	56%	0.558	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96	117.6	167.3	178.2	0	0	0	0	108.1	D22 T50	D22-V24 PolarHBondContact O-N 3.23Å; V24-T50 WeakPolarHBondContact CB-OG1 3.31Å; V24-T50 PolarHBondContact N-O 3.45Å; V24-T50 PolarHBondContact O-N 3.38Å; V24-T50 PolarHBondContact O-OG1 3.21Å
25	I	87.2	Confident	79.4	Confident	49 Å²	49	74.9 Å²	74.9	25%	0.251	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	142.4	-174.1	58.6	157.1	0	0	0	112.5	S48 L49 F126 V128	I25-S48 VanDerWaalsContact CA-O 3.31Å; I25-S48 WeakPolarHBondContact CA-O 3.43Å; I25-L49 HydrophobicContact CG2-CD1 3.72Å; I25-F126 HydrophobicContact CD1-CD2 3.88Å; I25-F126 HydrophobicContact CD1-CE2 4.4Å; I25-F126 HydrophobicContact CD1-CG 4.44Å; I25-F126 HydrophobicContact CG2-CD1 4.17Å; I25-F126 HydrophobicContact CG2-CD2 4.1Å; I25-F126 HydrophobicContact CG2-CE1 4.08Å; I25-F126 HydrophobicContact CG2-CE2 3.98Å; I25-F126 HydrophobicContact CG2-CG 4.19Å; I25-F126 HydrophobicContact CG2-CZ 3.99Å; I25-V128 HydrophobicContact CD1-CG2 3.85Å
26	T	88.3	Confident	80.4	Confident	84 Å²	84	73.5 Å²	73.5	52%	0.515	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	97.1	164.3	66	0	0	0	0	109.5	L47 S48	T26-L47 WeakPolarHBondContact O-CA 3.17Å; T26-S48 PolarHBondContact N-O 2.79Å; T26-S48 PolarHBondContact O-N 2.97Å; T26-S48 VanDerWaalsContact O-N 3.14Å; T26-S48 WeakPolarHBondContact OG1-CB 3.46Å; T26-S48 PolarHBondContact OG1-OG 2.88Å
27	P	89.8	Confident	81.4	Confident	70 Å²	70	76.4 Å²	76.4	46%	0.455	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	143	-179.3	31.7	-32.9	0	0	0	112.1	E46 V128	P27-E46 CarbonylContact C-O 3.53Å; P27-V128 HydrophobicContact CB-CG1 3.6Å; P27-V128 HydrophobicContact CB-CG2 4.16Å; P27-V128 HydrophobicContact CG-CG1 4.09Å
28	S	90.9	Very high	82.3	Confident	45 Å²	45	75.5 Å²	75.5	32%	0.315	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	125.9	166.9	47.5	0	0	0	0	108.9	E46	S28-E46 PolarHBondContact N-O 2.52Å; S28-E46 PolarHBondContact O-N 2.93Å; S28-E46 WeakPolarHBondContact OG-CB 3.29Å; S28-E46 PolarHBondContact OG-O 3.37Å
29	A	90.8	Very high	83.1	Confident	47 Å²	47	74.5 Å²	74.5	39%	0.388	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	139.6	-176.1	0	0	0	0	0	111.4	I44 V45 I130	A29-I44 CarbonylContact C-O 3.55Å; A29-I44 WeakPolarHBondContact CA-O 3.37Å; A29-V45 HydrophobicContact CB-CG2 4.43Å; A29-I130 HydrophobicContact CB-CB 4.33Å; A29-I130 HydrophobicContact CB-CD1 4.39Å; A29-I130 HydrophobicContact CB-CG1 3.85Å; A29-I130 HydrophobicContact CB-CG2 3.64Å
30	Y	91.4	Very high	83.9	Confident	135 Å²	135	75.3 Å²	75.3	53%	0.529	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	131.8	176.9	-55.8	-83.8	0	0	0	108.9	I44	Y30-I44 PolarHBondContact N-O 3.37Å; Y30-I44 PolarHBondContact O-N 3.45Å
31	T	91.4	Very high	84.4	Confident	38 Å²	38	74.9 Å²	74.9	23%	0.233	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	131.7	178.6	78.5	0	0	0	0	109.5	V42 F43 I130 H132	T31-V42 WeakPolarHBondContact CA-O 3.43Å; T31-F43 HydrophobicContact CG2-CD1 3.62Å; T31-F43 HydrophobicContact CG2-CE1 3.96Å; T31-I130 HydrophobicContact CG2-CG2 3.94Å; T31-H132 WeakPolarHBondContact CB-ND1 3.46Å; T31-H132 PolarHBondContact OG1-ND1 3.36Å
32	T	87.8	Confident	85	Confident	60 Å²	60	70.5 Å²	70.5	37%	0.368	41%	0.413	S	S	.	.			trans	-70.9	136.3	174.5	56.9	0	0	0	0	110.6	S41 V42 H132	T32-S41 VanDerWaalsContact OG1-CA 3.31Å; T32-S41 WeakPolarHBondContact OG1-CA 3.43Å; T32-V42 HydrophobicContact CG2-CB 4.06Å; T32-V42 PolarHBondContact N-O 3.23Å; T32-V42 PolarHBondContact OG1-N 3.09Å; T32-V42 PolarHBondContact OG1-O 2.89Å; T32-H132 PolarHBondContact O-CE1 3.34Å; T32-H132 VanDerWaalsContact O-CE1 3.3Å
33	S	81.9	Confident	85.6	Confident	50 Å²	50	64.5 Å²	64.5	35%	0.35	38%	0.381	S	S	.	.			trans	-113.3	1	-179.7	-54.4	0	0	0	0	113.9	A135 W136	S33-A135 CarbonylContact O-C 3.57Å; S33-A135 WeakPolarHBondContact O-CA 3.47Å; S33-W136 PolarHBondContact O-N 2.71Å
34	D	76.6	Confident	86.1	Confident	104 Å²	104	65.2 Å²	65.2	56%	0.556	38%	0.382	S	S	*	.	B	Isolated β-bridge	trans	-100	110.9	-176.3	-67.3	-49.2	0	0	0	111.6
35	A	78.5	Confident	86.5	Confident	25 Å²	25	60.9 Å²	60.9	21%	0.207	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-1.9	175.5	0	0	0	0	0	114	H88 A135 W136	A35-H88 WeakPolarHBondContact CA-NE2 3.43Å; A35-H88 HydrophobicContact CB-CB 4.46Å; A35-A135 HydrophobicContact CB-CB 3.78Å; A35-W136 WeakPolarHBondContact CB-O 3.24Å; A35-W136 PolarHBondContact N-O 3.23Å; A35-W136 VanDerWaalsContact N-O 3.09Å
36	V	72.8	Confident	86.8	Confident	83 Å²	83	62 Å²	62	50%	0.503	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-32.5	-178.2	-177.4	0	0	0	0	112	W136	V36-W136 HydrophobicContact CG2-CE3 3.97Å; V36-W136 HydrophobicContact CG2-CZ3 3.97Å
37	I	76.3	Confident	87	Confident	155 Å²	155	58.2 Å²	58.2	80%	0.795	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-22.5	-173	-53.1	-58.5	0	0	0	112.6
38	S	78.9	Confident	87	Confident	53 Å²	53	56.8 Å²	56.8	37%	0.371	33%	0.328	S	S	.	.			trans	-121.1	149.4	180	-177.7	0	0	0	0	110.4	E40 H88	S38-E40 WeakPolarHBondContact CB-O 3.39Å; S38-E40 PolarHBondContact OG-N 3.48Å; S38-E40 PolarHBondContact OG-O 2.97Å; S38-H88 PolarHBondContact O-CD2 3.47Å; S38-H88 VanDerWaalsContact O-CD2 3.26Å; S38-H88 PolarHBondContact O-NE2 2.92Å
39	S	82.3	Confident	86.9	Confident	102 Å²	102	55 Å²	55	71%	0.713	32%	0.315	S	S	*	.	S	Bend	trans	-85.3	-15.3	171.3	54.9	0	0	0	0	113.5	H88	S39-H88 PolarHBondContact O-CD2 2.95Å
40	E	88.8	Confident	86.7	Confident	74 Å²	74	56.7 Å²	56.7	35%	0.346	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	148.2	-177.9	-58.7	-166.6	148.9	0	0	111.3	S38 S85 L86 H88	S38-E40 WeakPolarHBondContact CB-O 3.39Å; S38-E40 PolarHBondContact OG-N 3.48Å; S38-E40 PolarHBondContact OG-O 2.97Å; E40-S85 VanDerWaalsContact OE2-CB 3.24Å; E40-S85 WeakPolarHBondContact OE2-CB 3.4Å; E40-S85 PolarHBondContact OE2-OG 3.41Å; E40-L86 CarbonylContact C-O 3.5Å; E40-L86 WeakPolarHBondContact CA-O 3.4Å; E40-H88 PolarHBondContact N-NE2 2.78Å; E40-H88 PolarHBondContact O-CE1 2.69Å; E40-H88 VanDerWaalsContact O-CE1 3.27Å
41	S	90.2	Very high	86.4	Confident	0 Å²	0	51 Å²	51	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	128.7	167.9	-73.4	0	0	0	0	109.5	T32 S85 L86 H88	T32-S41 VanDerWaalsContact OG1-CA 3.31Å; T32-S41 WeakPolarHBondContact OG1-CA 3.43Å; S41-S85 CarbonylContact O-C 3.49Å; S41-S85 VanDerWaalsContact O-CA 3.29Å; S41-S85 WeakPolarHBondContact O-CA 3.43Å; S41-L86 PolarHBondContact N-O 3.21Å; S41-L86 PolarHBondContact O-N 3.05Å; S41-H88 PolarHBondContact N-CE1 3.44Å; S41-H88 VanDerWaalsContact N-CE1 3.34Å; S41-H88 PolarHBondContact N-ND1 3.13Å; S41-H88 PolarHBondContact OG-CE1 3Å; S41-H88 VanDerWaalsContact OG-CE1 3.24Å; S41-H88 PolarHBondContact OG-ND1 2.94Å
42	V	92.1	Very high	85.9	Confident	50 Å²	50	53 Å²	53	30%	0.303	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	134.7	177.2	-176	0	0	0	0	109.3	T31 T32 I44	T31-V42 WeakPolarHBondContact CA-O 3.43Å; T32-V42 HydrophobicContact CG2-CB 4.06Å; T32-V42 PolarHBondContact N-O 3.23Å; T32-V42 PolarHBondContact OG1-N 3.09Å; T32-V42 PolarHBondContact OG1-O 2.89Å; V42-I44 HydrophobicContact CG1-CG1 4.11Å
43	F	93.3	Very high	85.5	Confident	1 Å²	1	53.4 Å²	53.4	0%	0.004	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	132.1	175.8	-61.9	-100.2	0	0	0	108	T31 S83 W84 L86 A91 Y96 H132	T31-F43 HydrophobicContact CG2-CD1 3.62Å; T31-F43 HydrophobicContact CG2-CE1 3.96Å; F43-S83 WeakPolarHBondContact O-CA 3.15Å; F43-S83 WeakPolarHBondContact O-CB 3.38Å; F43-W84 HydrophobicContact CB-CD2 3.71Å; F43-W84 HydrophobicContact CB-CE3 4.02Å; F43-W84 HydrophobicContact CB-CG 4.36Å; F43-W84 HydrophobicContact CB-CH2 3.67Å; F43-W84 HydrophobicContact CB-CZ2 3.34Å; F43-W84 HydrophobicContact CB-CZ3 4Å; F43-W84 AromaticContact CD1-CZ2 3.87Å; F43-W84 HydrophobicContact CD1-CZ2 3.87Å; F43-W84 AromaticContact CD2-CE2 3.93Å; F43-W84 HydrophobicContact CD2-CZ2 4.33Å; F43-W84 AromaticContact CD2-NE1 3.47Å; F43-W84 HydrophobicContact CG-CD2 4.39Å; F43-W84 AromaticContact CG-CE2 3.61Å; F43-W84 HydrophobicContact CG-CH2 4.36Å; F43-W84 AromaticContact CG-CZ2 3.6Å; F43-W84 HydrophobicContact CG-CZ2 3.6Å; F43-W84 AromaticContact CG-NE1 3.66Å; F43-W84 PolarHBondContact N-O 2.9Å; F43-W84 PolarHBondContact O-N 2.78Å; F43-L86 HydrophobicContact CE2-CB 4.21Å; F43-L86 HydrophobicContact CE2-CD1 3.96Å; F43-L86 HydrophobicContact CE2-CG 4.28Å; F43-L86 HydrophobicContact CZ-CD1 4.47Å; F43-A91 HydrophobicContact CE2-CB 4.16Å; F43-A91 HydrophobicContact CZ-CB 4.14Å; F43-Y96 HydrophobicContact CE1-CD2 4.05Å; F43-Y96 HydrophobicContact CE1-CE2 4.13Å; F43-Y96 HydrophobicContact CE1-CG 4.43Å; F43-Y96 HydrophobicContact CZ-CE2 4.23Å; F43-H132 HydrophobicContact CE1-CB 3.85Å; F43-H132 AromaticContact CE1-CG 3.71Å; F43-H132 HydrophobicContact CZ-CB 4.44Å; F43-H132 AromaticContact CZ-CD2 3.91Å; F43-H132 AromaticContact CZ-CG 3.94Å
44	I	93.9	Very high	85.2	Confident	53 Å²	53	53.1 Å²	53.1	27%	0.272	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	127.1	176.8	-56	175.5	0	0	0	107.1	A29 Y30 V42 E46 Q81	A29-I44 CarbonylContact C-O 3.55Å; A29-I44 WeakPolarHBondContact CA-O 3.37Å; Y30-I44 PolarHBondContact N-O 3.37Å; Y30-I44 PolarHBondContact O-N 3.45Å; V42-I44 HydrophobicContact CG1-CG1 4.11Å; I44-E46 HydrophobicContact CG2-CG 4.44Å; I44-Q81 HydrophobicContact CG2-CG 3.96Å; I44-Q81 VanDerWaalsContact CG2-NE2 3.3Å
45	V	94.1	Very high	85.3	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.006	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	115.4	177.1	-174.1	0	0	0	0	107.3	A29 Q81 V82 W84 F100 I130	A29-V45 HydrophobicContact CB-CG2 4.43Å; V45-Q81 CarbonylContact O-C 3.56Å; V45-Q81 VanDerWaalsContact O-CA 3.28Å; V45-Q81 WeakPolarHBondContact O-CA 3.34Å; V45-V82 HydrophobicContact CB-CG1 3.79Å; V45-V82 HydrophobicContact CG2-CG1 4.34Å; V45-V82 PolarHBondContact N-O 3.37Å; V45-V82 PolarHBondContact O-N 3.42Å; V45-W84 HydrophobicContact CG2-CH2 3.68Å; V45-W84 HydrophobicContact CG2-CZ3 3.59Å; V45-F100 HydrophobicContact CG1-CZ 4.47Å; V45-I130 HydrophobicContact CB-CD1 4.47Å; V45-I130 HydrophobicContact CG2-CD1 3.18Å; V45-I130 HydrophobicContact CG2-CG1 4.21Å
