A0A087WRT0_MOUSE Loading...

Cysteine protease

Cysteine protease that plays a key role in autophagy by mediating both proteolytic activation and delipidation of ATG8 family proteins.

AlphaFold DB , UniProt , Accession A0A087WRT0, Species MOUSE (Mus musculus, Mouse), Gene Atg4b, Length 143 aa.

						>A0A087WRT0_MOUSE|A0A087WRT0|Atg4b
MDAATLTYDTLRFAEFEDFPETSEPVWILGRKYSIFTEKDEILSDVASRLWFTYRRNFPAIGGTGPTSDTGWGCMLRCGQMIFAQALVCRHLGRDWRWTQRKRQPDSYFNVLNAFLDRKDSYYSIHQIGNLLYSTHGVPWLFT
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	44.4	Very low	59	Low	239 Å²	239	102.6 Å²	102.6	100%	1.177	58%	0.575	S	S	*	*				0	118.9	0	-75.6	-180	-178.5	0	0	106
2	D	42.9	Very low	60.1	Low	120 Å²	120	107.8 Å²	107.8	64%	0.642	58%	0.579	S	S	*	*			trans	-84.3	124	-169.3	-158.5	-6.5	0	0	0	110.7	A4 T5	D2-A4 PolarHBondContact O-N 3.37Å; D2-A4 VanDerWaalsContact O-N 3.11Å; D2-T5 PolarHBondContact O-N 3.07Å; D2-T5 VanDerWaalsContact O-N 3.1Å; D2-T5 PolarHBondContact O-OG1 2.72Å
3	A	46.4	Very low	61	Low	78 Å²	78	111.2 Å²	111.2	65%	0.645	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-59.2	-25.8	-174.1	0	0	0	0	0	112.5	T5 L6	A3-T5 PolarHBondContact O-N 2.66Å; A3-L6 PolarHBondContact O-N 3.1Å
4	A	52.3	Low	61.8	Low	52 Å²	52	106.3 Å²	106.3	43%	0.43	57%	0.569	S	S	.	*	G	3₁₀ helix	trans	-64.2	-18	177.6	0	0	0	0	0	114.5	D2 T7 Y8	D2-A4 PolarHBondContact O-N 3.37Å; D2-A4 VanDerWaalsContact O-N 3.11Å; A4-T7 PolarHBondContact O-OG1 3.48Å; A4-Y8 VanDerWaalsContact O-CD2 3.26Å; A4-Y8 WeakPolarHBondContact O-CD2 3.41Å; A4-Y8 WeakPolarHBondContact O-CE2 3.44Å
5	T	53.5	Low	62.4	Low	69 Å²	69	111.2 Å²	111.2	42%	0.423	59%	0.587	S	S	.	*	G	3₁₀ helix	trans	-82.6	-22.3	179	47.2	0	0	0	0	113.8	D2 A3 T70	D2-T5 PolarHBondContact O-N 3.07Å; D2-T5 VanDerWaalsContact O-N 3.1Å; D2-T5 PolarHBondContact O-OG1 2.72Å; A3-T5 PolarHBondContact O-N 2.66Å; T5-T70 WeakPolarHBondContact O-CG2 3.49Å
6	L	59.7	Low	63.2	Low	93 Å²	93	115 Å²	115	49%	0.487	60%	0.598	S	S	.	*	G	3₁₀ helix	trans	-78	-25.3	-179.7	-79.5	158.7	0	0	0	112.9	A3 Y8 D9	A3-L6 PolarHBondContact O-N 3.1Å; L6-Y8 PolarHBondContact O-N 3.14Å; L6-D9 PolarHBondContact O-N 2.89Å
7	T	68.6	Low	64.1	Low	96 Å²	96	118.5 Å²	118.5	59%	0.589	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-67.9	-20.9	-178.7	52.3	0	0	0	0	113.2	A4	A4-T7 PolarHBondContact O-OG1 3.48Å
8	Y	65.7	Low	65.1	Low	125 Å²	125	118.7 Å²	118.7	49%	0.49	61%	0.613	S	S	.	*	G	3₁₀ helix	trans	-90	-5.4	178	-63.6	-79.8	0	0	0	113.7	A4 L6 T10	A4-Y8 VanDerWaalsContact O-CD2 3.26Å; A4-Y8 WeakPolarHBondContact O-CD2 3.41Å; A4-Y8 WeakPolarHBondContact O-CE2 3.44Å; L6-Y8 PolarHBondContact O-N 3.14Å; Y8-T10 PolarHBondContact O-N 2.91Å; Y8-T10 VanDerWaalsContact O-N 3.1Å
9	D	72	Confident	66.1	Low	62 Å²	62	116.4 Å²	116.4	33%	0.332	60%	0.598	S	S	.	*			trans	-85	57.2	172.1	-167.5	10.1	0	0	0	110.2	L6 L11 R12	L6-D9 PolarHBondContact O-N 2.89Å; D9-L11 PolarHBondContact O-N 3.04Å; D9-R12 HydrophobicContact CB-CB 4.42Å; D9-R12 VanDerWaalsContact O-CB 3.29Å; D9-R12 WeakPolarHBondContact O-CB 3.44Å; D9-R12 PolarHBondContact O-N 3.3Å; D9-R12 VanDerWaalsContact O-N 3.11Å
10	T	71.4	Confident	67.1	Low	99 Å²	99	115.3 Å²	115.3	61%	0.607	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-64.8	-29.2	-173.9	53.9	0	0	0	0	112.5	Y8 R12 F13 A14	Y8-T10 PolarHBondContact O-N 2.91Å; Y8-T10 VanDerWaalsContact O-N 3.1Å; T10-R12 PolarHBondContact O-N 3.24Å; T10-F13 PolarHBondContact O-N 2.76Å; T10-A14 PolarHBondContact O-N 2.82Å; T10-A14 VanDerWaalsContact O-N 3.16Å
11	L	72.1	Confident	68.2	Low	96 Å²	96	117.2 Å²	117.2	50%	0.503	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-63	-26.1	174.9	-71.2	177	0	0	0	113.1	D9 F13 F16 W51	D9-L11 PolarHBondContact O-N 3.04Å; L11-F13 PolarHBondContact O-N 2.88Å; L11-F16 WeakPolarHBondContact O-CZ 3.25Å; L11-W51 HydrophobicContact CD1-CZ2 4.02Å
12	R	71.9	Confident	70.5	Confident	164 Å²	164	108.6 Å²	108.6	62%	0.619	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-66.3	-28.1	177.5	-177.3	175.7	178.1	158.3	0.8	113	D9 T10	D9-R12 HydrophobicContact CB-CB 4.42Å; D9-R12 VanDerWaalsContact O-CB 3.29Å; D9-R12 WeakPolarHBondContact O-CB 3.44Å; D9-R12 PolarHBondContact O-N 3.3Å; D9-R12 VanDerWaalsContact O-N 3.11Å; T10-R12 PolarHBondContact O-N 3.24Å
13	F	72.1	Confident	72.9	Confident	152 Å²	152	107.8 Å²	107.8	67%	0.667	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-112.4	5.6	-176.7	-53.6	-74.7	0	0	0	112.6	T10 L11	T10-F13 PolarHBondContact O-N 2.76Å; L11-F13 PolarHBondContact O-N 2.88Å
14	A	72.9	Confident	75.3	Confident	43 Å²	43	110.3 Å²	110.3	36%	0.355	57%	0.568	S	S	.	*			trans	-69.1	140.8	175.4	0	0	0	0	0	110.2	T10 F16	T10-A14 PolarHBondContact O-N 2.82Å; T10-A14 VanDerWaalsContact O-N 3.16Å; A14-F16 WeakPolarHBondContact O-CD2 3.29Å; A14-F16 VanDerWaalsContact O-CE2 3.3Å; A14-F16 WeakPolarHBondContact O-CE2 3.37Å
15	E	69.7	Low	77.4	Confident	180 Å²	180	109.9 Å²	109.9	84%	0.841	56%	0.561	S	S	*	*			trans	-73.5	132.7	167.3	-67.6	-175.3	166.9	0	0	108.9
16	F	75.3	Confident	79.5	Confident	172 Å²	172	108 Å²	108	75%	0.754	55%	0.549	S	S	*	.			trans	-103.2	102.7	178.5	-62.7	-82.6	0	0	0	108.4	L11 A14	L11-F16 WeakPolarHBondContact O-CZ 3.25Å; A14-F16 WeakPolarHBondContact O-CD2 3.29Å; A14-F16 VanDerWaalsContact O-CE2 3.3Å; A14-F16 WeakPolarHBondContact O-CE2 3.37Å