46	E	93.4	Very high	85	Confident	73 Å²	73	53.1 Å²	53.1	34%	0.341	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	138.3	169.7	-68.8	175.7	177.7	0	0	108	P27 S28 I44 Y80 Q81	P27-E46 CarbonylContact C-O 3.53Å; S28-E46 PolarHBondContact N-O 2.52Å; S28-E46 PolarHBondContact O-N 2.93Å; S28-E46 WeakPolarHBondContact OG-CB 3.29Å; S28-E46 PolarHBondContact OG-O 3.37Å; I44-E46 HydrophobicContact CG2-CG 4.44Å; E46-Y80 CarbonylContact C-O 3.55Å; E46-Y80 WeakPolarHBondContact CA-O 3.41Å; E46-Q81 HydrophobicContact CG-CB 4.42Å; E46-Q81 HydrophobicContact CG-CG 4.04Å
47	L	91.7	Very high	85.1	Confident	4 Å²	4	53.4 Å²	53.4	2%	0.021	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	141.8	176.4	63.9	96.7	0	0	0	109.3	T26 L49 K79 Y80 F100 F126	T26-L47 WeakPolarHBondContact O-CA 3.17Å; L47-L49 HydrophobicContact CD1-CB 4.06Å; L47-K79 CarbonylContact O-C 3.59Å; L47-K79 WeakPolarHBondContact O-CA 3.49Å; L47-Y80 HydrophobicContact CD1-CD2 3.79Å; L47-Y80 HydrophobicContact CD1-CG 4.02Å; L47-Y80 PolarHBondContact N-O 3.23Å; L47-Y80 PolarHBondContact O-N 3.15Å; L47-F100 HydrophobicContact CD2-CD1 4.04Å; L47-F100 HydrophobicContact CD2-CE1 3.35Å; L47-F100 HydrophobicContact CD2-CE2 3.97Å; L47-F100 HydrophobicContact CD2-CZ 3.3Å; L47-F126 HydrophobicContact CD1-CZ 4.2Å; L47-F126 HydrophobicContact CD2-CE2 4.19Å; L47-F126 HydrophobicContact CD2-CZ 4.3Å
48	S	89.9	Confident	85.5	Confident	39 Å²	39	46.5 Å²	46.5	27%	0.273	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	130.4	162.9	92.3	0	0	0	0	108.7	I25 T26 G78	I25-S48 VanDerWaalsContact CA-O 3.31Å; I25-S48 WeakPolarHBondContact CA-O 3.43Å; T26-S48 PolarHBondContact N-O 2.79Å; T26-S48 PolarHBondContact O-N 2.97Å; T26-S48 VanDerWaalsContact O-N 3.14Å; T26-S48 WeakPolarHBondContact OG1-CB 3.46Å; T26-S48 PolarHBondContact OG1-OG 2.88Å; S48-G78 CarbonylContact C-O 3.59Å; S48-G78 WeakPolarHBondContact CA-O 3.34Å
49	L	88.5	Confident	85.9	Confident	8 Å²	8	46.2 Å²	46.2	4%	0.042	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	126.8	-179.8	-179.7	73.5	0	0	0	108.9	P23 I25 L47 L60 G78 Y80 F126	P23-L49 HydrophobicContact CB-CD1 3.57Å; I25-L49 HydrophobicContact CG2-CD1 3.72Å; L47-L49 HydrophobicContact CD1-CB 4.06Å; L49-L60 HydrophobicContact CD2-CD1 4.2Å; L49-G78 PolarHBondContact N-O 3.15Å; L49-Y80 HydrophobicContact CB-CD2 3.91Å; L49-Y80 HydrophobicContact CB-CE2 3.74Å; L49-Y80 HydrophobicContact CD2-CE2 3.96Å; L49-Y80 HydrophobicContact CG-CE2 4.49Å; L49-F126 HydrophobicContact CD1-CE1 3.93Å; L49-F126 HydrophobicContact CD1-CZ 4.46Å
50	T	86.5	Confident	86.3	Confident	83 Å²	83	41.4 Å²	41.4	51%	0.509	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	125.9	169.6	52.4	0	0	0	0	108.9	V24	V24-T50 WeakPolarHBondContact CB-OG1 3.31Å; V24-T50 PolarHBondContact N-O 3.45Å; V24-T50 PolarHBondContact O-N 3.38Å; V24-T50 PolarHBondContact O-OG1 3.21Å
51	C	84.9	Confident	86.5	Confident	15 Å²	15	40.6 Å²	40.6	10%	0.101	25%	0.247	C	C	.	.			trans	-104.8	141.5	-179	-53.5	0	0	0	0	109.6	C20 N53 G54 A55	C20-C51 HydrophobicContact CB-CB 4.03Å; C20-C51 WeakPolarHBondContact CB-SG 3.01Å; C20-C51 WeakPolarHBondContact SG-CB 3.04Å; C20-C51 CovalentContact SG-SG 2.02Å; C20-C51 PolarHBondContact SG-SG 2.02Å; C51-N53 WeakPolarHBondContact CB-OD1 3.47Å; C51-N53 PolarHBondContact O-N 2.84Å; C51-G54 PolarHBondContact O-N 2.92Å; C51-A55 HydrophobicContact CB-CB 4.29Å; C51-A55 PolarHBondContact SG-O 3.39Å
52	A	81.8	Confident	86.8	Confident	81 Å²	81	40.6 Å²	40.6	67%	0.669	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-27.7	-179.4	0	0	0	0	0	112.9	K21 D22 G54	K21-A52 PolarHBondContact O-N 3.24Å; D22-A52 HydrophobicContact CB-CB 4.17Å; A52-G54 VanDerWaalsContact C-N 3.28Å; A52-G54 PolarHBondContact O-N 2.64Å
53	N	80.1	Confident	86.8	Confident	67 Å²	67	38.9 Å²	38.9	36%	0.358	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-1.7	174.3	59.9	-40.3	0	0	0	114.2	S19 K21 C51 A55	S19-N53 PolarHBondContact O-ND2 2.9Å; K21-N53 PolarHBondContact N-OD1 3.13Å; K21-N53 VanDerWaalsContact N-OD1 3.13Å; C51-N53 WeakPolarHBondContact CB-OD1 3.47Å; C51-N53 PolarHBondContact O-N 2.84Å; N53-A55 VanDerWaalsContact C-N 3.28Å; N53-A55 PolarHBondContact O-N 2.8Å
54	G	75.6	Confident	86.8	Confident	45 Å²	45	39.1 Å²	39.1	46%	0.464	24%	0.237	S	C	.	.			trans	76.6	10.9	-179.7	0	0	0	0	0	114.7	C51 A52 Q56	C51-G54 PolarHBondContact O-N 2.92Å; A52-G54 VanDerWaalsContact C-N 3.28Å; A52-G54 PolarHBondContact O-N 2.64Å; G54-Q56 WeakPolarHBondContact O-CG 3.32Å; G54-Q56 PolarHBondContact O-N 2.76Å
55	A	78.8	Confident	86.6	Confident	5 Å²	5	43 Å²	43	4%	0.041	26%	0.259	C	S	.	.			trans	-64.2	118.7	176.4	0	0	0	0	0	110.7	E18 C51 N53 V58	E18-A55 HydrophobicContact CB-CB 4.1Å; C51-A55 HydrophobicContact CB-CB 4.29Å; C51-A55 PolarHBondContact SG-O 3.39Å; N53-A55 VanDerWaalsContact C-N 3.28Å; N53-A55 PolarHBondContact O-N 2.8Å; A55-V58 HydrophobicContact CB-CG2 3.77Å
56	Q	71.8	Confident	86.2	Confident	124 Å²	124	45 Å²	45	58%	0.579	28%	0.279	S	S	*	.			trans	-111.2	-18.2	-174.2	-75.5	172.2	15	0	0	113.5	G54 V77 Y80	G54-Q56 WeakPolarHBondContact O-CG 3.32Å; G54-Q56 PolarHBondContact O-N 2.76Å; Q56-V77 HydrophobicContact CB-CG1 3.73Å; Q56-V77 HydrophobicContact CG-CG1 3.63Å; Q56-V77 VanDerWaalsContact OE1-CG1 3.3Å; Q56-Y80 PolarHBondContact O-OH 3.35Å
57	S	74.7	Confident	86.1	Confident	88 Å²	88	49.2 Å²	49.2	62%	0.615	29%	0.292	S	S	*	.			trans	-112.8	32.9	-173	54.7	0	0	0	0	113.2	R73	S57-R73 PolarHBondContact O-NH2 3.31Å
58	V	83.9	Confident	86.1	Confident	11 Å²	11	52 Å²	52	7%	0.067	31%	0.305	C	S	.	.			trans	-73.8	133.2	-179.3	-174.5	0	0	0	0	110.6	C20 A55 L60 R73 Y80	C20-V58 HydrophobicContact CB-CG2 4.26Å; A55-V58 HydrophobicContact CB-CG2 3.77Å; V58-L60 HydrophobicContact CG1-CD2 4.09Å; V58-R73 VanDerWaalsContact O-CZ 3.3Å; V58-R73 PolarHBondContact O-NE 3.39Å; V58-R73 PolarHBondContact O-NH2 2.99Å; V58-Y80 VanDerWaalsContact O-CE1 3.24Å; V58-Y80 WeakPolarHBondContact O-CE1 3.4Å; V58-Y80 PolarHBondContact O-OH 3.44Å; V58-Y80 VanDerWaalsContact O-OH 3.05Å
59	T	88.1	Confident	86.2	Confident	47 Å²	47	52.3 Å²	52.3	29%	0.288	30%	0.302	S	S	.	.			trans	-87.9	127	175.7	-55.4	0	0	0	0	108.3	Y61 R73	T59-Y61 HydrophobicContact CG2-CE2 3.95Å; T59-R73 PolarHBondContact OG1-NH2 3.2Å
60	L	90.9	Very high	86.4	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	33%	0.329	C	S	.	.			trans	-114.2	150.3	-179.2	-62.9	178.1	0	0	0	111.1	L49 V58 V71 Y80 F101 L125 F126	L49-L60 HydrophobicContact CD2-CD1 4.2Å; V58-L60 HydrophobicContact CG1-CD2 4.09Å; L60-V71 HydrophobicContact CB-CB 3.99Å; L60-V71 HydrophobicContact CB-CG1 4.3Å; L60-V71 HydrophobicContact CB-CG2 3.98Å; L60-V71 VanDerWaalsContact O-CB 3.26Å; L60-V71 WeakPolarHBondContact O-CB 3.49Å; L60-V71 WeakPolarHBondContact O-CG2 3.3Å; L60-V71 PolarHBondContact O-N 3.31Å; L60-Y80 HydrophobicContact CD1-CD1 3.92Å; L60-Y80 HydrophobicContact CD1-CD2 4.43Å; L60-Y80 HydrophobicContact CD1-CE1 4.06Å; L60-Y80 HydrophobicContact CD1-CG 4.13Å; L60-Y80 HydrophobicContact CG-CD1 4.36Å; L60-Y80 HydrophobicContact CG-CE1 4.21Å; L60-F101 WeakPolarHBondContact CA-O 3.23Å; L60-L125 HydrophobicContact CD2-CD2 4.04Å; L60-F126 HydrophobicContact CD1-CE1 4.41Å; L60-F126 HydrophobicContact CD1-CZ 4.16Å
61	Y	93.5	Very high	86.7	Confident	56 Å²	56	53.2 Å²	53.2	22%	0.22	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	139	172	-63	-81.8	0	0	0	108.8	T59 F100 F101 Y106	T59-Y61 HydrophobicContact CG2-CE2 3.95Å; Y61-F100 CarbonylContact O-C 3.55Å; Y61-F100 WeakPolarHBondContact O-CA 3.49Å; Y61-F101 PolarHBondContact N-O 2.81Å; Y61-F101 PolarHBondContact O-N 2.84Å; Y61-Y106 VanDerWaalsContact CB-CD2 3.47Å; Y61-Y106 AromaticContact CD1-CD1 3.97Å; Y61-Y106 HydrophobicContact CD1-CD1 3.97Å; Y61-Y106 HydrophobicContact CD1-CD2 4.35Å; Y61-Y106 AromaticContact CD1-CE1 3.65Å; Y61-Y106 HydrophobicContact CD1-CE1 3.65Å; Y61-Y106 HydrophobicContact CD1-CE2 4.07Å; Y61-Y106 HydrophobicContact CD1-CG 4.28Å; Y61-Y106 AromaticContact CD1-CZ 3.7Å; Y61-Y106 AromaticContact CD2-CD1 3.46Å; Y61-Y106 HydrophobicContact CD2-CD1 3.46Å; Y61-Y106 VanDerWaalsContact CD2-CD1 3.46Å; Y61-Y106 HydrophobicContact CD2-CD2 4.15Å; Y61-Y106 HydrophobicContact CD2-CE1 4.03Å; Y61-Y106 AromaticContact CD2-CG 3.5Å; Y61-Y106 HydrophobicContact CD2-CG 3.5Å; Y61-Y106 HydrophobicContact CE1-CD1 4.15Å; Y61-Y106 AromaticContact CE1-CE1 3.75Å; Y61-Y106 HydrophobicContact CE1-CE1 3.75Å; Y61-Y106 AromaticContact CE2-CD1 3.65Å; Y61-Y106 HydrophobicContact CE2-CD1 3.65Å; Y61-Y106 HydrophobicContact CE2-CE1 4.11Å; Y61-Y106 HydrophobicContact CE2-CG 4.17Å; Y61-Y106 AromaticContact CG-CD1 3.62Å; Y61-Y106 HydrophobicContact CG-CD1 3.62Å; Y61-Y106 AromaticContact CG-CD2 3.73Å; Y61-Y106 HydrophobicContact CG-CD2 3.73Å; Y61-Y106 AromaticContact CG-CE1 3.79Å; Y61-Y106 HydrophobicContact CG-CE1 3.79Å; Y61-Y106 AromaticContact CG-CE2 3.91Å; Y61-Y106 HydrophobicContact CG-CE2 3.91Å; Y61-Y106 AromaticContact CG-CG 3.57Å; Y61-Y106 HydrophobicContact CG-CG 3.57Å; Y61-Y106 AromaticContact CG-CZ 3.93Å; Y61-Y106 AromaticContact CZ-CD1 3.99Å; Y61-Y106 AromaticContact CZ-CE1 3.98Å
62	A	94.7	Very high	87	Confident	1 Å²	1	57 Å²	57	1%	0.008	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	144	176.9	0	0	0	0	0	109.7	Q68 F69 V71 V82 V98 K99 F100	A62-Q68 CarbonylContact O-C 3.53Å; A62-Q68 VanDerWaalsContact O-CA 3.27Å; A62-Q68 WeakPolarHBondContact O-CA 3.3Å; A62-F69 PolarHBondContact N-O 3.46Å; A62-F69 PolarHBondContact O-N 3.02Å; A62-V71 HydrophobicContact CB-CG2 3.9Å; A62-V82 HydrophobicContact CB-CB 4.35Å; A62-V82 HydrophobicContact CB-CG1 4.34Å; A62-V82 HydrophobicContact CB-CG2 3.83Å; A62-V98 HydrophobicContact CB-CG1 3.97Å; A62-K99 CarbonylContact C-O 3.57Å; A62-K99 VanDerWaalsContact CA-O 3.3Å; A62-K99 WeakPolarHBondContact CA-O 3.35Å; A62-F100 HydrophobicContact CB-CD1 4.25Å; A62-F100 HydrophobicContact CB-CE1 4.09Å
63	D	93.8	Very high	87.4	Confident	13 Å²	13	58.4 Å²	58.4	7%	0.07	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	130	165.9	-171.4	-88.1	0	0	0	109.2	G66 R67 Q68 K99 F101	D63-G66 VanDerWaalsContact OD1-CA 3.22Å; D63-G66 WeakPolarHBondContact OD1-CA 3.41Å; D63-G66 PolarHBondContact OD1-N 3.12Å; D63-G66 VanDerWaalsContact OD2-C 3.23Å; D63-G66 WeakPolarHBondContact OD2-CA 3.22Å; D63-R67 WeakPolarHBondContact CA-O 3.41Å; D63-R67 PolarHBondContact OD2-N 3.36Å; D63-Q68 PolarHBondContact OD2-NE2 3.14Å; D63-K99 HydrophobicContact CB-CB 4.43Å; D63-K99 PolarHBondContact N-O 2.81Å; D63-K99 PolarHBondContact O-N 2.77Å; D63-F101 HydrophobicContact CB-CD2 4.21Å; D63-F101 HydrophobicContact CB-CE2 3.63Å
64	V	92.6	Very high	87.6	Confident	6 Å²	6	56.9 Å²	56.9	4%	0.036	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	115.7	175.1	-171.1	0	0	0	0	107.8	G66 R67 F69 W84 V98	V64-G66 PolarHBondContact O-N 2.79Å; V64-R67 PolarHBondContact N-O 2.95Å; V64-R67 PolarHBondContact O-N 2.61Å; V64-F69 HydrophobicContact CB-CD2 4.39Å; V64-F69 HydrophobicContact CB-CE2 4.16Å; V64-F69 HydrophobicContact CG2-CD2 4.17Å; V64-F69 HydrophobicContact CG2-CE2 4.37Å; V64-W84 HydrophobicContact CG1-CZ2 4.14Å; V64-W84 HydrophobicContact CG2-CD2 4.25Å; V64-W84 HydrophobicContact CG2-CE3 4.27Å; V64-W84 HydrophobicContact CG2-CH2 4.33Å; V64-W84 HydrophobicContact CG2-CZ2 4.28Å; V64-W84 HydrophobicContact CG2-CZ3 4.31Å; V64-V98 HydrophobicContact CG2-CB 4.29Å; V64-V98 HydrophobicContact CG2-CG1 3.94Å; V64-V98 HydrophobicContact CG2-CG2 3.89Å
65	N	88.6	Confident	87.8	Confident	134 Å²	134	64.4 Å²	64.4	72%	0.717	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	39	-177.9	-71.7	-44.1	0	0	0	113.7	R67	N65-R67 VanDerWaalsContact C-N 3.3Å; N65-R67 PolarHBondContact O-N 3.03Å
66	G	87.6	Confident	88	Confident	43 Å²	43	68.5 Å²	68.5	44%	0.443	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	7	179.3	0	0	0	0	0	114.7	D63 V64 Q68	D63-G66 VanDerWaalsContact OD1-CA 3.22Å; D63-G66 WeakPolarHBondContact OD1-CA 3.41Å; D63-G66 PolarHBondContact OD1-N 3.12Å; D63-G66 VanDerWaalsContact OD2-C 3.23Å; D63-G66 WeakPolarHBondContact OD2-CA 3.22Å; V64-G66 PolarHBondContact O-N 2.79Å; G66-Q68 PolarHBondContact O-NE2 3.24Å
67	R	90.1	Very high	88.4	Confident	162 Å²	162	67.6 Å²	67.6	61%	0.611	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.1	127.6	172.4	-63.7	-175.2	179.8	-141.9	0.3	109.9	D63 V64 N65 F69	D63-R67 WeakPolarHBondContact CA-O 3.41Å; D63-R67 PolarHBondContact OD2-N 3.36Å; V64-R67 PolarHBondContact N-O 2.95Å; V64-R67 PolarHBondContact O-N 2.61Å; N65-R67 VanDerWaalsContact C-N 3.3Å; N65-R67 PolarHBondContact O-N 3.03Å; R67-F69 HydrophobicContact CB-CE2 3.77Å; R67-F69 HydrophobicContact CB-CZ 4.08Å; R67-F69 WeakPolarHBondContact O-CD2 3.42Å
68	Q	91.1	Very high	88.8	Confident	63 Å²	63	63.9 Å²	63.9	29%	0.294	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	133.2	-177.7	-56.2	73.9	46.9	0	0	110.6	A62 D63 G66 Y106 L109	A62-Q68 CarbonylContact O-C 3.53Å; A62-Q68 VanDerWaalsContact O-CA 3.27Å; A62-Q68 WeakPolarHBondContact O-CA 3.3Å; D63-Q68 PolarHBondContact OD2-NE2 3.14Å; G66-Q68 PolarHBondContact O-NE2 3.24Å; Q68-Y106 HydrophobicContact CB-CE2 3.88Å; Q68-Y106 HydrophobicContact CG-CE2 3.74Å; Q68-L109 HydrophobicContact CG-CD2 4.31Å
69	F	93.8	Very high	89.1	Confident	45 Å²	45	68.3 Å²	68.3	20%	0.197	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	138.5	176.8	-63.4	-81.2	0	0	0	110.2	A62 V64 R67 V82 W84	A62-F69 PolarHBondContact N-O 3.46Å; A62-F69 PolarHBondContact O-N 3.02Å; V64-F69 HydrophobicContact CB-CD2 4.39Å; V64-F69 HydrophobicContact CB-CE2 4.16Å; V64-F69 HydrophobicContact CG2-CD2 4.17Å; V64-F69 HydrophobicContact CG2-CE2 4.37Å; R67-F69 HydrophobicContact CB-CE2 3.77Å; R67-F69 HydrophobicContact CB-CZ 4.08Å; R67-F69 WeakPolarHBondContact O-CD2 3.42Å; F69-V82 HydrophobicContact CB-CG2 3.82Å; F69-W84 HydrophobicContact CD1-CB 3.83Å; F69-W84 HydrophobicContact CD2-CB 4.19Å; F69-W84 HydrophobicContact CE1-CB 3.5Å; F69-W84 HydrophobicContact CE2-CB 3.89Å; F69-W84 HydrophobicContact CE2-CG 4.17Å; F69-W84 HydrophobicContact CG-CB 4.16Å; F69-W84 HydrophobicContact CZ-CB 3.53Å; F69-W84 HydrophobicContact CZ-CG 4.17Å
70	P	92.1	Very high	89.3	Confident	93 Å²	93	66.3 Å²	66.3	60%	0.604	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	138.9	174.4	30	-33.6	0	0	0	110.2
71	V	93.4	Very high	89.5	Confident	18 Å²	18	69.7 Å²	69.7	11%	0.109	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-96.4	125.3	172.2	-172.1	0	0	0	0	108.5	L60 A62 Y80 V82 F100	L60-V71 HydrophobicContact CB-CB 3.99Å; L60-V71 HydrophobicContact CB-CG1 4.3Å; L60-V71 HydrophobicContact CB-CG2 3.98Å; L60-V71 VanDerWaalsContact O-CB 3.26Å; L60-V71 WeakPolarHBondContact O-CB 3.49Å; L60-V71 WeakPolarHBondContact O-CG2 3.3Å; L60-V71 PolarHBondContact O-N 3.31Å; A62-V71 HydrophobicContact CB-CG2 3.9Å; V71-Y80 HydrophobicContact CG1-CD1 4Å; V71-Y80 HydrophobicContact CG1-CG 4.34Å; V71-V82 HydrophobicContact CG2-CB 4.26Å; V71-F100 HydrophobicContact CG2-CD1 4.04Å; V71-F100 HydrophobicContact CG2-CE1 3.94Å
72	T	91.1	Very high	89.5	Confident	95 Å²	95	67 Å²	67	58%	0.583	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	143.2	177.6	-50.4	0	0	0	0	109.4	Y80 Q81	T72-Y80 CarbonylContact O-C 3.55Å; T72-Y80 WeakPolarHBondContact O-CA 3.02Å; T72-Q81 PolarHBondContact N-O 3.15Å; T72-Q81 PolarHBondContact O-N 3.07Å
73	R	89.5	Confident	89.5	Confident	109 Å²	109	70.2 Å²	70.2	41%	0.411	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	135.8	171.4	-58.9	-164.9	-170.1	85.7	-8.4	109.7	S57 V58 T59 K79 Y80	S57-R73 PolarHBondContact O-NH2 3.31Å; V58-R73 VanDerWaalsContact O-CZ 3.3Å; V58-R73 PolarHBondContact O-NE 3.39Å; V58-R73 PolarHBondContact O-NH2 2.99Å; T59-R73 PolarHBondContact OG1-NH2 3.2Å; R73-K79 WeakPolarHBondContact CA-O 3.3Å; R73-Y80 HydrophobicContact CG-CD1 3.84Å; R73-Y80 HydrophobicContact CG-CE1 3.56Å
74	G	83.2	Confident	89.5	Confident	35 Å²	35	70 Å²	70	36%	0.361	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-69.4	172.7	171.4	0	0	0	0	0	111.7	D76 K79	G74-D76 VanDerWaalsContact C-N 3.25Å; G74-D76 PolarHBondContact O-N 3.07Å; G74-K79 PolarHBondContact N-O 3.31Å
75	Q	81.1	Confident	89.5	Confident	203 Å²	203	72.3 Å²	72.3	95%	0.949	39%	0.391	S	S	*	.	S	Bend	trans	-68.4	-27.6	177.3	-170.3	171.5	-6.3	0	0	112.4
76	D	82.1	Confident	89.6	Confident	91 Å²	91	67 Å²	67	49%	0.487	36%	0.362	S	S	.	.	S	Bend	trans	-87.1	144	174.7	-56.3	-47.9	0	0	0	111.4	G74 G78 K79	G74-D76 VanDerWaalsContact C-N 3.25Å; G74-D76 PolarHBondContact O-N 3.07Å; D76-G78 PolarHBondContact O-N 2.96Å; D76-K79 HydrophobicContact CB-CD 3.76Å; D76-K79 HydrophobicContact CB-CG 3.98Å; D76-K79 PolarHBondContact O-N 3.41Å; D76-K79 VanDerWaalsContact OD2-CE 3.23Å; D76-K79 WeakPolarHBondContact OD2-CE 3.35Å; D76-K79 IonicContact OD2-NZ 2.66Å; D76-K79 PolarHBondContact OD2-NZ 2.89Å
77	V	81.4	Confident	89.8	Confident	106 Å²	106	67.1 Å²	67.1	64%	0.642	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	131	178	-177.2	0	0	0	0	110.5	Q56 K79	Q56-V77 HydrophobicContact CB-CG1 3.73Å; Q56-V77 HydrophobicContact CG-CG1 3.63Å; Q56-V77 VanDerWaalsContact OE1-CG1 3.3Å; V77-K79 VanDerWaalsContact C-N 3.26Å; V77-K79 PolarHBondContact O-N 3.42Å
78	G	82.7	Confident	89.6	Confident	10 Å²	10	61.2 Å²	61.2	10%	0.103	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.5	0.6	177.6	0	0	0	0	0	114.9	S48 L49 D76 Y80	S48-G78 CarbonylContact C-O 3.59Å; S48-G78 WeakPolarHBondContact CA-O 3.34Å; L49-G78 PolarHBondContact N-O 3.15Å; D76-G78 PolarHBondContact O-N 2.96Å; G78-Y80 VanDerWaalsContact O-CD2 3.3Å; G78-Y80 WeakPolarHBondContact O-CD2 3.43Å
79	K	90.5	Very high	89.2	Confident	103 Å²	103	68.1 Å²	68.1	45%	0.448	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	134.1	171.6	-66	-167.4	-172.6	170.3	0	110.9	L47 R73 G74 D76 V77	L47-K79 CarbonylContact O-C 3.59Å; L47-K79 WeakPolarHBondContact O-CA 3.49Å; R73-K79 WeakPolarHBondContact CA-O 3.3Å; G74-K79 PolarHBondContact N-O 3.31Å; D76-K79 HydrophobicContact CB-CD 3.76Å; D76-K79 HydrophobicContact CB-CG 3.98Å; D76-K79 PolarHBondContact O-N 3.41Å; D76-K79 VanDerWaalsContact OD2-CE 3.23Å; D76-K79 WeakPolarHBondContact OD2-CE 3.35Å; D76-K79 IonicContact OD2-NZ 2.66Å; D76-K79 PolarHBondContact OD2-NZ 2.89Å; V77-K79 VanDerWaalsContact C-N 3.26Å; V77-K79 PolarHBondContact O-N 3.42Å
80	Y	92.1	Very high	88.9	Confident	6 Å²	6	71.5 Å²	71.5	2%	0.024	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	148	178.8	-64.3	-96.9	0	0	0	109.5	E46 L47 L49 Q56 V58 L60 V71 T72 R73 G78	E46-Y80 CarbonylContact C-O 3.55Å; E46-Y80 WeakPolarHBondContact CA-O 3.41Å; L47-Y80 HydrophobicContact CD1-CD2 3.79Å; L47-Y80 HydrophobicContact CD1-CG 4.02Å; L47-Y80 PolarHBondContact N-O 3.23Å; L47-Y80 PolarHBondContact O-N 3.15Å; L49-Y80 HydrophobicContact CB-CD2 3.91Å; L49-Y80 HydrophobicContact CB-CE2 3.74Å; L49-Y80 HydrophobicContact CD2-CE2 3.96Å; L49-Y80 HydrophobicContact CG-CE2 4.49Å; Q56-Y80 PolarHBondContact O-OH 3.35Å; V58-Y80 VanDerWaalsContact O-CE1 3.24Å; V58-Y80 WeakPolarHBondContact O-CE1 3.4Å; V58-Y80 PolarHBondContact O-OH 3.44Å; V58-Y80 VanDerWaalsContact O-OH 3.05Å; L60-Y80 HydrophobicContact CD1-CD1 3.92Å; L60-Y80 HydrophobicContact CD1-CD2 4.43Å; L60-Y80 HydrophobicContact CD1-CE1 4.06Å; L60-Y80 HydrophobicContact CD1-CG 4.13Å; L60-Y80 HydrophobicContact CG-CD1 4.36Å; L60-Y80 HydrophobicContact CG-CE1 4.21Å; V71-Y80 HydrophobicContact CG1-CD1 4Å; V71-Y80 HydrophobicContact CG1-CG 4.34Å; T72-Y80 CarbonylContact O-C 3.55Å; T72-Y80 WeakPolarHBondContact O-CA 3.02Å; R73-Y80 HydrophobicContact CG-CD1 3.84Å; R73-Y80 HydrophobicContact CG-CE1 3.56Å; G78-Y80 VanDerWaalsContact O-CD2 3.3Å; G78-Y80 WeakPolarHBondContact O-CD2 3.43Å