17	E	78.9	Confident	81.3	Confident	174 Å²	174	111.2 Å²	111.2	81%	0.813	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-89.1	143.6	169.3	-65.3	-171.6	165.5	0	0	110.3
18	D	81.9	Confident	82.8	Confident	122 Å²	122	107.7 Å²	107.7	65%	0.652	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-69.9	160.8	169.5	-107.1	-5	0	0	0	110.4	K39	D18-K39 IonicContact OD2-NZ 3.13Å; D18-K39 PolarHBondContact OD2-NZ 2.89Å
19	F	83.6	Confident	84.3	Confident	75 Å²	75	106.5 Å²	106.5	33%	0.329	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-56	131.7	175.6	-73.8	-82.4	0	0	0	111	E21 I35 I42 L43	F19-E21 PolarHBondContact O-N 3.03Å; F19-I35 HydrophobicContact CB-CD1 3.54Å; F19-I35 HydrophobicContact CB-CG1 4.12Å; F19-I35 HydrophobicContact CD2-CD1 4.4Å; F19-I35 HydrophobicContact CG-CD1 4.04Å; F19-I42 HydrophobicContact CD2-CG2 4.27Å; F19-I42 HydrophobicContact CE1-CG2 4.15Å; F19-I42 HydrophobicContact CE2-CG2 3.64Å; F19-I42 HydrophobicContact CZ-CG2 3.56Å; F19-L43 HydrophobicContact CE2-CD2 4.08Å
20	P	87.8	Confident	85.5	Confident	95 Å²	95	106.8 Å²	106.8	62%	0.617	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-66.1	132.2	177.6	28.1	-34.8	0	0	0	110.3	T22	P20-T22 HydrophobicContact CB-CG2 4.08Å; P20-T22 PolarHBondContact O-N 2.82Å
21	E	88.6	Confident	86.8	Confident	155 Å²	155	106 Å²	106	72%	0.724	54%	0.537	S	S	*	.			trans	-74.7	93.8	177.9	-68.6	-173.8	-174.3	0	0	110.3	F19 F36	F19-E21 PolarHBondContact O-N 3.03Å; E21-F36 HydrophobicContact CB-CE1 4.03Å
22	T	93.5	Very high	88.1	Confident	58 Å²	58	107.6 Å²	107.6	36%	0.356	54%	0.54	S	S	.	.			trans	-132.6	158.3	-177.5	71	0	0	0	0	111.4	P20 E24 I35 F36	P20-T22 HydrophobicContact CB-CG2 4.08Å; P20-T22 PolarHBondContact O-N 2.82Å; T22-E24 PolarHBondContact O-N 2.88Å; T22-I35 VanDerWaalsContact O-CG2 3.23Å; T22-I35 WeakPolarHBondContact O-CG2 3.47Å; T22-F36 WeakPolarHBondContact O-CE2 3.38Å
23	S	93.9	Very high	89.3	Confident	104 Å²	104	100.7 Å²	100.7	73%	0.727	51%	0.514	S	S	*	.	S	Bend	trans	-72.8	-9.7	172.9	55.4	0	0	0	0	113.8
24	E	96.4	Very high	90.5	Very high	131 Å²	131	95.2 Å²	95.2	61%	0.612	50%	0.495	S	S	*	.	S	Bend	trans	-71.8	139.7	179	-68	-54.5	128.8	0	0	110.8	T22	T22-E24 PolarHBondContact O-N 2.88Å
25	P	96.9	Very high	91.6	Very high	43 Å²	43	93.6 Å²	93.6	28%	0.279	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-74.3	139.8	-178.3	30.3	-34.8	0	0	0	112.2	K32 Y33	P25-K32 HydrophobicContact CB-CD 4.07Å; P25-K32 HydrophobicContact CB-CG 3.65Å; P25-Y33 WeakPolarHBondContact CA-O 3.2Å
26	V	97.3	Very high	92.8	Very high	30 Å²	30	91 Å²	91	18%	0.182	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	123.6	170.8	179.6	0	0	0	0	108.8	I28 K32 Y33 I42	V26-I28 HydrophobicContact CG1-CD1 4.23Å; V26-I28 HydrophobicContact CG1-CG1 4.19Å; V26-K32 CarbonylContact O-C 3.52Å; V26-Y33 PolarHBondContact N-O 3.03Å; V26-Y33 PolarHBondContact O-N 3.27Å; V26-I42 HydrophobicContact CB-CD1 3.99Å; V26-I42 HydrophobicContact CB-CG1 4.46Å; V26-I42 HydrophobicContact CG1-CD1 4.26Å; V26-I42 HydrophobicContact CG1-CG1 4.35Å; V26-I42 HydrophobicContact CG1-CG2 4.4Å; V26-I42 HydrophobicContact CG2-CD1 4.01Å
27	W	97.9	Very high	93.8	Very high	160 Å²	160	87.8 Å²	87.8	61%	0.606	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.7	124.1	177.9	-73.6	91.5	0	0	0	111.6	R31 K32	W27-R31 CarbonylContact C-O 3.57Å; W27-R31 VanDerWaalsContact CA-O 3.29Å; W27-R31 WeakPolarHBondContact CA-O 3.35Å; W27-K32 HydrophobicContact CD2-CB 4.1Å; W27-K32 HydrophobicContact CD2-CG 4.26Å; W27-K32 HydrophobicContact CE3-CB 3.95Å; W27-K32 HydrophobicContact CH2-CB 3.72Å; W27-K32 HydrophobicContact CH2-CD 4.16Å; W27-K32 HydrophobicContact CH2-CG 4.13Å; W27-K32 HydrophobicContact CZ2-CB 3.85Å; W27-K32 HydrophobicContact CZ2-CD 3.71Å; W27-K32 HydrophobicContact CZ2-CG 3.73Å; W27-K32 HydrophobicContact CZ3-CB 3.76Å
28	I	98.4	Very high	94.7	Very high	22 Å²	22	82.6 Å²	82.6	11%	0.113	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	110.5	176.3	-59	165.6	0	0	0	108.2	V26 G30 R31 Y33 I42 D45 V46 R94	V26-I28 HydrophobicContact CG1-CD1 4.23Å; V26-I28 HydrophobicContact CG1-CG1 4.19Å; I28-G30 VanDerWaalsContact C-N 3.3Å; I28-G30 PolarHBondContact O-N 3.33Å; I28-G30 VanDerWaalsContact O-N 3.14Å; I28-R31 PolarHBondContact N-O 2.91Å; I28-R31 WeakPolarHBondContact O-CB 3.23Å; I28-R31 PolarHBondContact O-N 3.39Å; I28-Y33 HydrophobicContact CB-CE2 4.16Å; I28-Y33 HydrophobicContact CD1-CD2 4.19Å; I28-Y33 HydrophobicContact CD1-CE2 4.17Å; I28-Y33 HydrophobicContact CG1-CE2 4.49Å; I28-I42 HydrophobicContact CD1-CB 4.5Å; I28-I42 HydrophobicContact CD1-CG2 4.03Å; I28-D45 HydrophobicContact CD1-CB 4.46Å; I28-V46 HydrophobicContact CD1-CG2 3.73Å; I28-R94 PolarHBondContact O-NH2 3.12Å
29	L	98.1	Very high	95.3	Very high	99 Å²	99	80.2 Å²	80.2	52%	0.518	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.3	51.6	173	-55.4	176.9	0	0	0	113.3	R31 Q85 R94	L29-R31 PolarHBondContact O-N 3.18Å; L29-Q85 HydrophobicContact CD1-CG 3.78Å; L29-R94 PolarHBondContact O-NE 3.34Å; L29-R94 VanDerWaalsContact O-NE 3.1Å
30	G	98	Very high	95.9	Very high	68 Å²	68	82.6 Å²	82.6	70%	0.701	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	3.9	178.9	0	0	0	0	0	116.2	I28	I28-G30 VanDerWaalsContact C-N 3.3Å; I28-G30 PolarHBondContact O-N 3.33Å; I28-G30 VanDerWaalsContact O-N 3.14Å