81	Q	93.9	Very high	88.6	Confident	71 Å²	71	67.1 Å²	67.1	33%	0.332	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	131.7	-179.4	-173.2	-179.1	-5.1	0	0	110	I44 V45 E46 T72	I44-Q81 HydrophobicContact CG2-CG 3.96Å; I44-Q81 VanDerWaalsContact CG2-NE2 3.3Å; V45-Q81 CarbonylContact O-C 3.56Å; V45-Q81 VanDerWaalsContact O-CA 3.28Å; V45-Q81 WeakPolarHBondContact O-CA 3.34Å; E46-Q81 HydrophobicContact CG-CB 4.42Å; E46-Q81 HydrophobicContact CG-CG 4.04Å; T72-Q81 PolarHBondContact N-O 3.15Å; T72-Q81 PolarHBondContact O-N 3.07Å
82	V	95.2	Very high	88.3	Confident	1 Å²	1	69.9 Å²	69.9	1%	0.006	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	140.1	167.9	58.6	0	0	0	0	109	V45 A62 F69 V71 W84 F100	V45-V82 HydrophobicContact CB-CG1 3.79Å; V45-V82 HydrophobicContact CG2-CG1 4.34Å; V45-V82 PolarHBondContact N-O 3.37Å; V45-V82 PolarHBondContact O-N 3.42Å; A62-V82 HydrophobicContact CB-CB 4.35Å; A62-V82 HydrophobicContact CB-CG1 4.34Å; A62-V82 HydrophobicContact CB-CG2 3.83Å; F69-V82 HydrophobicContact CB-CG2 3.82Å; V71-V82 HydrophobicContact CG2-CB 4.26Å; V82-W84 HydrophobicContact CG1-CZ3 4.27Å; V82-W84 HydrophobicContact CG2-CE3 4.35Å; V82-F100 HydrophobicContact CG1-CE1 3.96Å; V82-F100 HydrophobicContact CG1-CZ 3.85Å
83	S	94.1	Very high	88.2	Confident	67 Å²	67	69.3 Å²	69.3	47%	0.469	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	146	173.6	59.7	0	0	0	0	111.1	F43	F43-S83 WeakPolarHBondContact O-CA 3.15Å; F43-S83 WeakPolarHBondContact O-CB 3.38Å
84	W	94.2	Very high	88.3	Confident	10 Å²	10	65.7 Å²	65.7	4%	0.038	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	158.2	172.6	69.2	96.9	0	0	0	109.8	F43 V45 V64 F69 V82 V98 I130	F43-W84 HydrophobicContact CB-CD2 3.71Å; F43-W84 HydrophobicContact CB-CE3 4.02Å; F43-W84 HydrophobicContact CB-CG 4.36Å; F43-W84 HydrophobicContact CB-CH2 3.67Å; F43-W84 HydrophobicContact CB-CZ2 3.34Å; F43-W84 HydrophobicContact CB-CZ3 4Å; F43-W84 AromaticContact CD1-CZ2 3.87Å; F43-W84 HydrophobicContact CD1-CZ2 3.87Å; F43-W84 AromaticContact CD2-CE2 3.93Å; F43-W84 HydrophobicContact CD2-CZ2 4.33Å; F43-W84 AromaticContact CD2-NE1 3.47Å; F43-W84 HydrophobicContact CG-CD2 4.39Å; F43-W84 AromaticContact CG-CE2 3.61Å; F43-W84 HydrophobicContact CG-CH2 4.36Å; F43-W84 AromaticContact CG-CZ2 3.6Å; F43-W84 HydrophobicContact CG-CZ2 3.6Å; F43-W84 AromaticContact CG-NE1 3.66Å; F43-W84 PolarHBondContact N-O 2.9Å; F43-W84 PolarHBondContact O-N 2.78Å; V45-W84 HydrophobicContact CG2-CH2 3.68Å; V45-W84 HydrophobicContact CG2-CZ3 3.59Å; V64-W84 HydrophobicContact CG1-CZ2 4.14Å; V64-W84 HydrophobicContact CG2-CD2 4.25Å; V64-W84 HydrophobicContact CG2-CE3 4.27Å; V64-W84 HydrophobicContact CG2-CH2 4.33Å; V64-W84 HydrophobicContact CG2-CZ2 4.28Å; V64-W84 HydrophobicContact CG2-CZ3 4.31Å; F69-W84 HydrophobicContact CD1-CB 3.83Å; F69-W84 HydrophobicContact CD2-CB 4.19Å; F69-W84 HydrophobicContact CE1-CB 3.5Å; F69-W84 HydrophobicContact CE2-CB 3.89Å; F69-W84 HydrophobicContact CE2-CG 4.17Å; F69-W84 HydrophobicContact CG-CB 4.16Å; F69-W84 HydrophobicContact CZ-CB 3.53Å; F69-W84 HydrophobicContact CZ-CG 4.17Å; V82-W84 HydrophobicContact CG1-CZ3 4.27Å; V82-W84 HydrophobicContact CG2-CE3 4.35Å; W84-V98 HydrophobicContact CH2-CG2 3.45Å; W84-V98 VanDerWaalsContact CH2-CG2 3.45Å; W84-V98 HydrophobicContact CZ2-CG2 4.17Å; W84-V98 HydrophobicContact CZ3-CG2 4Å; W84-I130 HydrophobicContact CH2-CD1 3.66Å; W84-I130 HydrophobicContact CZ2-CD1 4.44Å
85	S	92.1	Very high	88.7	Confident	54 Å²	54	68.3 Å²	68.3	38%	0.378	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	147.3	172.6	65.2	0	0	0	0	110.8	E40 S41	E40-S85 VanDerWaalsContact OE2-CB 3.24Å; E40-S85 WeakPolarHBondContact OE2-CB 3.4Å; E40-S85 PolarHBondContact OE2-OG 3.41Å; S41-S85 CarbonylContact O-C 3.49Å; S41-S85 VanDerWaalsContact O-CA 3.29Å; S41-S85 WeakPolarHBondContact O-CA 3.43Å
86	L	91.3	Very high	89.3	Confident	22 Å²	22	59.5 Å²	59.5	12%	0.115	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	142.1	172.2	-67.3	173.1	0	0	0	109	E40 S41 F43 A91 Y96	E40-L86 CarbonylContact C-O 3.5Å; E40-L86 WeakPolarHBondContact CA-O 3.4Å; S41-L86 PolarHBondContact N-O 3.21Å; S41-L86 PolarHBondContact O-N 3.05Å; F43-L86 HydrophobicContact CE2-CB 4.21Å; F43-L86 HydrophobicContact CE2-CD1 3.96Å; F43-L86 HydrophobicContact CE2-CG 4.28Å; F43-L86 HydrophobicContact CZ-CD1 4.47Å; L86-A91 HydrophobicContact CB-CB 4.07Å; L86-Y96 HydrophobicContact CD1-CD1 4.45Å; L86-Y96 HydrophobicContact CD1-CE1 3.84Å
87	P	90.1	Very high	89.8	Confident	45 Å²	45	59.1 Å²	59.1	29%	0.292	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	142.2	170.4	-23.7	33.6	0	0	0	110.7	K89 Q90 A91	P87-K89 PolarHBondContact O-N 2.78Å; P87-Q90 CarbonylContact O-C 3.57Å; P87-Q90 WeakPolarHBondContact O-CA 3.26Å; P87-Q90 PolarHBondContact O-N 2.93Å; P87-A91 PolarHBondContact O-N 2.86Å
88	H	86.1	Confident	90.5	Very high	39 Å²	39	54.1 Å²	54.1	18%	0.181	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-31	-177.1	-68.6	-50.9	0	0	0	114.6	A35 S38 S39 E40 S41 Q90 A91	A35-H88 WeakPolarHBondContact CA-NE2 3.43Å; A35-H88 HydrophobicContact CB-CB 4.46Å; S38-H88 PolarHBondContact O-CD2 3.47Å; S38-H88 VanDerWaalsContact O-CD2 3.26Å; S38-H88 PolarHBondContact O-NE2 2.92Å; S39-H88 PolarHBondContact O-CD2 2.95Å; E40-H88 PolarHBondContact N-NE2 2.78Å; E40-H88 PolarHBondContact O-CE1 2.69Å; E40-H88 VanDerWaalsContact O-CE1 3.27Å; S41-H88 PolarHBondContact N-CE1 3.44Å; S41-H88 VanDerWaalsContact N-CE1 3.34Å; S41-H88 PolarHBondContact N-ND1 3.13Å; S41-H88 PolarHBondContact OG-CE1 3Å; S41-H88 VanDerWaalsContact OG-CE1 3.24Å; S41-H88 PolarHBondContact OG-ND1 2.94Å; H88-Q90 VanDerWaalsContact C-N 3.26Å; H88-Q90 PolarHBondContact O-N 3.07Å; H88-A91 PolarHBondContact O-N 2.89Å
89	K	84.1	Confident	91	Very high	207 Å²	207	56.5 Å²	56.5	90%	0.9	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-27.7	175.7	-63.6	-175.4	179.3	-179.2	0	113.3	P87	P87-K89 PolarHBondContact O-N 2.78Å
90	Q	86.3	Confident	91.1	Very high	116 Å²	116	51.6 Å²	51.6	54%	0.542	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-26.3	178.9	-61.1	-179.6	24.6	0	0	111.4	P87 H88 S92 Y96	P87-Q90 CarbonylContact O-C 3.57Å; P87-Q90 WeakPolarHBondContact O-CA 3.26Å; P87-Q90 PolarHBondContact O-N 2.93Å; H88-Q90 VanDerWaalsContact C-N 3.26Å; H88-Q90 PolarHBondContact O-N 3.07Å; Q90-S92 PolarHBondContact O-N 3.44Å; Q90-Y96 PolarHBondContact O-OH 3.05Å
91	A	86.9	Confident	91.1	Very high	2 Å²	2	51.6 Å²	51.6	2%	0.017	29%	0.286	C	S	.	.	S	Bend	trans	-78.9	55.4	174.2	0	0	0	0	0	112.1	F43 L86 P87 H88 Y96 H132	F43-A91 HydrophobicContact CE2-CB 4.16Å; F43-A91 HydrophobicContact CZ-CB 4.14Å; L86-A91 HydrophobicContact CB-CB 4.07Å; P87-A91 PolarHBondContact O-N 2.86Å; H88-A91 PolarHBondContact O-N 2.89Å; A91-Y96 VanDerWaalsContact C-OH 3.31Å; A91-Y96 WeakPolarHBondContact CA-OH 3.3Å; A91-H132 PolarHBondContact O-CD2 2.87Å; A91-H132 PolarHBondContact O-NE2 2.95Å
92	S	86.8	Confident	91	Very high	75 Å²	75	49.5 Å²	49.5	52%	0.524	28%	0.277	S	S	.	.			trans	-66.3	157.8	176.2	66.1	0	0	0	0	112.1	Q90 G94 Y96	Q90-S92 PolarHBondContact O-N 3.44Å; S92-G94 PolarHBondContact O-N 2.9Å; S92-Y96 PolarHBondContact N-OH 2.99Å; S92-Y96 VanDerWaalsContact N-OH 3.09Å; S92-Y96 WeakPolarHBondContact O-CE2 3.45Å; S92-Y96 PolarHBondContact O-OH 3.32Å
93	S	89.6	Confident	90.7	Very high	84 Å²	84	55.4 Å²	55.4	59%	0.587	31%	0.305	S	S	*	.	S	Bend	trans	-63.3	130.7	174.3	59.9	0	0	0	0	110.6	H132 R133	S93-H132 CarbonylContact C-O 3.59Å; S93-H132 VanDerWaalsContact CA-O 3.23Å; S93-H132 WeakPolarHBondContact CA-O 3.37Å; S93-R133 WeakPolarHBondContact CB-O 3.24Å
94	G	90.8	Very high	90.4	Very high	32 Å²	32	59.3 Å²	59.3	33%	0.33	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	159.9	-177.9	-179.5	0	0	0	0	0	112.3	S92 H132	S92-G94 PolarHBondContact O-N 2.9Å; G94-H132 PolarHBondContact N-O 2.8Å; G94-H132 PolarHBondContact O-N 2.69Å
95	T	92.4	Very high	90.1	Very high	90 Å²	90	59.7 Å²	59.7	55%	0.552	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	120.8	179.2	-49	0	0	0	0	110	N129 I130 D131	T95-N129 HydrophobicContact CG2-CB 3.7Å; T95-I130 CarbonylContact C-O 3.49Å; T95-I130 VanDerWaalsContact CA-O 3.3Å; T95-I130 WeakPolarHBondContact CA-O 3.35Å; T95-D131 WeakPolarHBondContact CB-OD1 3.39Å; T95-D131 WeakPolarHBondContact CG2-OD1 3.33Å; T95-D131 PolarHBondContact OG1-OD1 3.09Å
96	Y	92.4	Very high	90.1	Very high	18 Å²	18	58.7 Å²	58.7	7%	0.071	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	122.3	174.6	-68.5	-99.4	0	0	0	109	F43 L86 Q90 A91 S92 I130 H132	F43-Y96 HydrophobicContact CE1-CD2 4.05Å; F43-Y96 HydrophobicContact CE1-CE2 4.13Å; F43-Y96 HydrophobicContact CE1-CG 4.43Å; F43-Y96 HydrophobicContact CZ-CE2 4.23Å; L86-Y96 HydrophobicContact CD1-CD1 4.45Å; L86-Y96 HydrophobicContact CD1-CE1 3.84Å; Q90-Y96 PolarHBondContact O-OH 3.05Å; A91-Y96 VanDerWaalsContact C-OH 3.31Å; A91-Y96 WeakPolarHBondContact CA-OH 3.3Å; S92-Y96 PolarHBondContact N-OH 2.99Å; S92-Y96 VanDerWaalsContact N-OH 3.09Å; S92-Y96 WeakPolarHBondContact O-CE2 3.45Å; S92-Y96 PolarHBondContact O-OH 3.32Å; Y96-I130 PolarHBondContact N-O 2.81Å; Y96-I130 PolarHBondContact O-N 3.29Å; Y96-H132 HydrophobicContact CD2-CB 3.92Å; Y96-H132 HydrophobicContact CE2-CB 3.7Å
97	Q	93.4	Very high	90	Very high	84 Å²	84	61.1 Å²	61.1	39%	0.393	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	120.9	174.9	-176.8	175.3	86.1	0	0	109.8	K99	Q97-K99 HydrophobicContact CG-CG 4.34Å