31	R	98.3	Very high	96.3	Very high	84 Å²	84	82.5 Å²	82.5	32%	0.317	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	137.4	171.1	-66	-80.2	165.8	136.4	1	109.9	W27 I28 L29 Y33 R94 D95	W27-R31 CarbonylContact C-O 3.57Å; W27-R31 VanDerWaalsContact CA-O 3.29Å; W27-R31 WeakPolarHBondContact CA-O 3.35Å; I28-R31 PolarHBondContact N-O 2.91Å; I28-R31 WeakPolarHBondContact O-CB 3.23Å; I28-R31 PolarHBondContact O-N 3.39Å; L29-R31 PolarHBondContact O-N 3.18Å; R31-Y33 HydrophobicContact CB-CD2 4.27Å; R31-Y33 HydrophobicContact CB-CE2 3.37Å; R31-Y33 WeakPolarHBondContact CB-OH 3.38Å; R31-Y33 HydrophobicContact CG-CE2 4.42Å; R31-R94 VanDerWaalsContact CG-NH2 3.3Å; R31-D95 IonicContact CZ-OD1 3.85Å; R31-D95 IonicContact NH1-OD1 3.24Å; R31-D95 PolarHBondContact NH1-OD1 2.92Å; R31-D95 IonicContact NH2-OD1 3.11Å; R31-D95 PolarHBondContact NH2-OD1 3.35Å; R31-D95 IonicContact NH2-OD2 3.41Å; R31-D95 PolarHBondContact NH2-OD2 2.9Å; R31-D95 VanDerWaalsContact NH2-OD2 3.07Å
32	K	98.3	Very high	96.7	Very high	129 Å²	129	75.1 Å²	75.1	56%	0.561	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.1	135.8	175.9	-169.6	-174.4	179.4	-178.8	0	108.8	P25 V26 W27	P25-K32 HydrophobicContact CB-CD 4.07Å; P25-K32 HydrophobicContact CB-CG 3.65Å; V26-K32 CarbonylContact O-C 3.52Å; W27-K32 HydrophobicContact CD2-CB 4.1Å; W27-K32 HydrophobicContact CD2-CG 4.26Å; W27-K32 HydrophobicContact CE3-CB 3.95Å; W27-K32 HydrophobicContact CH2-CB 3.72Å; W27-K32 HydrophobicContact CH2-CD 4.16Å; W27-K32 HydrophobicContact CH2-CG 4.13Å; W27-K32 HydrophobicContact CZ2-CB 3.85Å; W27-K32 HydrophobicContact CZ2-CD 3.71Å; W27-K32 HydrophobicContact CZ2-CG 3.73Å; W27-K32 HydrophobicContact CZ3-CB 3.76Å
33	Y	98	Very high	96.8	Very high	18 Å²	18	76.1 Å²	76.1	7%	0.071	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	153.6	178.7	-59.9	-80.4	0	0	0	111.3	P25 V26 I28 R31 E38 E41 I42 D45 R97	P25-Y33 WeakPolarHBondContact CA-O 3.2Å; V26-Y33 PolarHBondContact N-O 3.03Å; V26-Y33 PolarHBondContact O-N 3.27Å; I28-Y33 HydrophobicContact CB-CE2 4.16Å; I28-Y33 HydrophobicContact CD1-CD2 4.19Å; I28-Y33 HydrophobicContact CD1-CE2 4.17Å; I28-Y33 HydrophobicContact CG1-CE2 4.49Å; R31-Y33 HydrophobicContact CB-CD2 4.27Å; R31-Y33 HydrophobicContact CB-CE2 3.37Å; R31-Y33 WeakPolarHBondContact CB-OH 3.38Å; R31-Y33 HydrophobicContact CG-CE2 4.42Å; Y33-E38 WeakPolarHBondContact CA-OE2 3.39Å; Y33-E38 HydrophobicContact CD1-CB 4.16Å; Y33-E41 HydrophobicContact CD1-CB 4.12Å; Y33-E41 HydrophobicContact CE1-CB 3.91Å; Y33-I42 HydrophobicContact CD1-CG1 4.34Å; Y33-I42 HydrophobicContact CD2-CG1 4.17Å; Y33-I42 HydrophobicContact CG-CG1 3.76Å; Y33-D45 PolarHBondContact OH-OD2 3.4Å; Y33-D45 VanDerWaalsContact OH-OD2 3.11Å; Y33-R97 PolarHBondContact OH-NH2 3.4Å; Y33-R97 VanDerWaalsContact OH-NH2 3.11Å
34	S	97.1	Very high	97	Very high	38 Å²	38	73.2 Å²	73.2	27%	0.266	38%	0.376	S	S	.	.			trans	-102.5	123.3	169.1	163.7	0	0	0	0	109.9	F36 T37 E38	S34-F36 PolarHBondContact O-N 3.17Å; S34-T37 VanDerWaalsContact CB-OG1 3.25Å; S34-T37 WeakPolarHBondContact CB-OG1 3.33Å; S34-T37 PolarHBondContact O-N 3.31Å; S34-T37 PolarHBondContact OG-OG1 3.25Å; S34-T37 VanDerWaalsContact OG-OG1 3.04Å; S34-E38 PolarHBondContact N-OE2 3.04Å; S34-E38 WeakPolarHBondContact O-CA 3.3Å; S34-E38 WeakPolarHBondContact O-CB 3.49Å; S34-E38 PolarHBondContact O-N 2.99Å
35	I	95.7	Very high	97.1	Very high	9 Å²	9	67 Å²	67	5%	0.046	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-28.8	-179.2	-170.6	57.7	0	0	0	113	F19 T22 K39 I42	F19-I35 HydrophobicContact CB-CD1 3.54Å; F19-I35 HydrophobicContact CB-CG1 4.12Å; F19-I35 HydrophobicContact CD2-CD1 4.4Å; F19-I35 HydrophobicContact CG-CD1 4.04Å; T22-I35 VanDerWaalsContact O-CG2 3.23Å; T22-I35 WeakPolarHBondContact O-CG2 3.47Å; I35-K39 HydrophobicContact CD1-CB 4.35Å; I35-K39 HydrophobicContact CD1-CG 4.1Å; I35-I42 HydrophobicContact CD1-CD1 3.86Å
36	F	94.8	Very high	97.1	Very high	124 Å²	124	68.5 Å²	68.5	54%	0.544	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-29.6	-178.6	-60.7	-62	0	0	0	113.6	E21 T22 S34	E21-F36 HydrophobicContact CB-CE1 4.03Å; T22-F36 WeakPolarHBondContact O-CE2 3.38Å; S34-F36 PolarHBondContact O-N 3.17Å
37	T	96.9	Very high	97.1	Very high	106 Å²	106	70.2 Å²	70.2	65%	0.65	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.7	-20.1	-170.4	52.5	0	0	0	0	113.5	S34	S34-T37 VanDerWaalsContact CB-OG1 3.25Å; S34-T37 WeakPolarHBondContact CB-OG1 3.33Å; S34-T37 PolarHBondContact O-N 3.31Å; S34-T37 PolarHBondContact OG-OG1 3.25Å; S34-T37 VanDerWaalsContact OG-OG1 3.04Å
38	E	97.2	Very high	97.1	Very high	64 Å²	64	62.7 Å²	62.7	30%	0.299	34%	0.344	S	S	.	.			trans	-128.4	29.2	-169.7	-60.8	172.2	107.2	0	0	112.2	Y33 S34 D40 E41 I42	Y33-E38 WeakPolarHBondContact CA-OE2 3.39Å; Y33-E38 HydrophobicContact CD1-CB 4.16Å; S34-E38 PolarHBondContact N-OE2 3.04Å; S34-E38 WeakPolarHBondContact O-CA 3.3Å; S34-E38 WeakPolarHBondContact O-CB 3.49Å; S34-E38 PolarHBondContact O-N 2.99Å; E38-D40 VanDerWaalsContact C-N 3.29Å; E38-D40 PolarHBondContact O-N 3.4Å; E38-E41 VanDerWaalsContact C-OE2 3.28Å; E38-E41 WeakPolarHBondContact CA-OE2 3.14Å; E38-E41 HydrophobicContact CB-CB 4.24Å; E38-E41 PolarHBondContact O-N 3.26Å; E38-I42 VanDerWaalsContact O-CG1 3.3Å; E38-I42 WeakPolarHBondContact O-CG1 3.42Å; E38-I42 PolarHBondContact O-N 3.27Å