98	V	94.8	Very high	90	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	119.7	173.2	-174.2	0	0	0	0	108.2	A62 V64 W84 F100 T127 V128 I130	A62-V98 HydrophobicContact CB-CG1 3.97Å; V64-V98 HydrophobicContact CG2-CB 4.29Å; V64-V98 HydrophobicContact CG2-CG1 3.94Å; V64-V98 HydrophobicContact CG2-CG2 3.89Å; W84-V98 HydrophobicContact CH2-CG2 3.45Å; W84-V98 VanDerWaalsContact CH2-CG2 3.45Å; W84-V98 HydrophobicContact CZ2-CG2 4.17Å; W84-V98 HydrophobicContact CZ3-CG2 4Å; V98-F100 HydrophobicContact CB-CE2 4Å; V98-F100 HydrophobicContact CG1-CD2 4.13Å; V98-F100 HydrophobicContact CG1-CE1 4.4Å; V98-F100 HydrophobicContact CG1-CE2 3.48Å; V98-F100 VanDerWaalsContact CG1-CE2 3.48Å; V98-F100 HydrophobicContact CG1-CZ 3.64Å; V98-T127 WeakPolarHBondContact O-CA 3.42Å; V98-V128 PolarHBondContact N-O 2.79Å; V98-V128 PolarHBondContact O-N 3.17Å; V98-I130 HydrophobicContact CB-CD1 4.48Å; V98-I130 HydrophobicContact CG2-CD1 3.37Å
99	K	94.2	Very high	90.2	Very high	61 Å²	61	59.3 Å²	59.3	27%	0.265	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	126	178.8	-61.3	-180	-177.7	177.8	0	108.7	A62 D63 Q97 F101 P124 T127	A62-K99 CarbonylContact C-O 3.57Å; A62-K99 VanDerWaalsContact CA-O 3.3Å; A62-K99 WeakPolarHBondContact CA-O 3.35Å; D63-K99 HydrophobicContact CB-CB 4.43Å; D63-K99 PolarHBondContact N-O 2.81Å; D63-K99 PolarHBondContact O-N 2.77Å; Q97-K99 HydrophobicContact CG-CG 4.34Å; K99-F101 HydrophobicContact CB-CD2 4.47Å; K99-F101 HydrophobicContact CB-CE2 3.62Å; K99-F101 HydrophobicContact CB-CZ 4.06Å; K99-F101 HydrophobicContact CD-CZ 4.45Å; K99-P124 HydrophobicContact CB-CB 3.99Å; K99-P124 HydrophobicContact CB-CG 4.42Å; K99-P124 HydrophobicContact CG-CG 4.47Å; K99-T127 HydrophobicContact CB-CG2 4.43Å; K99-T127 HydrophobicContact CG-CG2 3.96Å
100	F	93.4	Very high	90.4	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	134.8	177.3	-69.1	-92.8	0	0	0	110.2	V45 L47 Y61 A62 V71 V82 V98 P124 L125 F126 V128	V45-F100 HydrophobicContact CG1-CZ 4.47Å; L47-F100 HydrophobicContact CD2-CD1 4.04Å; L47-F100 HydrophobicContact CD2-CE1 3.35Å; L47-F100 HydrophobicContact CD2-CE2 3.97Å; L47-F100 HydrophobicContact CD2-CZ 3.3Å; Y61-F100 CarbonylContact O-C 3.55Å; Y61-F100 WeakPolarHBondContact O-CA 3.49Å; A62-F100 HydrophobicContact CB-CD1 4.25Å; A62-F100 HydrophobicContact CB-CE1 4.09Å; V71-F100 HydrophobicContact CG2-CD1 4.04Å; V71-F100 HydrophobicContact CG2-CE1 3.94Å; V82-F100 HydrophobicContact CG1-CE1 3.96Å; V82-F100 HydrophobicContact CG1-CZ 3.85Å; V98-F100 HydrophobicContact CB-CE2 4Å; V98-F100 HydrophobicContact CG1-CD2 4.13Å; V98-F100 HydrophobicContact CG1-CE1 4.4Å; V98-F100 HydrophobicContact CG1-CE2 3.48Å; V98-F100 VanDerWaalsContact CG1-CE2 3.48Å; V98-F100 HydrophobicContact CG1-CZ 3.64Å; F100-P124 CarbonylContact O-C 3.47Å; F100-P124 WeakPolarHBondContact O-CB 3.42Å; F100-L125 WeakPolarHBondContact O-CB 3.16Å; F100-L125 PolarHBondContact O-N 3.04Å; F100-F126 HydrophobicContact CB-CD1 4.35Å; F100-F126 HydrophobicContact CB-CD2 3.94Å; F100-F126 HydrophobicContact CB-CE1 4.01Å; F100-F126 HydrophobicContact CB-CE2 3.58Å; F100-F126 HydrophobicContact CB-CG 4.31Å; F100-F126 HydrophobicContact CB-CZ 3.6Å; F100-F126 HydrophobicContact CD1-CE2 4.12Å; F100-F126 HydrophobicContact CD1-CZ 4.14Å; F100-F126 AromaticContact CD2-CD2 3.62Å; F100-F126 HydrophobicContact CD2-CD2 3.62Å; F100-F126 AromaticContact CD2-CE2 3.19Å; F100-F126 HydrophobicContact CD2-CE2 3.19Å; F100-F126 AromaticContact CD2-CZ 4Å; F100-F126 HydrophobicContact CD2-CZ 4Å; F100-F126 HydrophobicContact CE2-CD2 4.44Å; F100-F126 AromaticContact CE2-CE2 3.84Å; F100-F126 HydrophobicContact CE2-CE2 3.84Å; F100-F126 HydrophobicContact CG-CD2 4.01Å; F100-F126 AromaticContact CG-CE2 3.35Å; F100-F126 HydrophobicContact CG-CE2 3.35Å; F100-F126 AromaticContact CG-CZ 3.64Å; F100-F126 HydrophobicContact CG-CZ 3.64Å; F100-F126 PolarHBondContact N-O 3.02Å; F100-V128 HydrophobicContact CD2-CG2 4.23Å; F100-V128 HydrophobicContact CE2-CB 4.12Å; F100-V128 HydrophobicContact CE2-CG2 3.78Å
101	F	92.2	Very high	90.7	Very high	5 Å²	5	55.9 Å²	55.9	2%	0.022	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	144.2	-178.8	-64.7	-85	0	0	0	109.2	L60 Y61 D63 K99 S105 L109 I122 P124	L60-F101 WeakPolarHBondContact CA-O 3.23Å; Y61-F101 PolarHBondContact N-O 2.81Å; Y61-F101 PolarHBondContact O-N 2.84Å; D63-F101 HydrophobicContact CB-CD2 4.21Å; D63-F101 HydrophobicContact CB-CE2 3.63Å; K99-F101 HydrophobicContact CB-CD2 4.47Å; K99-F101 HydrophobicContact CB-CE2 3.62Å; K99-F101 HydrophobicContact CB-CZ 4.06Å; K99-F101 HydrophobicContact CD-CZ 4.45Å; F101-S105 WeakPolarHBondContact CB-OG 3.47Å; F101-L109 HydrophobicContact CD2-CD2 4.27Å; F101-L109 HydrophobicContact CE1-CD1 4.29Å; F101-L109 HydrophobicContact CE2-CD2 4.02Å; F101-L109 HydrophobicContact CZ-CD1 4.11Å; F101-L109 HydrophobicContact CZ-CD2 4.19Å; F101-I122 HydrophobicContact CE1-CG2 4.15Å; F101-P124 HydrophobicContact CD1-CB 4.26Å; F101-P124 HydrophobicContact CE1-CB 3.79Å; F101-P124 HydrophobicContact CE2-CB 4.36Å; F101-P124 HydrophobicContact CZ-CB 3.86Å
102	D	90.8	Very high	90.8	Very high	27 Å²	27	56 Å²	56	14%	0.144	30%	0.303	C	S	.	.			trans	-80.8	177.8	165	68	0.2	0	0	0	110.5	E104 S105 Y106	D102-E104 VanDerWaalsContact C-N 3.31Å; D102-E104 PolarHBondContact O-N 3.36Å; D102-E104 PolarHBondContact OD1-N 2.8Å; D102-S105 PolarHBondContact N-OG 3.37Å; D102-S105 VanDerWaalsContact N-OG 3.15Å; D102-S105 PolarHBondContact O-OG 3.21Å; D102-S105 WeakPolarHBondContact OD1-CB 3.49Å; D102-S105 PolarHBondContact OD1-N 3.19Å; D102-S105 PolarHBondContact OD1-OG 3.45Å; D102-Y106 WeakPolarHBondContact O-CB 3.23Å; D102-Y106 PolarHBondContact O-N 3.01Å
103	E	88.6	Confident	90.8	Very high	125 Å²	125	55.1 Å²	55.1	58%	0.584	29%	0.291	S	S	*	.	H	α-helix	trans	-62.8	-37.1	-177.3	-169.4	167.7	172.3	0	0	113	S107	E103-S107 WeakPolarHBondContact O-CB 3.35Å; E103-S107 PolarHBondContact O-N 3.2Å; E103-S107 VanDerWaalsContact O-N 3.07Å
104	E	88.1	Confident	90.8	Very high	149 Å²	149	60.2 Å²	60.2	70%	0.696	30%	0.297	S	S	*	.	H	α-helix	trans	-68.9	-55.6	179.7	-174.5	177.8	176.9	0	0	111.4	D102 Y106 S107 A108	D102-E104 VanDerWaalsContact C-N 3.31Å; D102-E104 PolarHBondContact O-N 3.36Å; D102-E104 PolarHBondContact OD1-N 2.8Å; E104-Y106 VanDerWaalsContact C-N 3.29Å; E104-Y106 PolarHBondContact O-N 2.85Å; E104-S107 PolarHBondContact O-N 3.36Å; E104-S107 VanDerWaalsContact O-N 3.15Å; E104-S107 PolarHBondContact O-OG 2.75Å; E104-A108 PolarHBondContact O-N 3.09Å; E104-A108 VanDerWaalsContact O-N 3.13Å
105	S	88.5	Confident	90.8	Very high	19 Å²	19	62.8 Å²	62.8	13%	0.133	30%	0.303	C	S	.	.	H	α-helix	trans	-64.1	-33.8	179.1	61.7	0	0	0	0	112.2	F101 D102 A108 L109	F101-S105 WeakPolarHBondContact CB-OG 3.47Å; D102-S105 PolarHBondContact N-OG 3.37Å; D102-S105 VanDerWaalsContact N-OG 3.15Å; D102-S105 PolarHBondContact O-OG 3.21Å; D102-S105 WeakPolarHBondContact OD1-CB 3.49Å; D102-S105 PolarHBondContact OD1-N 3.19Å; D102-S105 PolarHBondContact OD1-OG 3.45Å; S105-A108 PolarHBondContact O-N 3.37Å; S105-L109 WeakPolarHBondContact O-CB 3.34Å; S105-L109 PolarHBondContact O-N 2.66Å
106	Y	90.6	Very high	90.3	Very high	33 Å²	33	66 Å²	66	13%	0.129	32%	0.317	C	S	.	.	H	α-helix	trans	-65.1	-40.7	173.5	-179.7	-114.4	0	0	0	112.6	Y61 Q68 D102 E104 A108 L109 R110	Y61-Y106 VanDerWaalsContact CB-CD2 3.47Å; Y61-Y106 AromaticContact CD1-CD1 3.97Å; Y61-Y106 HydrophobicContact CD1-CD1 3.97Å; Y61-Y106 HydrophobicContact CD1-CD2 4.35Å; Y61-Y106 AromaticContact CD1-CE1 3.65Å; Y61-Y106 HydrophobicContact CD1-CE1 3.65Å; Y61-Y106 HydrophobicContact CD1-CE2 4.07Å; Y61-Y106 HydrophobicContact CD1-CG 4.28Å; Y61-Y106 AromaticContact CD1-CZ 3.7Å; Y61-Y106 AromaticContact CD2-CD1 3.46Å; Y61-Y106 HydrophobicContact CD2-CD1 3.46Å; Y61-Y106 VanDerWaalsContact CD2-CD1 3.46Å; Y61-Y106 HydrophobicContact CD2-CD2 4.15Å; Y61-Y106 HydrophobicContact CD2-CE1 4.03Å; Y61-Y106 AromaticContact CD2-CG 3.5Å; Y61-Y106 HydrophobicContact CD2-CG 3.5Å; Y61-Y106 HydrophobicContact CE1-CD1 4.15Å; Y61-Y106 AromaticContact CE1-CE1 3.75Å; Y61-Y106 HydrophobicContact CE1-CE1 3.75Å; Y61-Y106 AromaticContact CE2-CD1 3.65Å; Y61-Y106 HydrophobicContact CE2-CD1 3.65Å; Y61-Y106 HydrophobicContact CE2-CE1 4.11Å; Y61-Y106 HydrophobicContact CE2-CG 4.17Å; Y61-Y106 AromaticContact CG-CD1 3.62Å; Y61-Y106 HydrophobicContact CG-CD1 3.62Å; Y61-Y106 AromaticContact CG-CD2 3.73Å; Y61-Y106 HydrophobicContact CG-CD2 3.73Å; Y61-Y106 AromaticContact CG-CE1 3.79Å; Y61-Y106 HydrophobicContact CG-CE1 3.79Å; Y61-Y106 AromaticContact CG-CE2 3.91Å; Y61-Y106 HydrophobicContact CG-CE2 3.91Å; Y61-Y106 AromaticContact CG-CG 3.57Å; Y61-Y106 HydrophobicContact CG-CG 3.57Å; Y61-Y106 AromaticContact CG-CZ 3.93Å; Y61-Y106 AromaticContact CZ-CD1 3.99Å; Y61-Y106 AromaticContact CZ-CE1 3.98Å; Q68-Y106 HydrophobicContact CB-CE2 3.88Å; Q68-Y106 HydrophobicContact CG-CE2 3.74Å; D102-Y106 WeakPolarHBondContact O-CB 3.23Å; D102-Y106 PolarHBondContact O-N 3.01Å; E104-Y106 VanDerWaalsContact C-N 3.29Å; E104-Y106 PolarHBondContact O-N 2.85Å; Y106-A108 VanDerWaalsContact C-N 3.31Å; Y106-A108 PolarHBondContact O-N 3.4Å; Y106-L109 WeakPolarHBondContact O-CB 3.41Å; Y106-L109 PolarHBondContact O-N 2.9Å; Y106-R110 HydrophobicContact CE1-CG 4.4Å; Y106-R110 HydrophobicContact CE2-CG 4.22Å; Y106-R110 VanDerWaalsContact CZ-CD 3.49Å; Y106-R110 PolarHBondContact O-N 2.77Å
107	S	89.6	Confident	90	Very high	73 Å²	73	70.2 Å²	70.2	51%	0.51	34%	0.337	S	S	.	.	H	α-helix	trans	-63.4	-39.6	176.6	79.7	0	0	0	0	111.6	E103 E104 K111	E103-S107 WeakPolarHBondContact O-CB 3.35Å; E103-S107 PolarHBondContact O-N 3.2Å; E103-S107 VanDerWaalsContact O-N 3.07Å; E104-S107 PolarHBondContact O-N 3.36Å; E104-S107 VanDerWaalsContact O-N 3.15Å; E104-S107 PolarHBondContact O-OG 2.75Å; S107-K111 PolarHBondContact O-N 3.33Å; S107-K111 VanDerWaalsContact O-N 3.15Å
108	A	89.9	Confident	89.4	Confident	41 Å²	41	71.2 Å²	71.2	34%	0.339	35%	0.345	S	S	.	.	H	α-helix	trans	-64.3	-43.1	173.1	0	0	0	0	0	111.1	E104 S105 Y106 R110 K111 A112 I122	E104-A108 PolarHBondContact O-N 3.09Å; E104-A108 VanDerWaalsContact O-N 3.13Å; S105-A108 PolarHBondContact O-N 3.37Å; Y106-A108 VanDerWaalsContact C-N 3.31Å; Y106-A108 PolarHBondContact O-N 3.4Å; A108-R110 PolarHBondContact O-N 3.44Å; A108-K111 WeakPolarHBondContact O-CB 3.39Å; A108-K111 PolarHBondContact O-N 2.92Å; A108-A112 PolarHBondContact O-N 2.78Å; A108-I122 VanDerWaalsContact C-CD1 3.41Å; A108-I122 HydrophobicContact CB-CD1 3.97Å; A108-I122 HydrophobicContact CB-CG1 4.49Å; A108-I122 WeakPolarHBondContact O-CD1 3.29Å
109	L	90.4	Very high	88.7	Confident	4 Å²	4	73.6 Å²	73.6	2%	0.021	36%	0.36	C	S	.	.	H	α-helix	trans	-57.7	-49.2	-180	-169.5	79	0	0	0	111.1	Q68 F101 S105 Y106 K111 A112 Q113 V119 I122	Q68-L109 HydrophobicContact CG-CD2 4.31Å; F101-L109 HydrophobicContact CD2-CD2 4.27Å; F101-L109 HydrophobicContact CE1-CD1 4.29Å; F101-L109 HydrophobicContact CE2-CD2 4.02Å; F101-L109 HydrophobicContact CZ-CD1 4.11Å; F101-L109 HydrophobicContact CZ-CD2 4.19Å; S105-L109 WeakPolarHBondContact O-CB 3.34Å; S105-L109 PolarHBondContact O-N 2.66Å; Y106-L109 WeakPolarHBondContact O-CB 3.41Å; Y106-L109 PolarHBondContact O-N 2.9Å; L109-K111 VanDerWaalsContact C-N 3.26Å; L109-K111 PolarHBondContact O-N 2.84Å; L109-A112 PolarHBondContact O-N 2.92Å; L109-Q113 WeakPolarHBondContact O-CB 3.27Å; L109-Q113 VanDerWaalsContact O-CG 3.3Å; L109-Q113 WeakPolarHBondContact O-CG 3.36Å; L109-Q113 PolarHBondContact O-N 2.79Å; L109-V119 HydrophobicContact CD1-CG1 3.37Å; L109-V119 HydrophobicContact CG-CG1 4.31Å; L109-I122 VanDerWaalsContact CA-CD1 3.44Å; L109-I122 HydrophobicContact CB-CD1 4.33Å; L109-I122 HydrophobicContact CD1-CB 4.43Å; L109-I122 HydrophobicContact CD1-CD1 4.35Å
110	R	89.8	Confident	87.9	Confident	127 Å²	127	76.9 Å²	76.9	48%	0.479	38%	0.38	S	S	.	.	H	α-helix	trans	-66.9	-26.8	178	-69.4	-177.3	68.5	174.5	5.2	113.2	Y106 A108 R114	Y106-R110 HydrophobicContact CE1-CG 4.4Å; Y106-R110 HydrophobicContact CE2-CG 4.22Å; Y106-R110 VanDerWaalsContact CZ-CD 3.49Å; Y106-R110 PolarHBondContact O-N 2.77Å; A108-R110 PolarHBondContact O-N 3.44Å; R110-R114 WeakPolarHBondContact O-CG 3.36Å; R110-R114 PolarHBondContact O-N 3.4Å; R110-R114 PolarHBondContact O-NE 3.45Å
111	K	90.7	Very high	87.3	Confident	125 Å²	125	80.4 Å²	80.4	54%	0.543	41%	0.409	S	S	.	.	H	α-helix	trans	-72.4	-49	174	-172.2	-177.4	176	-171.7	0	110.3	S107 A108 L109 Q113 R114 N115	S107-K111 PolarHBondContact O-N 3.33Å; S107-K111 VanDerWaalsContact O-N 3.15Å; A108-K111 WeakPolarHBondContact O-CB 3.39Å; A108-K111 PolarHBondContact O-N 2.92Å; L109-K111 VanDerWaalsContact C-N 3.26Å; L109-K111 PolarHBondContact O-N 2.84Å; K111-Q113 VanDerWaalsContact C-N 3.34Å; K111-Q113 PolarHBondContact O-N 3.45Å; K111-R114 PolarHBondContact O-N 2.84Å; K111-N115 WeakPolarHBondContact O-CB 3.45Å; K111-N115 PolarHBondContact O-N 2.79Å
112	A	89.3	Confident	87	Confident	5 Å²	5	81.8 Å²	81.8	4%	0.041	42%	0.417	C	S	.	.	H	α-helix	trans	-59.5	-43.9	178.5	0	0	0	0	0	111.9	A108 L109 R114 N115 N116 E117 I122	A108-A112 PolarHBondContact O-N 2.78Å; L109-A112 PolarHBondContact O-N 2.92Å; A112-R114 PolarHBondContact O-N 2.81Å; A112-N115 CarbonylContact O-C 3.53Å; A112-N115 PolarHBondContact O-N 2.97Å; A112-N116 PolarHBondContact O-N 3.47Å; A112-E117 HydrophobicContact CB-CB 4.11Å; A112-E117 PolarHBondContact O-N 3.49Å; A112-I122 HydrophobicContact CB-CD1 3.74Å
113	Q	88.3	Confident	86.8	Confident	56 Å²	56	88.5 Å²	88.5	26%	0.262	45%	0.447	S	S	.	.	H	α-helix	trans	-61.7	-40.1	177.3	-74.3	174.1	-18.9	0	0	113.4	L109 K111 N115 V119	L109-Q113 WeakPolarHBondContact O-CB 3.27Å; L109-Q113 VanDerWaalsContact O-CG 3.3Å; L109-Q113 WeakPolarHBondContact O-CG 3.36Å; L109-Q113 PolarHBondContact O-N 2.79Å; K111-Q113 VanDerWaalsContact C-N 3.34Å; K111-Q113 PolarHBondContact O-N 3.45Å; Q113-N115 VanDerWaalsContact C-N 3.31Å; Q113-V119 HydrophobicContact CG-CG1 4.31Å; Q113-V119 HydrophobicContact CG-CG2 3.88Å
114	R	89.4	Confident	86.9	Confident	191 Å²	191	84.5 Å²	84.5	72%	0.721	43%	0.432	S	S	*	.	H	α-helix	trans	-70	-31.7	177.2	-75.8	-173.6	-68.7	178.3	1.4	112.5	R110 K111 A112	R110-R114 WeakPolarHBondContact O-CG 3.36Å; R110-R114 PolarHBondContact O-N 3.4Å; R110-R114 PolarHBondContact O-NE 3.45Å; K111-R114 PolarHBondContact O-N 2.84Å; A112-R114 PolarHBondContact O-N 2.81Å
115	N	89.6	Confident	86.9	Confident	86 Å²	86	79.7 Å²	79.7	46%	0.46	41%	0.411	S	S	.	.	H	α-helix	trans	-90.9	-0.9	-178.3	-68.8	-4.4	0	0	0	113.6	K111 A112 Q113 E117	K111-N115 WeakPolarHBondContact O-CB 3.45Å; K111-N115 PolarHBondContact O-N 2.79Å; A112-N115 CarbonylContact O-C 3.53Å; A112-N115 PolarHBondContact O-N 2.97Å; Q113-N115 VanDerWaalsContact C-N 3.31Å; N115-E117 HydrophobicContact CB-CG 3.8Å; N115-E117 VanDerWaalsContact CB-OE1 3.29Å; N115-E117 WeakPolarHBondContact CB-OE1 3.28Å; N115-E117 PolarHBondContact ND2-OE1 2.88Å; N115-E117 PolarHBondContact O-N 3.46Å
116	N	83.1	Confident	87	Confident	156 Å²	156	79.8 Å²	79.8	83%	0.834	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	37	-169.3	-75.8	-50.4	0	0	0	113	A112	A112-N116 PolarHBondContact O-N 3.47Å
117	E	85.8	Confident	87	Confident	108 Å²	108	81.2 Å²	81.2	51%	0.505	42%	0.421	S	S	.	.			trans	-83.7	170.4	171.6	-67.3	168	-156.8	0	0	110.4	A112 N115 V119	A112-E117 HydrophobicContact CB-CB 4.11Å; A112-E117 PolarHBondContact O-N 3.49Å; N115-E117 HydrophobicContact CB-CG 3.8Å; N115-E117 VanDerWaalsContact CB-OE1 3.29Å; N115-E117 WeakPolarHBondContact CB-OE1 3.28Å; N115-E117 PolarHBondContact ND2-OE1 2.88Å; N115-E117 PolarHBondContact O-N 3.46Å; E117-V119 PolarHBondContact O-N 2.88Å
118	D	79.9	Confident	87.2	Confident	105 Å²	105	78.1 Å²	78.1	56%	0.561	40%	0.399	S	S	*	.			trans	-69.8	100.7	-179.2	-172.2	11.5	0	0	0	111.7	N120 A121	D118-N120 PolarHBondContact O-N 2.84Å; D118-N120 WeakPolarHBondContact OD1-CB 3.42Å; D118-N120 PolarHBondContact OD1-N 3.3Å; D118-N120 VanDerWaalsContact OD1-N 3.09Å; D118-N120 PolarHBondContact OD1-ND2 2.79Å; D118-A121 WeakPolarHBondContact O-CB 3.2Å; D118-A121 PolarHBondContact O-N 2.86Å
119	V	79.7	Confident	87.3	Confident	50 Å²	50	80.9 Å²	80.9	30%	0.303	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-62.1	-24.2	178.4	-172.7	0	0	0	0	111.6	L109 Q113 E117 A121 I122	L109-V119 HydrophobicContact CD1-CG1 3.37Å; L109-V119 HydrophobicContact CG-CG1 4.31Å; Q113-V119 HydrophobicContact CG-CG1 4.31Å; Q113-V119 HydrophobicContact CG-CG2 3.88Å; E117-V119 PolarHBondContact O-N 2.88Å; V119-A121 VanDerWaalsContact C-N 3.3Å; V119-A121 PolarHBondContact O-N 2.86Å; V119-I122 PolarHBondContact O-N 3.05Å
120	N	78.1	Confident	87.4	Confident	129 Å²	129	81 Å²	81	69%	0.69	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-77.2	-16.3	-178.4	-55.7	-66.1	0	0	0	113.4	D118 I122	D118-N120 PolarHBondContact O-N 2.84Å; D118-N120 WeakPolarHBondContact OD1-CB 3.42Å; D118-N120 PolarHBondContact OD1-N 3.3Å; D118-N120 VanDerWaalsContact OD1-N 3.09Å; D118-N120 PolarHBondContact OD1-ND2 2.79Å; N120-I122 PolarHBondContact O-N 3.24Å
121	A	80.6	Confident	87.5	Confident	75 Å²	75	80.7 Å²	80.7	62%	0.62	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-67.8	-19.9	175	0	0	0	0	0	112.3	D118 V119 Q123	D118-A121 WeakPolarHBondContact O-CB 3.2Å; D118-A121 PolarHBondContact O-N 2.86Å; V119-A121 VanDerWaalsContact C-N 3.3Å; V119-A121 PolarHBondContact O-N 2.86Å; A121-Q123 PolarHBondContact O-N 3.46Å
122	I	86.8	Confident	87.6	Confident	34 Å²	34	75 Å²	75	17%	0.174	39%	0.392	C	S	.	.	S	Bend	trans	-89.6	109	-177.4	-57.7	169.9	0	0	0	108.6	F101 A108 L109 A112 V119 N120	F101-I122 HydrophobicContact CE1-CG2 4.15Å; A108-I122 VanDerWaalsContact C-CD1 3.41Å; A108-I122 HydrophobicContact CB-CD1 3.97Å; A108-I122 HydrophobicContact CB-CG1 4.49Å; A108-I122 WeakPolarHBondContact O-CD1 3.29Å; L109-I122 VanDerWaalsContact CA-CD1 3.44Å; L109-I122 HydrophobicContact CB-CD1 4.33Å; L109-I122 HydrophobicContact CD1-CB 4.43Å; L109-I122 HydrophobicContact CD1-CD1 4.35Å; A112-I122 HydrophobicContact CB-CD1 3.74Å; V119-I122 PolarHBondContact O-N 3.05Å; N120-I122 PolarHBondContact O-N 3.24Å
123	Q	86.4	Confident	87.4	Confident	167 Å²	167	85.8 Å²	85.8	78%	0.78	43%	0.431	S	S	*	.			trans	-74.5	130	-178.9	-69.7	-179.3	26.2	0	0	110.7	A121	A121-Q123 PolarHBondContact O-N 3.46Å
124	P	90.5	Very high	87.2	Confident	41 Å²	41	84 Å²	84	27%	0.266	43%	0.428	S	S	.	.			trans	-70.1	154.2	169.1	30.7	-33.7	0	0	0	110.6	K99 F100 F101 T127	K99-P124 HydrophobicContact CB-CB 3.99Å; K99-P124 HydrophobicContact CB-CG 4.42Å; K99-P124 HydrophobicContact CG-CG 4.47Å; F100-P124 CarbonylContact O-C 3.47Å; F100-P124 WeakPolarHBondContact O-CB 3.42Å; F101-P124 HydrophobicContact CD1-CB 4.26Å; F101-P124 HydrophobicContact CE1-CB 3.79Å; F101-P124 HydrophobicContact CE2-CB 4.36Å; F101-P124 HydrophobicContact CZ-CB 3.86Å; P124-T127 HydrophobicContact CB-CG2 4.29Å; P124-T127 HydrophobicContact CG-CG2 3.67Å
125	L	88.4	Confident	87	Confident	48 Å²	48	76.2 Å²	76.2	25%	0.251	41%	0.405	S	S	.	.	S	Bend	trans	-63.6	-44.1	176.1	-175.2	67.7	0	0	0	111.1	C20 P23 L60 F100	C20-L125 HydrophobicContact CB-CD2 4.38Å; P23-L125 HydrophobicContact CG-CD1 4.42Å; P23-L125 HydrophobicContact CG-CG 4.24Å; L60-L125 HydrophobicContact CD2-CD2 4.04Å; F100-L125 WeakPolarHBondContact O-CB 3.16Å; F100-L125 PolarHBondContact O-N 3.04Å