39	K	94.8	Very high	97.1	Very high	73 Å²	73	63.6 Å²	63.6	32%	0.317	35%	0.346	S	S	.	.	H	α-helix	trans	-58.2	-41.4	-179.5	-172.4	172.6	-179.5	174	0	111.8	D18 I35 I42 L43	D18-K39 IonicContact OD2-NZ 3.13Å; D18-K39 PolarHBondContact OD2-NZ 2.89Å; I35-K39 HydrophobicContact CD1-CB 4.35Å; I35-K39 HydrophobicContact CD1-CG 4.1Å; K39-I42 WeakPolarHBondContact O-CB 3.36Å; K39-I42 PolarHBondContact O-N 3.43Å; K39-L43 HydrophobicContact CG-CD1 4.41Å; K39-L43 WeakPolarHBondContact O-CG 3.34Å; K39-L43 PolarHBondContact O-N 3.42Å
40	D	95.1	Very high	97.1	Very high	125 Å²	125	59.7 Å²	59.7	67%	0.668	33%	0.326	S	S	*	.	H	α-helix	trans	-68.8	-36.1	179.8	-72.6	-20.9	0	0	0	111.8	E38 L43 S44	E38-D40 VanDerWaalsContact C-N 3.29Å; E38-D40 PolarHBondContact O-N 3.4Å; D40-L43 PolarHBondContact O-N 2.77Å; D40-S44 WeakPolarHBondContact O-CB 3.38Å; D40-S44 PolarHBondContact O-N 2.64Å
41	E	97.2	Very high	97.1	Very high	93 Å²	93	64.9 Å²	64.9	44%	0.435	32%	0.324	S	S	.	.	H	α-helix	trans	-68.5	-38.9	175.8	-68.8	76.3	-175.9	0	0	111.8	Y33 E38 S44 D45	Y33-E41 HydrophobicContact CD1-CB 4.12Å; Y33-E41 HydrophobicContact CE1-CB 3.91Å; E38-E41 VanDerWaalsContact C-OE2 3.28Å; E38-E41 WeakPolarHBondContact CA-OE2 3.14Å; E38-E41 HydrophobicContact CB-CB 4.24Å; E38-E41 PolarHBondContact O-N 3.26Å; E41-S44 PolarHBondContact O-N 3.35Å; E41-D45 WeakPolarHBondContact O-CB 3.32Å; E41-D45 PolarHBondContact O-N 3.19Å
42	I	96.8	Very high	97.1	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-58.6	-54.2	172.3	-71.2	164.9	0	0	0	109.5	F19 V26 I28 Y33 I35 E38 K39 S44 D45 V46	F19-I42 HydrophobicContact CD2-CG2 4.27Å; F19-I42 HydrophobicContact CE1-CG2 4.15Å; F19-I42 HydrophobicContact CE2-CG2 3.64Å; F19-I42 HydrophobicContact CZ-CG2 3.56Å; V26-I42 HydrophobicContact CB-CD1 3.99Å; V26-I42 HydrophobicContact CB-CG1 4.46Å; V26-I42 HydrophobicContact CG1-CD1 4.26Å; V26-I42 HydrophobicContact CG1-CG1 4.35Å; V26-I42 HydrophobicContact CG1-CG2 4.4Å; V26-I42 HydrophobicContact CG2-CD1 4.01Å; I28-I42 HydrophobicContact CD1-CB 4.5Å; I28-I42 HydrophobicContact CD1-CG2 4.03Å; Y33-I42 HydrophobicContact CD1-CG1 4.34Å; Y33-I42 HydrophobicContact CD2-CG1 4.17Å; Y33-I42 HydrophobicContact CG-CG1 3.76Å; I35-I42 HydrophobicContact CD1-CD1 3.86Å; E38-I42 VanDerWaalsContact O-CG1 3.3Å; E38-I42 WeakPolarHBondContact O-CG1 3.42Å; E38-I42 PolarHBondContact O-N 3.27Å; K39-I42 WeakPolarHBondContact O-CB 3.36Å; K39-I42 PolarHBondContact O-N 3.43Å; I42-S44 VanDerWaalsContact C-N 3.34Å; I42-S44 PolarHBondContact O-N 3.17Å; I42-D45 PolarHBondContact O-N 2.84Å; I42-V46 WeakPolarHBondContact O-CG2 3.32Å; I42-V46 PolarHBondContact O-N 3.11Å
43	L	95.7	Very high	97	Very high	79 Å²	79	57.7 Å²	57.7	41%	0.414	30%	0.299	S	S	.	.	H	α-helix	trans	-62	-42.8	-179.7	-68.7	174.6	0	0	0	111.5	F19 K39 D40 D45 A47	F19-L43 HydrophobicContact CE2-CD2 4.08Å; K39-L43 HydrophobicContact CG-CD1 4.41Å; K39-L43 WeakPolarHBondContact O-CG 3.34Å; K39-L43 PolarHBondContact O-N 3.42Å; D40-L43 PolarHBondContact O-N 2.77Å; L43-D45 VanDerWaalsContact C-N 3.34Å; L43-D45 PolarHBondContact O-N 3.18Å; L43-A47 WeakPolarHBondContact O-CB 3.18Å; L43-A47 PolarHBondContact O-N 2.84Å
44	S	97.3	Very high	96.8	Very high	43 Å²	43	59.8 Å²	59.8	30%	0.301	31%	0.307	S	S	.	.	H	α-helix	trans	-60.8	-43.1	176.6	-176.4	0	0	0	0	111.5	D40 E41 I42 S48	D40-S44 WeakPolarHBondContact O-CB 3.38Å; D40-S44 PolarHBondContact O-N 2.64Å; E41-S44 PolarHBondContact O-N 3.35Å; I42-S44 VanDerWaalsContact C-N 3.34Å; I42-S44 PolarHBondContact O-N 3.17Å; S44-S48 VanDerWaalsContact O-CB 3.25Å; S44-S48 WeakPolarHBondContact O-CB 3.36Å; S44-S48 PolarHBondContact O-N 3.44Å; S44-S48 PolarHBondContact O-OG 3.48Å
45	D	98.4	Very high	96.8	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-68.5	-43.9	-178.7	-162.6	14.1	0	0	0	112.6	I28 Y33 E41 I42 L43 S48 R49 R94 R97	I28-D45 HydrophobicContact CD1-CB 4.46Å; Y33-D45 PolarHBondContact OH-OD2 3.4Å; Y33-D45 VanDerWaalsContact OH-OD2 3.11Å; E41-D45 WeakPolarHBondContact O-CB 3.32Å; E41-D45 PolarHBondContact O-N 3.19Å; I42-D45 PolarHBondContact O-N 2.84Å; L43-D45 VanDerWaalsContact C-N 3.34Å; L43-D45 PolarHBondContact O-N 3.18Å; D45-S48 PolarHBondContact O-N 2.97Å; D45-R49 WeakPolarHBondContact O-CG 3.38Å; D45-R49 PolarHBondContact O-NE 3.38Å; D45-R49 IonicContact OD1-CZ 2.81Å; D45-R49 IonicContact OD1-NE 3.7Å; D45-R49 PolarHBondContact OD1-NE 3.16Å; D45-R49 IonicContact OD1-NH2 2.75Å; D45-R49 PolarHBondContact OD1-NH2 3.11Å; D45-R94 IonicContact OD1-CZ 2.66Å; D45-R94 IonicContact OD1-NH1 3.63Å; D45-R94 PolarHBondContact OD1-NH1 2.84Å; D45-R94 IonicContact OD1-NH2 3.57Å; D45-R94 IonicContact OD2-CZ 3.07Å; D45-R94 IonicContact OD2-NH1 3.37Å; D45-R94 PolarHBondContact OD2-NH1 3.23Å; D45-R94 IonicContact OD2-NH2 2.72Å; D45-R94 PolarHBondContact OD2-NH2 3.21Å; D45-R97 VanDerWaalsContact CG-CZ 3.47Å; D45-R97 IonicContact OD1-CZ 3.58Å; D45-R97 IonicContact OD1-NE 3.92Å; D45-R97 PolarHBondContact OD1-NE 3.34Å; D45-R97 IonicContact OD1-NH1 3.07Å; D45-R97 IonicContact OD1-NH2 2.84Å; D45-R97 PolarHBondContact OD1-NH2 2.99Å; D45-R97 VanDerWaalsContact OD1-NH2 3.16Å; D45-R97 IonicContact OD2-CZ 2.64Å; D45-R97 IonicContact OD2-NH2 3.19Å; D45-R97 PolarHBondContact OD2-NH2 3.3Å
46	V	97.6	Very high	96.7	Very high	75 Å²	75	72.5 Å²	72.5	46%	0.455	35%	0.349	S	S	.	.	H	α-helix	trans	-62.4	-50.7	175.1	175.4	0	0	0	0	110.5	I28 I42 S48 R49	I28-V46 HydrophobicContact CD1-CG2 3.73Å; I42-V46 WeakPolarHBondContact O-CG2 3.32Å; I42-V46 PolarHBondContact O-N 3.11Å; V46-S48 PolarHBondContact O-N 3.4Å; V46-R49 WeakPolarHBondContact O-CB 3.28Å; V46-R49 PolarHBondContact O-N 3.24Å