126	F	89.4	Confident	86.7	Confident	22 Å²	22	79.6 Å²	79.6	10%	0.096	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	164.5	170.9	56.6	-93.7	0	0	0	110.4	P23 I25 L47 L49 L60 F100 V128	P23-F126 HydrophobicContact CB-CD1 4.13Å; P23-F126 HydrophobicContact CG-CD1 4.16Å; I25-F126 HydrophobicContact CD1-CD2 3.88Å; I25-F126 HydrophobicContact CD1-CE2 4.4Å; I25-F126 HydrophobicContact CD1-CG 4.44Å; I25-F126 HydrophobicContact CG2-CD1 4.17Å; I25-F126 HydrophobicContact CG2-CD2 4.1Å; I25-F126 HydrophobicContact CG2-CE1 4.08Å; I25-F126 HydrophobicContact CG2-CE2 3.98Å; I25-F126 HydrophobicContact CG2-CG 4.19Å; I25-F126 HydrophobicContact CG2-CZ 3.99Å; L47-F126 HydrophobicContact CD1-CZ 4.2Å; L47-F126 HydrophobicContact CD2-CE2 4.19Å; L47-F126 HydrophobicContact CD2-CZ 4.3Å; L49-F126 HydrophobicContact CD1-CE1 3.93Å; L49-F126 HydrophobicContact CD1-CZ 4.46Å; L60-F126 HydrophobicContact CD1-CE1 4.41Å; L60-F126 HydrophobicContact CD1-CZ 4.16Å; F100-F126 HydrophobicContact CB-CD1 4.35Å; F100-F126 HydrophobicContact CB-CD2 3.94Å; F100-F126 HydrophobicContact CB-CE1 4.01Å; F100-F126 HydrophobicContact CB-CE2 3.58Å; F100-F126 HydrophobicContact CB-CG 4.31Å; F100-F126 HydrophobicContact CB-CZ 3.6Å; F100-F126 HydrophobicContact CD1-CE2 4.12Å; F100-F126 HydrophobicContact CD1-CZ 4.14Å; F100-F126 AromaticContact CD2-CD2 3.62Å; F100-F126 HydrophobicContact CD2-CD2 3.62Å; F100-F126 AromaticContact CD2-CE2 3.19Å; F100-F126 HydrophobicContact CD2-CE2 3.19Å; F100-F126 AromaticContact CD2-CZ 4Å; F100-F126 HydrophobicContact CD2-CZ 4Å; F100-F126 HydrophobicContact CE2-CD2 4.44Å; F100-F126 AromaticContact CE2-CE2 3.84Å; F100-F126 HydrophobicContact CE2-CE2 3.84Å; F100-F126 HydrophobicContact CG-CD2 4.01Å; F100-F126 AromaticContact CG-CE2 3.35Å; F100-F126 HydrophobicContact CG-CE2 3.35Å; F100-F126 AromaticContact CG-CZ 3.64Å; F100-F126 HydrophobicContact CG-CZ 3.64Å; F100-F126 PolarHBondContact N-O 3.02Å; F126-V128 HydrophobicContact CD2-CG2 4.11Å; F126-V128 HydrophobicContact CE2-CG2 4.23Å
127	T	92	Very high	86.3	Confident	62 Å²	62	77.1 Å²	77.1	38%	0.38	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	141.2	177.5	62.4	0	0	0	0	110.4	V98 K99 P124	V98-T127 WeakPolarHBondContact O-CA 3.42Å; K99-T127 HydrophobicContact CB-CG2 4.43Å; K99-T127 HydrophobicContact CG-CG2 3.96Å; P124-T127 HydrophobicContact CB-CG2 4.29Å; P124-T127 HydrophobicContact CG-CG2 3.67Å
128	V	93	Very high	86	Confident	8 Å²	8	72.6 Å²	72.6	5%	0.048	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	127.4	176.8	179.9	0	0	0	0	108	I25 P27 V98 F100 F126 I130	I25-V128 HydrophobicContact CD1-CG2 3.85Å; P27-V128 HydrophobicContact CB-CG1 3.6Å; P27-V128 HydrophobicContact CB-CG2 4.16Å; P27-V128 HydrophobicContact CG-CG1 4.09Å; V98-V128 PolarHBondContact N-O 2.79Å; V98-V128 PolarHBondContact O-N 3.17Å; F100-V128 HydrophobicContact CD2-CG2 4.23Å; F100-V128 HydrophobicContact CE2-CB 4.12Å; F100-V128 HydrophobicContact CE2-CG2 3.78Å; F126-V128 HydrophobicContact CD2-CG2 4.11Å; F126-V128 HydrophobicContact CE2-CG2 4.23Å; V128-I130 HydrophobicContact CG1-CG1 4.29Å
129	N	93	Very high	86	Confident	100 Å²	100	71.3 Å²	71.3	54%	0.535	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	133.4	176.5	-66.1	-32.8	0	0	0	109.3	T95	T95-N129 HydrophobicContact CG2-CB 3.7Å
130	I	91.6	Very high	86.1	Confident	7 Å²	7	80.9 Å²	80.9	4%	0.036	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	122	-175.4	-58.2	155.5	0	0	0	108.9	A29 T31 V45 W84 T95 Y96 V98 V128	A29-I130 HydrophobicContact CB-CB 4.33Å; A29-I130 HydrophobicContact CB-CD1 4.39Å; A29-I130 HydrophobicContact CB-CG1 3.85Å; A29-I130 HydrophobicContact CB-CG2 3.64Å; T31-I130 HydrophobicContact CG2-CG2 3.94Å; V45-I130 HydrophobicContact CB-CD1 4.47Å; V45-I130 HydrophobicContact CG2-CD1 3.18Å; V45-I130 HydrophobicContact CG2-CG1 4.21Å; W84-I130 HydrophobicContact CH2-CD1 3.66Å; W84-I130 HydrophobicContact CZ2-CD1 4.44Å; T95-I130 CarbonylContact C-O 3.49Å; T95-I130 VanDerWaalsContact CA-O 3.3Å; T95-I130 WeakPolarHBondContact CA-O 3.35Å; Y96-I130 PolarHBondContact N-O 2.81Å; Y96-I130 PolarHBondContact O-N 3.29Å; V98-I130 HydrophobicContact CB-CD1 4.48Å; V98-I130 HydrophobicContact CG2-CD1 3.37Å; V128-I130 HydrophobicContact CG1-CG1 4.29Å
131	D	91.5	Very high	86.5	Confident	120 Å²	120	76.7 Å²	76.7	64%	0.642	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.9	117.8	177.6	-62.7	-42	0	0	0	110.8	T95	T95-D131 WeakPolarHBondContact CB-OD1 3.39Å; T95-D131 WeakPolarHBondContact CG2-OD1 3.33Å; T95-D131 PolarHBondContact OG1-OD1 3.09Å
132	H	92.1	Very high	86.7	Confident	5 Å²	5	77 Å²	77	2%	0.023	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	125.8	173.9	-175.7	50.2	0	0	0	110	T31 T32 F43 A91 S93 G94 Y96 G134	T31-H132 WeakPolarHBondContact CB-ND1 3.46Å; T31-H132 PolarHBondContact OG1-ND1 3.36Å; T32-H132 PolarHBondContact O-CE1 3.34Å; T32-H132 VanDerWaalsContact O-CE1 3.3Å; F43-H132 HydrophobicContact CE1-CB 3.85Å; F43-H132 AromaticContact CE1-CG 3.71Å; F43-H132 HydrophobicContact CZ-CB 4.44Å; F43-H132 AromaticContact CZ-CD2 3.91Å; F43-H132 AromaticContact CZ-CG 3.94Å; A91-H132 PolarHBondContact O-CD2 2.87Å; A91-H132 PolarHBondContact O-NE2 2.95Å; S93-H132 CarbonylContact C-O 3.59Å; S93-H132 VanDerWaalsContact CA-O 3.23Å; S93-H132 WeakPolarHBondContact CA-O 3.37Å; G94-H132 PolarHBondContact N-O 2.8Å; G94-H132 PolarHBondContact O-N 2.69Å; Y96-H132 HydrophobicContact CD2-CB 3.92Å; Y96-H132 HydrophobicContact CE2-CB 3.7Å; H132-G134 PolarHBondContact CD2-N 3.45Å; H132-G134 WeakPolarHBondContact NE2-CA 3.31Å; H132-G134 PolarHBondContact NE2-N 3.26Å; H132-G134 PolarHBondContact O-N 3.27Å
133	R	86.7	Confident	86.8	Confident	231 Å²	231	80.8 Å²	80.8	87%	0.872	42%	0.418	S	S	*	.			trans	-75.5	-9.3	-179	-73.3	-176.3	163.4	-164.5	-4.6	114	S93	S93-R133 WeakPolarHBondContact CB-O 3.24Å
134	G	84.4	Confident	86.9	Confident	18 Å²	18	80.5 Å²	80.5	19%	0.186	42%	0.417	C	S	.	.			trans	86.8	157.4	-173	0	0	0	0	0	111.8	H132	H132-G134 PolarHBondContact CD2-N 3.45Å; H132-G134 WeakPolarHBondContact NE2-CA 3.31Å; H132-G134 PolarHBondContact NE2-N 3.26Å; H132-G134 PolarHBondContact O-N 3.27Å
135	A	84.8	Confident	87	Confident	29 Å²	29	82.3 Å²	82.3	24%	0.24	43%	0.427	C	S	.	.			trans	-94.2	136	-177.6	0	0	0	0	0	111.9	S33 A35	S33-A135 CarbonylContact O-C 3.57Å; S33-A135 WeakPolarHBondContact O-CA 3.47Å; A35-A135 HydrophobicContact CB-CB 3.78Å
136	W	82	Confident	87.3	Confident	157 Å²	157	83.1 Å²	83.1	60%	0.595	43%	0.434	S	S	*	.	B	Isolated β-bridge	trans	-80.8	119.3	176.1	-178.8	67.6	0	0	0	110.6	S33 A35 V36 G138	S33-W136 PolarHBondContact O-N 2.71Å; A35-W136 WeakPolarHBondContact CB-O 3.24Å; A35-W136 PolarHBondContact N-O 3.23Å; A35-W136 VanDerWaalsContact N-O 3.09Å; V36-W136 HydrophobicContact CG2-CE3 3.97Å; V36-W136 HydrophobicContact CG2-CZ3 3.97Å; W136-G138 PolarHBondContact O-N 2.72Å
137	S	76.6	Confident	87.5	Confident	104 Å²	104	85 Å²	85	73%	0.727	45%	0.454	S	S	*	.			trans	-82.8	12.9	-175.7	61.3	0	0	0	0	115
138	G	77.9	Confident	87.7	Confident	13 Å²	13	83.9 Å²	83.9	13%	0.134	45%	0.454	C	S	.	.			trans	78.2	176.9	-177.8	0	0	0	0	0	114.3	W136	W136-G138 PolarHBondContact O-N 2.72Å
139	P	80.6	Confident	87.9	Confident	78 Å²	78	88.4 Å²	88.4	51%	0.506	48%	0.477	S	S	.	.			trans	-68.4	146.7	172.5	29.5	-32.4	0	0	0	110.6	V141	P139-V141 PolarHBondContact O-N 3.23Å
140	W	81.5	Confident	88.1	Confident	250 Å²	250	87.9 Å²	87.9	95%	0.947	47%	0.474	S	S	*	.	S	Bend	trans	-68.3	-14.7	-179.7	61.6	-78.6	0	0	0	114
141	V	86.3	Confident	88.3	Confident	41 Å²	41	89.3 Å²	89.3	25%	0.248	49%	0.49	C	S	.	.	S	Bend	trans	-117.7	131.9	174.6	-170.7	0	0	0	0	109.5	P139 T143 V145 V146	P139-V141 PolarHBondContact O-N 3.23Å; V141-T143 PolarHBondContact O-N 3Å; V141-V145 HydrophobicContact CG1-CB 4.02Å; V141-V145 HydrophobicContact CG1-CG1 4.2Å; V141-V146 HydrophobicContact CB-CG2 4.29Å; V141-V146 HydrophobicContact CG1-CG2 3.82Å
142	S	85.1	Confident	88.6	Confident	81 Å²	81	89 Å²	89	57%	0.566	49%	0.487	S	S	*	.			trans	-57.4	132.4	171.1	-59.6	0	0	0	0	110.6	E144 V145 V146	S142-E144 PolarHBondContact O-N 3.12Å; S142-E144 VanDerWaalsContact O-N 3.12Å; S142-V145 PolarHBondContact O-N 3.33Å; S142-V146 PolarHBondContact O-N 3.42Å
143	T	88.4	Confident	88.9	Confident	115 Å²	115	93.8 Å²	93.8	71%	0.706	51%	0.513	S	S	*	.	H	α-helix	trans	-57.8	-27.4	177.3	49.5	0	0	0	0	112.5	V141 V146 A147	V141-T143 PolarHBondContact O-N 3Å; T143-V146 PolarHBondContact O-N 3.35Å; T143-A147 WeakPolarHBondContact O-CB 3.36Å; T143-A147 PolarHBondContact O-N 3.39Å
144	E	89.4	Confident	89.4	Confident	160 Å²	160	87.7 Å²	87.7	75%	0.748	50%	0.496	S	S	*	.	H	α-helix	trans	-60.2	-45.3	172.7	-172.7	179.3	163.9	0	0	112.8	S142 V146 A147 G148	S142-E144 PolarHBondContact O-N 3.12Å; S142-E144 VanDerWaalsContact O-N 3.12Å; E144-V146 VanDerWaalsContact C-N 3.33Å; E144-V146 PolarHBondContact O-N 3.49Å; E144-A147 PolarHBondContact O-N 3.37Å; E144-G148 PolarHBondContact O-N 3.26Å
145	V	93.1	Very high	90	Very high	79 Å²	79	94.6 Å²	94.6	48%	0.479	52%	0.518	S	S	.	.	H	α-helix	trans	-65.8	-41.6	178.7	177.5	0	0	0	0	110	V141 S142 G148 L149	V141-V145 HydrophobicContact CG1-CB 4.02Å; V141-V145 HydrophobicContact CG1-CG1 4.2Å; S142-V145 PolarHBondContact O-N 3.33Å; V145-G148 PolarHBondContact O-N 2.94Å; V145-L149 HydrophobicContact CG1-CD1 4.27Å; V145-L149 WeakPolarHBondContact O-CG 3.42Å; V145-L149 PolarHBondContact O-N 3.31Å
146	V	93.1	Very high	90.5	Very high	66 Å²	66	100.5 Å²	100.5	40%	0.4	54%	0.535	S	S	.	.	H	α-helix	trans	-62.4	-46.5	176.6	179.8	0	0	0	0	110.8	V141 S142 T143 E144 G148 L149 I150	V141-V146 HydrophobicContact CB-CG2 4.29Å; V141-V146 HydrophobicContact CG1-CG2 3.82Å; S142-V146 PolarHBondContact O-N 3.42Å; T143-V146 PolarHBondContact O-N 3.35Å; E144-V146 VanDerWaalsContact C-N 3.33Å; E144-V146 PolarHBondContact O-N 3.49Å; V146-G148 PolarHBondContact O-N 2.93Å; V146-L149 PolarHBondContact O-N 3.49Å; V146-I150 HydrophobicContact CG1-CD1 3.88Å; V146-I150 VanDerWaalsContact O-CG1 3.28Å; V146-I150 WeakPolarHBondContact O-CG1 3.28Å; V146-I150 PolarHBondContact O-N 3.38Å
147	A	95.1	Very high	91.2	Very high	62 Å²	62	98.7 Å²	98.7	51%	0.512	54%	0.535	S	S	.	.	H	α-helix	trans	-62	-42.2	177.2	0	0	0	0	0	112	T143 E144 I150 G151	T143-A147 WeakPolarHBondContact O-CB 3.36Å; T143-A147 PolarHBondContact O-N 3.39Å; E144-A147 PolarHBondContact O-N 3.37Å; A147-I150 PolarHBondContact O-N 3.01Å; A147-G151 PolarHBondContact O-N 3.34Å