47	A	96.6	Very high	96.8	Very high	65 Å²	65	73.4 Å²	73.4	54%	0.537	36%	0.359	S	S	.	.	H	α-helix	trans	-65.8	-19.5	-179.3	0	0	0	0	0	113.4	L43 R49	L43-A47 WeakPolarHBondContact O-CB 3.18Å; L43-A47 PolarHBondContact O-N 2.84Å; A47-R49 VanDerWaalsContact C-N 3.32Å
48	S	98.3	Very high	96.7	Very high	3 Å²	3	68.9 Å²	68.9	2%	0.021	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-13.9	174.6	-62.6	0	0	0	0	113.7	S44 D45 V46 W96 R97 W98	S44-S48 VanDerWaalsContact O-CB 3.25Å; S44-S48 WeakPolarHBondContact O-CB 3.36Å; S44-S48 PolarHBondContact O-N 3.44Å; S44-S48 PolarHBondContact O-OG 3.48Å; D45-S48 PolarHBondContact O-N 2.97Å; V46-S48 PolarHBondContact O-N 3.4Å; S48-W96 WeakPolarHBondContact O-CZ3 2.96Å; S48-R97 VanDerWaalsContact OG-CA 3.28Å; S48-R97 WeakPolarHBondContact OG-CA 3.05Å; S48-R97 WeakPolarHBondContact OG-CD 3.45Å; S48-W98 PolarHBondContact OG-N 3.46Å
49	R	98.4	Very high	96.5	Very high	41 Å²	41	69.2 Å²	69.2	16%	0.155	34%	0.338	C	S	.	.	S	Bend	trans	-73.4	138	178.5	-56.6	-51.2	103.8	-163	5	109.7	D45 V46 A47 W51 W96	D45-R49 WeakPolarHBondContact O-CG 3.38Å; D45-R49 PolarHBondContact O-NE 3.38Å; D45-R49 IonicContact OD1-CZ 2.81Å; D45-R49 IonicContact OD1-NE 3.7Å; D45-R49 PolarHBondContact OD1-NE 3.16Å; D45-R49 IonicContact OD1-NH2 2.75Å; D45-R49 PolarHBondContact OD1-NH2 3.11Å; V46-R49 WeakPolarHBondContact O-CB 3.28Å; V46-R49 PolarHBondContact O-N 3.24Å; A47-R49 VanDerWaalsContact C-N 3.32Å; R49-W51 PolarHBondContact O-N 2.83Å; R49-W51 VanDerWaalsContact O-N 3.11Å; R49-W96 PolarHBondContact NH2-O 3.26Å
50	L	98.3	Very high	96.4	Very high	16 Å²	16	66.9 Å²	66.9	8%	0.084	33%	0.332	C	S	.	.			trans	-68.4	111.1	174.5	-73.5	176.2	0	0	0	109.1	F52 M81 A84 V88 Y108 V111 L112	L50-F52 HydrophobicContact CB-CE2 4.05Å; L50-F52 HydrophobicContact CB-CZ 3.87Å; L50-F52 HydrophobicContact CD1-CZ 4.38Å; L50-M81 WeakPolarHBondContact O-CG 3.27Å; L50-A84 HydrophobicContact CB-CB 4.13Å; L50-A84 HydrophobicContact CD1-CB 3.93Å; L50-V88 HydrophobicContact CD1-CG2 3.88Å; L50-V88 HydrophobicContact CG-CG2 4.31Å; L50-Y108 HydrophobicContact CD2-CE2 3.82Å; L50-V111 HydrophobicContact CD1-CG1 3.68Å; L50-L112 HydrophobicContact CD2-CD1 4.05Å
51	W	98.2	Very high	96.1	Very high	177 Å²	177	61 Å²	61	67%	0.67	30%	0.301	S	S	*	.			trans	-100.8	120.3	-177.6	-175.2	46	0	0	0	110.4	L11 R49 T53 M81	L11-W51 HydrophobicContact CD1-CZ2 4.02Å; R49-W51 PolarHBondContact O-N 2.83Å; R49-W51 VanDerWaalsContact O-N 3.11Å; W51-T53 HydrophobicContact CD2-CG2 3.74Å; W51-T53 HydrophobicContact CE3-CG2 4.18Å; W51-T53 HydrophobicContact CG-CG2 4.37Å; W51-T53 HydrophobicContact CH2-CG2 3.85Å; W51-T53 HydrophobicContact CZ2-CG2 3.35Å; W51-T53 HydrophobicContact CZ3-CG2 4.23Å; W51-M81 VanDerWaalsContact CD1-SD 3.55Å
52	F	97.9	Very high	95.6	Very high	22 Å²	22	59.4 Å²	59.4	10%	0.096	31%	0.309	C	S	.	.			trans	-114.3	130.2	177	-53.3	-66.3	0	0	0	109.6	L50 R77 Q80 M81 A84 L112 F115	L50-F52 HydrophobicContact CB-CE2 4.05Å; L50-F52 HydrophobicContact CB-CZ 3.87Å; L50-F52 HydrophobicContact CD1-CZ 4.38Å; F52-R77 HydrophobicContact CB-CB 4.48Å; F52-Q80 HydrophobicContact CD2-CB 3.56Å; F52-Q80 HydrophobicContact CE2-CB 4.03Å; F52-Q80 HydrophobicContact CG-CB 4.21Å; F52-M81 HydrophobicContact CB-CG 4.19Å; F52-M81 HydrophobicContact CD2-CB 4.4Å; F52-M81 HydrophobicContact CD2-CG 3.65Å; F52-M81 HydrophobicContact CE2-CG 4.5Å; F52-M81 HydrophobicContact CG-CG 4.34Å; F52-A84 HydrophobicContact CE2-CB 3.53Å; F52-A84 HydrophobicContact CZ-CB 3.99Å; F52-L112 HydrophobicContact CE1-CD1 4.3Å; F52-F115 HydrophobicContact CD1-CB 4.37Å; F52-F115 HydrophobicContact CE1-CB 3.56Å; F52-F115 HydrophobicContact CE1-CG 4.18Å; F52-F115 HydrophobicContact CE2-CB 4.17Å; F52-F115 HydrophobicContact CE2-CD1 4.04Å; F52-F115 HydrophobicContact CE2-CD2 4.39Å; F52-F115 AromaticContact CE2-CG 3.94Å; F52-F115 HydrophobicContact CE2-CG 3.94Å; F52-F115 HydrophobicContact CZ-CB 3.43Å; F52-F115 VanDerWaalsContact CZ-CB 3.43Å; F52-F115 HydrophobicContact CZ-CD1 4.09Å; F52-F115 AromaticContact CZ-CD2 3.84Å; F52-F115 HydrophobicContact CZ-CD2 3.84Å; F52-F115 AromaticContact CZ-CG 3.52Å; F52-F115 HydrophobicContact CZ-CG 3.52Å
53	T	95.9	Very high	95.2	Very high	40 Å²	40	61.5 Å²	61.5	25%	0.245	33%	0.331	C	S	.	.			trans	-124.8	176.4	-177.7	59.1	0	0	0	0	109.9	W51 R55 R77	W51-T53 HydrophobicContact CD2-CG2 3.74Å; W51-T53 HydrophobicContact CE3-CG2 4.18Å; W51-T53 HydrophobicContact CG-CG2 4.37Å; W51-T53 HydrophobicContact CH2-CG2 3.85Å; W51-T53 HydrophobicContact CZ2-CG2 3.35Å; W51-T53 HydrophobicContact CZ3-CG2 4.23Å; T53-R55 PolarHBondContact O-N 3.41Å; T53-R77 PolarHBondContact O-NE 3.49Å; T53-R77 VanDerWaalsContact O-NE 3.13Å
54	Y	95.4	Very high	94.8	Very high	63 Å²	63	64.5 Å²	64.5	25%	0.247	35%	0.353	C	S	.	.			trans	-55.1	140.5	170.5	-62.7	-44.7	0	0	0	111.8	D69 T70 C74	Y54-D69 VanDerWaalsContact CD1-O 3.29Å; Y54-D69 WeakPolarHBondContact CD1-O 3.41Å; Y54-D69 WeakPolarHBondContact CD1-OD2 3.36Å; Y54-D69 VanDerWaalsContact CE1-O 3.29Å; Y54-D69 WeakPolarHBondContact CE1-O 3.42Å; Y54-T70 HydrophobicContact CD2-CG2 4.26Å; Y54-C74 HydrophobicContact CE1-CB 4.12Å; Y54-C74 VanDerWaalsContact OH-CB 3.31Å; Y54-C74 WeakPolarHBondContact OH-CB 3.16Å
55	R	96.6	Very high	94.2	Very high	132 Å²	132	63.8 Å²	63.8	50%	0.498	35%	0.352	S	S	.	.			trans	-128.8	154.1	178.5	-65.1	-73.6	-168.9	-168	-2.2	109.1	T53 F58 S68 D69 D117	T53-R55 PolarHBondContact O-N 3.41Å; R55-F58 HydrophobicContact CB-CD1 3.86Å; R55-F58 HydrophobicContact CB-CE1 4.19Å; R55-F58 VanDerWaalsContact O-CE1 3.31Å; R55-F58 WeakPolarHBondContact O-CE1 3.34Å; R55-S68 VanDerWaalsContact O-CA 3.28Å; R55-S68 WeakPolarHBondContact O-CA 3.18Å; R55-S68 PolarHBondContact O-OG 2.8Å; R55-D69 PolarHBondContact N-OD1 2.9Å; R55-D69 PolarHBondContact O-N 3.45Å; R55-D69 VanDerWaalsContact O-N 3.16Å; R55-D69 VanDerWaalsContact O-OD1 3.08Å; R55-D117 VanDerWaalsContact CG-OD2 3.27Å; R55-D117 WeakPolarHBondContact CG-OD2 3.43Å
56	R	94.2	Very high	93.8	Very high	182 Å²	182	65.3 Å²	65.3	69%	0.687	36%	0.362	S	S	*	.	B	Isolated β-bridge	trans	-136.8	158.2	180	62	-177.8	179.6	-175.2	-0.3	108.9	F58 T67	R56-F58 PolarHBondContact O-N 3.15Å; R56-T67 CarbonylContact C-O 3.59Å
57	N	95.4	Very high	93.6	Very high	142 Å²	142	65.1 Å²	65.1	76%	0.759	36%	0.361	S	S	*	.	S	Bend	trans	62.4	25.8	-178.9	-49.3	-36	0	0	0	113.4	T67	N57-T67 PolarHBondContact N-O 3.07Å
58	F	95.1	Very high	93.4	Very high	12 Å²	12	63.4 Å²	63.4	5%	0.053	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-79.5	159.8	166.3	54.8	-115.5	0	0	0	110.1	R55 R56 I61 P66 T67 S68 D69 D117 I125 H126	R55-F58 HydrophobicContact CB-CD1 3.86Å; R55-F58 HydrophobicContact CB-CE1 4.19Å; R55-F58 VanDerWaalsContact O-CE1 3.31Å; R55-F58 WeakPolarHBondContact O-CE1 3.34Å; R56-F58 PolarHBondContact O-N 3.15Å; F58-I61 HydrophobicContact CE2-CD1 3.86Å; F58-I61 HydrophobicContact CE2-CG1 3.88Å; F58-I61 HydrophobicContact CZ-CD1 4.21Å; F58-P66 WeakPolarHBondContact CE2-O 3.37Å; F58-T67 VanDerWaalsContact CE2-CA 3.49Å; F58-T67 VanDerWaalsContact CZ-C 3.45Å; F58-T67 PolarHBondContact N-O 3.46Å; F58-T67 WeakPolarHBondContact O-CB 3.49Å; F58-S68 VanDerWaalsContact CZ-CA 3.41Å; F58-S68 VanDerWaalsContact CZ-N 3.3Å; F58-D69 HydrophobicContact CE1-CB 4.19Å; F58-D69 WeakPolarHBondContact CE1-OD1 3.17Å; F58-D69 HydrophobicContact CZ-CB 4.18Å; F58-D117 HydrophobicContact CB-CB 3.85Å; F58-D117 HydrophobicContact CD1-CB 4.24Å; F58-D117 HydrophobicContact CG-CB 4.26Å; F58-I125 HydrophobicContact CD1-CG2 4.44Å; F58-I125 HydrophobicContact CE1-CG2 4.19Å; F58-I125 HydrophobicContact CE2-CG2 4.39Å; F58-I125 HydrophobicContact CZ-CG2 4.15Å; F58-H126 AromaticContact CD2-CE1 3.87Å; F58-H126 AromaticContact CD2-NE2 3.69Å
59	P	94.2	Very high	93.1	Very high	70 Å²	70	63.2 Å²	63.2	46%	0.455	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-54.7	141.4	178.8	-26.1	35.1	0	0	0	112.1	I61 H126	P59-I61 PolarHBondContact O-N 3.14Å; P59-H126 PolarHBondContact O-CD2 2.75Å; P59-H126 PolarHBondContact O-NE2 3.4Å
60	A	91.6	Very high	92.8	Very high	24 Å²	24	62.7 Å²	62.7	20%	0.198	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-54.6	127.4	-178.1	0	0	0	0	0	112.4	G62 G63 T67 K119	A60-G62 PolarHBondContact O-N 2.79Å; A60-G63 WeakPolarHBondContact CB-O 3.1Å; A60-G63 PolarHBondContact O-N 2.82Å; A60-G63 VanDerWaalsContact O-N 3.08Å; A60-T67 HydrophobicContact CB-CG2 3.98Å; A60-K119 VanDerWaalsContact O-CE 3.29Å; A60-K119 WeakPolarHBondContact O-CE 3.29Å; A60-K119 PolarHBondContact O-NZ 2.72Å
61	I	89.8	Confident	92.3	Very high	3 Å²	3	62.3 Å²	62.3	2%	0.015	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-63.1	129.8	175.3	-61.8	172	0	0	0	108.2	F58 P59 G63 G65 P66 W72 I125 N130 Y133	F58-I61 HydrophobicContact CE2-CD1 3.86Å; F58-I61 HydrophobicContact CE2-CG1 3.88Å; F58-I61 HydrophobicContact CZ-CD1 4.21Å; P59-I61 PolarHBondContact O-N 3.14Å; I61-G63 PolarHBondContact O-N 3.43Å; I61-G65 WeakPolarHBondContact O-CA 3.45Å; I61-G65 PolarHBondContact O-N 3.41Å; I61-P66 PolarHBondContact N-O 3.48Å; I61-P66 VanDerWaalsContact N-O 3.11Å; I61-W72 HydrophobicContact CD1-CH2 3.74Å; I61-W72 HydrophobicContact CD1-CZ2 4.14Å; I61-I125 HydrophobicContact CD1-CG1 4.47Å; I61-N130 HydrophobicContact CG2-CB 4.47Å; I61-Y133 HydrophobicContact CG2-CD2 4.41Å
62	G	86.4	Confident	91.8	Very high	58 Å²	58	54.6 Å²	54.6	60%	0.598	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	64.1	7.2	-175.2	0	0	0	0	0	115.3	A60 T64	A60-G62 PolarHBondContact O-N 2.79Å; G62-T64 VanDerWaalsContact C-N 3.32Å; G62-T64 PolarHBondContact O-N 3.44Å
63	G	87.9	Confident	91.5	Very high	45 Å²	45	53.6 Å²	53.6	46%	0.464	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	90.1	-29	-179.2	0	0	0	0	0	114.9	A60 I61	A60-G63 WeakPolarHBondContact CB-O 3.1Å; A60-G63 PolarHBondContact O-N 2.82Å; A60-G63 VanDerWaalsContact O-N 3.08Å; I61-G63 PolarHBondContact O-N 3.43Å
64	T	86.8	Confident	91.3	Very high	141 Å²	141	54.2 Å²	54.2	87%	0.865	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.1	-6.4	-179.6	54.7	0	0	0	0	114.1	G62	G62-T64 VanDerWaalsContact C-N 3.32Å; G62-T64 PolarHBondContact O-N 3.44Å
65	G	86.3	Confident	91.2	Very high	29 Å²	29	56.3 Å²	56.3	30%	0.299	33%	0.331	S	S	.	.	S	Bend	trans	-77.3	-165.9	179.4	0	0	0	0	0	113.6	I61	I61-G65 WeakPolarHBondContact O-CA 3.45Å; I61-G65 PolarHBondContact O-N 3.41Å
66	P	88.8	Confident	91	Very high	31 Å²	31	51.1 Å²	51.1	20%	0.201	31%	0.313	C	S	.	.			trans	-59.2	151	-175.7	-23.3	32.7	0	0	0	113.4	F58 I61 S68 W72 Y133	F58-P66 WeakPolarHBondContact CE2-O 3.37Å; I61-P66 PolarHBondContact N-O 3.48Å; I61-P66 VanDerWaalsContact N-O 3.11Å; P66-S68 WeakPolarHBondContact CB-O 3.45Å; P66-W72 HydrophobicContact CB-CZ2 3.95Å; P66-W72 HydrophobicContact CG-CZ2 4.08Å; P66-Y133 WeakPolarHBondContact CD-OH 3.25Å; P66-Y133 WeakPolarHBondContact CG-OH 3.36Å