148	G	96.4	Very high	92	Very high	37 Å²	37	96.6 Å²	96.6	38%	0.381	52%	0.524	S	S	.	.	H	α-helix	trans	-61.1	-45.7	175.5	0	0	0	0	0	112.8	E144 V145 V146 I150 G151 I152	E144-G148 PolarHBondContact O-N 3.26Å; V145-G148 PolarHBondContact O-N 2.94Å; V146-G148 PolarHBondContact O-N 2.93Å; G148-I150 PolarHBondContact O-N 2.95Å; G148-G151 PolarHBondContact O-N 2.88Å; G148-I152 WeakPolarHBondContact O-CG1 3.37Å; G148-I152 PolarHBondContact O-N 3.26Å
149	L	95.9	Very high	92.8	Very high	103 Å²	103	101.2 Å²	101.2	54%	0.539	54%	0.54	S	S	.	.	H	α-helix	trans	-62.2	-42.5	176.6	-74	175	0	0	0	112.3	V145 V146 G151 I152 L153	V145-L149 HydrophobicContact CG1-CD1 4.27Å; V145-L149 WeakPolarHBondContact O-CG 3.42Å; V145-L149 PolarHBondContact O-N 3.31Å; V146-L149 PolarHBondContact O-N 3.49Å; L149-G151 VanDerWaalsContact C-N 3.34Å; L149-I152 PolarHBondContact O-N 2.96Å; L149-L153 WeakPolarHBondContact O-CB 3.34Å; L149-L153 WeakPolarHBondContact O-CG 3.44Å; L149-L153 PolarHBondContact O-N 3.48Å
150	I	96.8	Very high	93.4	Very high	89 Å²	89	99.4 Å²	99.4	46%	0.456	53%	0.53	S	S	.	.	H	α-helix	trans	-62.5	-43.8	176	-67.9	166.5	0	0	0	110.4	V146 A147 G148 I152 L153 I154	V146-I150 HydrophobicContact CG1-CD1 3.88Å; V146-I150 VanDerWaalsContact O-CG1 3.28Å; V146-I150 WeakPolarHBondContact O-CG1 3.28Å; V146-I150 PolarHBondContact O-N 3.38Å; A147-I150 PolarHBondContact O-N 3.01Å; G148-I150 PolarHBondContact O-N 2.95Å; I150-I152 PolarHBondContact O-N 3.39Å; I150-L153 PolarHBondContact O-N 3.48Å; I150-I154 HydrophobicContact CG2-CD1 3.76Å; I150-I154 HydrophobicContact CG2-CG1 4.42Å; I150-I154 VanDerWaalsContact O-CG1 3.3Å; I150-I154 WeakPolarHBondContact O-CG1 3.46Å; I150-I154 PolarHBondContact O-N 2.88Å
151	G	97.4	Very high	93.9	Very high	38 Å²	38	89.7 Å²	89.7	39%	0.392	50%	0.503	S	S	.	.	H	α-helix	trans	-60.1	-45.3	176.7	0	0	0	0	0	112.9	A147 G148 L149 I154 Y155	A147-G151 PolarHBondContact O-N 3.34Å; G148-G151 PolarHBondContact O-N 2.88Å; L149-G151 VanDerWaalsContact C-N 3.34Å; G151-I154 PolarHBondContact O-N 2.96Å; G151-Y155 WeakPolarHBondContact O-CB 3.3Å; G151-Y155 PolarHBondContact O-N 3.36Å
152	I	97.1	Very high	94.1	Very high	113 Å²	113	93.2 Å²	93.2	58%	0.579	52%	0.515	S	S	*	.	H	α-helix	trans	-62.7	-43.5	176.7	-67.8	166.4	0	0	0	110.9	G148 L149 I150 Y155 Y156	G148-I152 WeakPolarHBondContact O-CG1 3.37Å; G148-I152 PolarHBondContact O-N 3.26Å; L149-I152 PolarHBondContact O-N 2.96Å; I150-I152 PolarHBondContact O-N 3.39Å; I152-Y155 PolarHBondContact O-N 2.96Å; I152-Y156 WeakPolarHBondContact O-CB 3.46Å; I152-Y156 PolarHBondContact O-N 3.46Å
153	L	97.2	Very high	94	Very high	105 Å²	105	92 Å²	92	55%	0.55	51%	0.506	S	S	.	.	H	α-helix	trans	-61.5	-45.1	177.7	-81.6	169.6	0	0	0	112.2	L149 I150 Y156 M157	L149-L153 WeakPolarHBondContact O-CB 3.34Å; L149-L153 WeakPolarHBondContact O-CG 3.44Å; L149-L153 PolarHBondContact O-N 3.48Å; I150-L153 PolarHBondContact O-N 3.48Å; L153-Y156 PolarHBondContact O-N 3.37Å; L153-M157 WeakPolarHBondContact O-CG 3.34Å; L153-M157 PolarHBondContact O-N 3.4Å
154	I	97.3	Very high	94	Very high	104 Å²	104	91.2 Å²	91.2	53%	0.533	50%	0.502	S	S	.	.	H	α-helix	trans	-63.6	-45.4	177.7	-68	168.9	0	0	0	110.3	I150 G151 Y156 M157 A158	I150-I154 HydrophobicContact CG2-CD1 3.76Å; I150-I154 HydrophobicContact CG2-CG1 4.42Å; I150-I154 VanDerWaalsContact O-CG1 3.3Å; I150-I154 WeakPolarHBondContact O-CG1 3.46Å; I150-I154 PolarHBondContact O-N 2.88Å; G151-I154 PolarHBondContact O-N 2.96Å; I154-Y156 VanDerWaalsContact C-N 3.34Å; I154-Y156 PolarHBondContact O-N 2.85Å; I154-M157 PolarHBondContact O-N 2.95Å; I154-A158 WeakPolarHBondContact O-CB 3.46Å; I154-A158 PolarHBondContact O-N 3.05Å
155	Y	97	Very high	93.6	Very high	162 Å²	162	90.3 Å²	90.3	64%	0.635	50%	0.5	S	S	*	.	H	α-helix	trans	-59.7	-45.3	176.5	175.4	-97.6	0	0	0	111.7	G151 I152 A158 F159	G151-Y155 WeakPolarHBondContact O-CB 3.3Å; G151-Y155 PolarHBondContact O-N 3.36Å; I152-Y155 PolarHBondContact O-N 2.96Å; Y155-A158 PolarHBondContact O-N 2.82Å; Y155-F159 WeakPolarHBondContact O-CB 3.33Å; Y155-F159 PolarHBondContact O-N 3.25Å
156	Y	96.7	Very high	92.5	Very high	154 Å²	154	93.2 Å²	93.2	60%	0.604	51%	0.509	S	S	*	.	H	α-helix	trans	-61	-46.3	178.3	179.4	-98.8	0	0	0	111.6	I152 L153 I154 A158 F159 S160	I152-Y156 WeakPolarHBondContact O-CB 3.46Å; I152-Y156 PolarHBondContact O-N 3.46Å; L153-Y156 PolarHBondContact O-N 3.37Å; I154-Y156 VanDerWaalsContact C-N 3.34Å; I154-Y156 PolarHBondContact O-N 2.85Å; Y156-A158 VanDerWaalsContact C-N 3.34Å; Y156-A158 PolarHBondContact O-N 3.47Å; Y156-F159 PolarHBondContact O-N 3.37Å; Y156-S160 WeakPolarHBondContact O-CB 3.47Å; Y156-S160 PolarHBondContact O-N 2.95Å; Y156-S160 PolarHBondContact O-OG 2.71Å
157	M	95.4	Very high	90.5	Very high	118 Å²	118	96.7 Å²	96.7	58%	0.581	55%	0.545	S	S	*	.	H	α-helix	trans	-63.1	-39.2	176.9	-75.1	-158.3	-86.4	0	0	112.5	L153 I154 S160 A161	L153-M157 WeakPolarHBondContact O-CG 3.34Å; L153-M157 PolarHBondContact O-N 3.4Å; I154-M157 PolarHBondContact O-N 2.95Å; M157-S160 WeakPolarHBondContact CA-OG 3.42Å; M157-S160 PolarHBondContact O-OG 3.44Å; M157-A161 WeakPolarHBondContact O-CB 3.44Å; M157-A161 PolarHBondContact O-N 2.94Å
158	A	95	Very high	90.3	Very high	61 Å²	61	98.5 Å²	98.5	50%	0.504	55%	0.546	S	S	.	.	H	α-helix	trans	-65.2	-42.8	175.1	0	0	0	0	0	111.6	I154 Y155 Y156 K162	I154-A158 WeakPolarHBondContact O-CB 3.46Å; I154-A158 PolarHBondContact O-N 3.05Å; Y155-A158 PolarHBondContact O-N 2.82Å; Y156-A158 VanDerWaalsContact C-N 3.34Å; Y156-A158 PolarHBondContact O-N 3.47Å; A158-K162 WeakPolarHBondContact O-CB 3.43Å; A158-K162 PolarHBondContact O-N 3.13Å
159	F	94.8	Very high	90	Very high	109 Å²	109	101.7 Å²	101.7	48%	0.478	56%	0.555	S	S	.	*	H	α-helix	trans	-67.1	-42.7	178.4	-174.4	-95.7	0	0	0	112	Y155 Y156 K162 S163	Y155-F159 WeakPolarHBondContact O-CB 3.33Å; Y155-F159 PolarHBondContact O-N 3.25Å; Y156-F159 PolarHBondContact O-N 3.37Å; F159-K162 PolarHBondContact O-N 2.95Å; F159-S163 WeakPolarHBondContact O-CB 3.42Å; F159-S163 PolarHBondContact O-N 2.86Å; F159-S163 PolarHBondContact O-OG 3.31Å
160	S	92.4	Very high	89.7	Confident	40 Å²	40	101.6 Å²	101.6	28%	0.28	56%	0.556	S	S	.	*	H	α-helix	trans	-62.5	-46.5	177.2	64.3	0	0	0	0	111	Y156 M157 K162 S163 T164	Y156-S160 WeakPolarHBondContact O-CB 3.47Å; Y156-S160 PolarHBondContact O-N 2.95Å; Y156-S160 PolarHBondContact O-OG 2.71Å; M157-S160 WeakPolarHBondContact CA-OG 3.42Å; M157-S160 PolarHBondContact O-OG 3.44Å; S160-K162 VanDerWaalsContact C-N 3.32Å; S160-K162 PolarHBondContact O-N 3.35Å; S160-S163 WeakPolarHBondContact CA-OG 3.31Å; S160-S163 PolarHBondContact O-N 3.23Å; S160-S163 VanDerWaalsContact O-N 3.13Å; S160-S163 PolarHBondContact O-OG 2.85Å; S160-T164 WeakPolarHBondContact O-CG2 3.42Å; S160-T164 PolarHBondContact O-N 3.29Å; S160-T164 PolarHBondContact O-OG1 3.5Å
161	A	92.8	Very high	89.2	Confident	47 Å²	47	102.4 Å²	102.4	39%	0.388	56%	0.562	S	S	.	*	H	α-helix	trans	-60.4	-41	176.7	0	0	0	0	0	112.1	M157 T164 I165	M157-A161 WeakPolarHBondContact O-CB 3.44Å; M157-A161 PolarHBondContact O-N 2.94Å; A161-T164 WeakPolarHBondContact CA-OG1 3.43Å; A161-T164 PolarHBondContact O-N 3.33Å; A161-T164 PolarHBondContact O-OG1 2.77Å; A161-I165 WeakPolarHBondContact O-CD1 3.37Å; A161-I165 VanDerWaalsContact O-CG1 3.31Å; A161-I165 WeakPolarHBondContact O-CG1 3.47Å; A161-I165 PolarHBondContact O-N 3.02Å
162	K	90.4	Very high	88.7	Confident	114 Å²	114	106.4 Å²	106.4	50%	0.496	57%	0.572	S	S	.	*	H	α-helix	trans	-62.1	-47.3	173.1	-170	-161.3	-179.1	-147.7	0	111.3	A158 F159 S160 T164 I165 Q166	A158-K162 WeakPolarHBondContact O-CB 3.43Å; A158-K162 PolarHBondContact O-N 3.13Å; F159-K162 PolarHBondContact O-N 2.95Å; S160-K162 VanDerWaalsContact C-N 3.32Å; S160-K162 PolarHBondContact O-N 3.35Å; K162-T164 VanDerWaalsContact C-N 3.28Å; K162-T164 PolarHBondContact O-N 3.13Å; K162-I165 PolarHBondContact O-N 3.37Å; K162-I165 VanDerWaalsContact O-N 3.13Å; K162-Q166 WeakPolarHBondContact O-CG 3.47Å; K162-Q166 PolarHBondContact O-N 3.12Å; K162-Q166 VanDerWaalsContact O-N 3.12Å
163	S	82.1	Confident	88.2	Confident	55 Å²	55	105.9 Å²	105.9	39%	0.385	57%	0.572	S	S	.	*	H	α-helix	trans	-63	-33.2	-178.2	71.8	0	0	0	0	112.9	F159 S160 I165 A167	F159-S163 WeakPolarHBondContact O-CB 3.42Å; F159-S163 PolarHBondContact O-N 2.86Å; F159-S163 PolarHBondContact O-OG 3.31Å; S160-S163 WeakPolarHBondContact CA-OG 3.31Å; S160-S163 PolarHBondContact O-N 3.23Å; S160-S163 VanDerWaalsContact O-N 3.13Å; S160-S163 PolarHBondContact O-OG 2.85Å; S163-I165 VanDerWaalsContact C-N 3.35Å; S163-A167 PolarHBondContact O-N 3.4Å
164	T	87.6	Confident	87.5	Confident	100 Å²	100	106 Å²	106	61%	0.613	57%	0.573	S	S	*	*	H	α-helix	trans	-72.5	-25.8	175.8	49.5	0	0	0	0	113.5	S160 A161 K162	S160-T164 WeakPolarHBondContact O-CG2 3.42Å; S160-T164 PolarHBondContact O-N 3.29Å; S160-T164 PolarHBondContact O-OG1 3.5Å; A161-T164 WeakPolarHBondContact CA-OG1 3.43Å; A161-T164 PolarHBondContact O-N 3.33Å; A161-T164 PolarHBondContact O-OG1 2.77Å; K162-T164 VanDerWaalsContact C-N 3.28Å; K162-T164 PolarHBondContact O-N 3.13Å
165	I	81.6	Confident	86.8	Confident	140 Å²	140	106.2 Å²	106.2	72%	0.718	58%	0.576	S	S	*	*	H	α-helix	trans	-84.3	-27	177.9	-64.4	165.3	0	0	0	111.1	A161 K162 S163	A161-I165 WeakPolarHBondContact O-CD1 3.37Å; A161-I165 VanDerWaalsContact O-CG1 3.31Å; A161-I165 WeakPolarHBondContact O-CG1 3.47Å; A161-I165 PolarHBondContact O-N 3.02Å; K162-I165 PolarHBondContact O-N 3.37Å; K162-I165 VanDerWaalsContact O-N 3.13Å; S163-I165 VanDerWaalsContact C-N 3.35Å
166	Q	69.8	Low	85.9	Confident	140 Å²	140	101.5 Å²	101.5	65%	0.654	57%	0.572	S	S	*	*			trans	-90.9	0.9	-179.9	-64.1	-169.6	-66.9	0	0	113.9	K162	K162-Q166 WeakPolarHBondContact O-CG 3.47Å; K162-Q166 PolarHBondContact O-N 3.12Å; K162-Q166 VanDerWaalsContact O-N 3.12Å
167	A	52.4	Low	84.9	Confident	140 Å²	140	96.7 Å²	96.7	100%	1.157	57%	0.569	S	S	*	*			trans	-94.6	0	172.3	0	0	0	0	0	110.3	S163	S163-A167 PolarHBondContact O-N 3.4Å

Retrieved 167 of 167 residues in 138 ms (Link to these results)

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