67	T	93.3	Very high	91.1	Very high	71 Å²	71	42.8 Å²	42.8	44%	0.436	28%	0.281	S	S	.	.	S	Bend	trans	-111.5	7	170.6	56.8	0	0	0	0	112.1	R56 N57 F58 A60	R56-T67 CarbonylContact C-O 3.59Å; N57-T67 PolarHBondContact N-O 3.07Å; F58-T67 VanDerWaalsContact CE2-CA 3.49Å; F58-T67 VanDerWaalsContact CZ-C 3.45Å; F58-T67 PolarHBondContact N-O 3.46Å; F58-T67 WeakPolarHBondContact O-CB 3.49Å; A60-T67 HydrophobicContact CB-CG2 3.98Å
68	S	93.1	Very high	91.2	Very high	29 Å²	29	39 Å²	39	20%	0.203	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-144	142.7	174.7	-177.4	0	0	0	0	109.8	R55 F58 P66 T70 W72	R55-S68 VanDerWaalsContact O-CA 3.28Å; R55-S68 WeakPolarHBondContact O-CA 3.18Å; R55-S68 PolarHBondContact O-OG 2.8Å; F58-S68 VanDerWaalsContact CZ-CA 3.41Å; F58-S68 VanDerWaalsContact CZ-N 3.3Å; P66-S68 WeakPolarHBondContact CB-O 3.45Å; S68-T70 PolarHBondContact OG-N 3.02Å; S68-T70 PolarHBondContact OG-OG1 2.59Å; S68-W72 WeakPolarHBondContact O-CZ2 3.3Å; S68-W72 PolarHBondContact O-NE1 2.99Å
69	D	92.7	Very high	91.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	28%	0.28	C	S	.	.			trans	-101.8	5.2	173.5	71.9	-64.7	0	0	0	113.8	Y54 R55 F58 G71 W72 G73 R77 I125	Y54-D69 VanDerWaalsContact CD1-O 3.29Å; Y54-D69 WeakPolarHBondContact CD1-O 3.41Å; Y54-D69 WeakPolarHBondContact CD1-OD2 3.36Å; Y54-D69 VanDerWaalsContact CE1-O 3.29Å; Y54-D69 WeakPolarHBondContact CE1-O 3.42Å; R55-D69 PolarHBondContact N-OD1 2.9Å; R55-D69 PolarHBondContact O-N 3.45Å; R55-D69 VanDerWaalsContact O-N 3.16Å; R55-D69 VanDerWaalsContact O-OD1 3.08Å; F58-D69 HydrophobicContact CE1-CB 4.19Å; F58-D69 WeakPolarHBondContact CE1-OD1 3.17Å; F58-D69 HydrophobicContact CZ-CB 4.18Å; D69-G71 PolarHBondContact O-N 3.48Å; D69-W72 VanDerWaalsContact CA-CE2 3.48Å; D69-W72 HydrophobicContact CB-CD2 4.49Å; D69-W72 HydrophobicContact CB-CH2 4.06Å; D69-W72 HydrophobicContact CB-CZ2 3.71Å; D69-W72 PolarHBondContact O-N 2.92Å; D69-G73 WeakPolarHBondContact O-CA 3.41Å; D69-G73 PolarHBondContact O-N 3.17Å; D69-R77 VanDerWaalsContact CG-NH2 3.27Å; D69-R77 IonicContact OD1-CZ 3.18Å; D69-R77 IonicContact OD1-NE 2.84Å; D69-R77 IonicContact OD1-NH2 3.4Å; D69-R77 PolarHBondContact OD1-NH2 2.88Å; D69-R77 IonicContact OD2-CZ 3.16Å; D69-R77 IonicContact OD2-NE 3.44Å; D69-R77 PolarHBondContact OD2-NE 3.26Å; D69-R77 IonicContact OD2-NH2 3.4Å; D69-R77 PolarHBondContact OD2-NH2 3.48Å; D69-I125 HydrophobicContact CB-CD1 4.31Å; D69-I125 HydrophobicContact CB-CG1 4.04Å
70	T	91.3	Very high	91.4	Very high	30 Å²	30	36.9 Å²	36.9	18%	0.184	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	128.4	175.1	-52.9	0	0	0	0	111.6	T5 Y54 S68	T5-T70 WeakPolarHBondContact O-CG2 3.49Å; Y54-T70 HydrophobicContact CD2-CG2 4.26Å; S68-T70 PolarHBondContact OG-N 3.02Å; S68-T70 PolarHBondContact OG-OG1 2.59Å
71	G	87	Confident	91.8	Very high	8 Å²	8	38.4 Å²	38.4	8%	0.082	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	87	-7.2	176.5	0	0	0	0	0	115.5	D69	D69-G71 PolarHBondContact O-N 3.48Å
72	W	87.9	Confident	92.2	Very high	15 Å²	15	44.4 Å²	44.4	6%	0.057	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-142.1	-19.7	178.3	61	-87.9	0	0	0	115	I61 P66 S68 D69 C74 L76 I125 P139 W140	I61-W72 HydrophobicContact CD1-CH2 3.74Å; I61-W72 HydrophobicContact CD1-CZ2 4.14Å; P66-W72 HydrophobicContact CB-CZ2 3.95Å; P66-W72 HydrophobicContact CG-CZ2 4.08Å; S68-W72 WeakPolarHBondContact O-CZ2 3.3Å; S68-W72 PolarHBondContact O-NE1 2.99Å; D69-W72 VanDerWaalsContact CA-CE2 3.48Å; D69-W72 HydrophobicContact CB-CD2 4.49Å; D69-W72 HydrophobicContact CB-CH2 4.06Å; D69-W72 HydrophobicContact CB-CZ2 3.71Å; D69-W72 PolarHBondContact O-N 2.92Å; W72-C74 PolarHBondContact O-N 3.36Å; W72-L76 HydrophobicContact CE3-CD1 4.24Å; W72-L76 HydrophobicContact CZ3-CD1 3.72Å; W72-I125 HydrophobicContact CH2-CG1 4.26Å; W72-P139 HydrophobicContact CE3-CB 4.06Å; W72-P139 HydrophobicContact CE3-CG 4.38Å; W72-P139 HydrophobicContact CZ3-CB 4.26Å; W72-W140 HydrophobicContact CB-CD2 4.4Å; W72-W140 HydrophobicContact CB-CE3 3.56Å; W72-W140 HydrophobicContact CB-CH2 4.16Å; W72-W140 HydrophobicContact CB-CZ3 3.45Å; W72-W140 VanDerWaalsContact CB-CZ3 3.45Å; W72-W140 AromaticContact CD1-CH2 3.58Å; W72-W140 AromaticContact CD1-CZ3 3.72Å; W72-W140 HydrophobicContact CG-CE3 4.27Å; W72-W140 HydrophobicContact CG-CH2 4.04Å; W72-W140 AromaticContact CG-CZ3 3.84Å; W72-W140 HydrophobicContact CG-CZ3 3.84Å
73	G	91	Very high	92.7	Very high	0 Å²	0	46 Å²	46	0%	0	28%	0.284	C	S	.	.			trans	-82.2	-3.1	-175.3	0	0	0	0	0	115.5	D69 M75 L76 R77	D69-G73 WeakPolarHBondContact O-CA 3.41Å; D69-G73 PolarHBondContact O-N 3.17Å; G73-M75 PolarHBondContact O-N 3.46Å; G73-L76 CarbonylContact O-C 3.48Å; G73-L76 WeakPolarHBondContact O-CA 3.31Å; G73-L76 WeakPolarHBondContact O-CB 3.32Å; G73-L76 PolarHBondContact O-N 3.23Å; G73-R77 WeakPolarHBondContact O-CG 3.4Å; G73-R77 PolarHBondContact O-N 2.86Å
74	C	92.8	Very high	93.2	Very high	54 Å²	54	43.9 Å²	43.9	37%	0.365	26%	0.262	S	S	.	.	H	α-helix	trans	-57.5	-48.4	-166.7	49.7	0	0	0	0	112.3	Y54 W72 L76 R77 C78	Y54-C74 HydrophobicContact CE1-CB 4.12Å; Y54-C74 VanDerWaalsContact OH-CB 3.31Å; Y54-C74 WeakPolarHBondContact OH-CB 3.16Å; W72-C74 PolarHBondContact O-N 3.36Å; C74-L76 VanDerWaalsContact C-N 3.28Å; C74-L76 PolarHBondContact O-N 2.89Å; C74-R77 PolarHBondContact O-N 3.24Å; C74-C78 PolarHBondContact O-N 3.02Å; C74-C78 PolarHBondContact O-SG 2.92Å; C74-C78 VanDerWaalsContact O-SG 3.34Å
75	M	92.6	Very high	93.8	Very high	107 Å²	107	38.3 Å²	38.3	53%	0.527	23%	0.226	S	C	.	.	H	α-helix	trans	-65.8	-34.1	178.9	-170.5	56.3	68.5	0	0	111.8	G73 C78 G79 F142	G73-M75 PolarHBondContact O-N 3.46Å; M75-C78 PolarHBondContact O-N 3.19Å; M75-C78 HydrophobicContact SD-CB 4.39Å; M75-G79 PolarHBondContact O-N 2.88Å; M75-F142 HydrophobicContact CB-CB 4.4Å
76	L	93.9	Very high	94.4	Very high	23 Å²	23	39.5 Å²	39.5	12%	0.12	23%	0.233	C	C	.	.	H	α-helix	trans	-66.9	-40.4	175.6	-52.1	-175.2	0	0	0	111	W72 G73 C74 G79 Q80 I125 I128 L132	W72-L76 HydrophobicContact CE3-CD1 4.24Å; W72-L76 HydrophobicContact CZ3-CD1 3.72Å; G73-L76 CarbonylContact O-C 3.48Å; G73-L76 WeakPolarHBondContact O-CA 3.31Å; G73-L76 WeakPolarHBondContact O-CB 3.32Å; G73-L76 PolarHBondContact O-N 3.23Å; C74-L76 VanDerWaalsContact C-N 3.28Å; C74-L76 PolarHBondContact O-N 2.89Å; L76-G79 PolarHBondContact O-N 3.04Å; L76-Q80 WeakPolarHBondContact O-CG 3.48Å; L76-Q80 PolarHBondContact O-N 3.05Å; L76-I125 HydrophobicContact CB-CD1 3.78Å; L76-I125 HydrophobicContact CD1-CD1 3.66Å; L76-I125 HydrophobicContact CG-CD1 4.37Å; L76-I128 HydrophobicContact CD1-CG2 4.3Å; L76-I128 HydrophobicContact CD2-CG2 3.85Å; L76-I128 HydrophobicContact CG-CG2 4.45Å; L76-L132 HydrophobicContact CD1-CD1 4.13Å; L76-L132 HydrophobicContact CD2-CD1 3.54Å; L76-L132 HydrophobicContact CG-CD1 4.49Å
77	R	96.1	Very high	94.9	Very high	7 Å²	7	39.3 Å²	39.3	3%	0.026	23%	0.23	C	C	.	.	H	α-helix	trans	-64.7	-40.8	173.5	-62.3	-50.4	-176.7	173.2	1.2	111.9	F52 T53 D69 G73 C74 G79 Q80 M81 D117	F52-R77 HydrophobicContact CB-CB 4.48Å; T53-R77 PolarHBondContact O-NE 3.49Å; T53-R77 VanDerWaalsContact O-NE 3.13Å; D69-R77 VanDerWaalsContact CG-NH2 3.27Å; D69-R77 IonicContact OD1-CZ 3.18Å; D69-R77 IonicContact OD1-NE 2.84Å; D69-R77 IonicContact OD1-NH2 3.4Å; D69-R77 PolarHBondContact OD1-NH2 2.88Å; D69-R77 IonicContact OD2-CZ 3.16Å; D69-R77 IonicContact OD2-NE 3.44Å; D69-R77 PolarHBondContact OD2-NE 3.26Å; D69-R77 IonicContact OD2-NH2 3.4Å; D69-R77 PolarHBondContact OD2-NH2 3.48Å; G73-R77 WeakPolarHBondContact O-CG 3.4Å; G73-R77 PolarHBondContact O-N 2.86Å; C74-R77 PolarHBondContact O-N 3.24Å; R77-G79 VanDerWaalsContact C-N 3.34Å; R77-G79 PolarHBondContact O-N 3.44Å; R77-Q80 WeakPolarHBondContact O-CB 3.39Å; R77-Q80 PolarHBondContact O-N 3.34Å; R77-M81 WeakPolarHBondContact O-CG 3.36Å; R77-M81 PolarHBondContact O-N 3.16Å; R77-D117 IonicContact CZ-OD1 3.33Å; R77-D117 VanDerWaalsContact CZ-OD1 3.24Å; R77-D117 IonicContact NH1-OD1 2.72Å; R77-D117 PolarHBondContact NH1-OD1 2.75Å; R77-D117 IonicContact NH2-OD1 3.71Å; R77-D117 PolarHBondContact NH2-OD1 3.07Å; R77-D117 IonicContact NH2-OD2 3.89Å
78	C	96.3	Very high	95.1	Very high	63 Å²	63	35.9 Å²	35.9	43%	0.426	21%	0.209	S	C	.	.	H	α-helix	trans	-59.7	-44.1	171.5	-67.8	0	0	0	0	112	C74 M75 Q80 M81 I82	C74-C78 PolarHBondContact O-N 3.02Å; C74-C78 PolarHBondContact O-SG 2.92Å; C74-C78 VanDerWaalsContact O-SG 3.34Å; M75-C78 PolarHBondContact O-N 3.19Å; M75-C78 HydrophobicContact SD-CB 4.39Å; C78-Q80 PolarHBondContact O-N 3.41Å; C78-M81 HydrophobicContact CB-CE 4.47Å; C78-M81 PolarHBondContact O-N 2.97Å; C78-I82 PolarHBondContact O-N 3.33Å
79	G	96.6	Very high	95.4	Very high	35 Å²	35	37 Å²	37	36%	0.361	22%	0.217	S	C	.	.	H	α-helix	trans	-58.9	-44	173.2	0	0	0	0	0	112.9	M75 L76 R77 M81 I82 F83	M75-G79 PolarHBondContact O-N 2.88Å; L76-G79 PolarHBondContact O-N 3.04Å; R77-G79 VanDerWaalsContact C-N 3.34Å; R77-G79 PolarHBondContact O-N 3.44Å; G79-M81 PolarHBondContact O-N 2.81Å; G79-I82 WeakPolarHBondContact O-CG2 3.43Å; G79-F83 VanDerWaalsContact O-CB 3.27Å; G79-F83 WeakPolarHBondContact O-CB 3.39Å; G79-F83 PolarHBondContact O-N 3.47Å; G79-F83 VanDerWaalsContact O-N 3.07Å
80	Q	97.9	Very high	95.7	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.009	25%	0.249	C	C	.	.	H	α-helix	trans	-60.7	-43.3	173.7	-71.6	-177.4	-41.9	0	0	111.5	F52 L76 R77 C78 F83 A84 F115 Y123 I128	F52-Q80 HydrophobicContact CD2-CB 3.56Å; F52-Q80 HydrophobicContact CE2-CB 4.03Å; F52-Q80 HydrophobicContact CG-CB 4.21Å; L76-Q80 WeakPolarHBondContact O-CG 3.48Å; L76-Q80 PolarHBondContact O-N 3.05Å; R77-Q80 WeakPolarHBondContact O-CB 3.39Å; R77-Q80 PolarHBondContact O-N 3.34Å; C78-Q80 PolarHBondContact O-N 3.41Å; Q80-F83 PolarHBondContact O-N 3.26Å; Q80-A84 WeakPolarHBondContact O-CB 3.45Å; Q80-A84 PolarHBondContact O-N 2.9Å; Q80-F115 HydrophobicContact CB-CD1 3.84Å; Q80-F115 HydrophobicContact CB-CE1 4.2Å; Q80-F115 HydrophobicContact CG-CD1 3.96Å; Q80-F115 HydrophobicContact CG-CE1 4.48Å; Q80-F115 WeakPolarHBondContact O-CE1 3.48Å; Q80-Y123 PolarHBondContact NE2-O 3.31Å; Q80-I128 HydrophobicContact CG-CD1 3.77Å
81	M	98.6	Very high	96	Very high	55 Å²	55	48.8 Å²	48.8	27%	0.271	26%	0.262	S	S	.	.	H	α-helix	trans	-65.4	-47.6	-178.8	-71.6	-172	-72.7	0	0	112.6	L50 W51 F52 R77 C78 G79 F83 A84 Q85	L50-M81 WeakPolarHBondContact O-CG 3.27Å; W51-M81 VanDerWaalsContact CD1-SD 3.55Å; F52-M81 HydrophobicContact CB-CG 4.19Å; F52-M81 HydrophobicContact CD2-CB 4.4Å; F52-M81 HydrophobicContact CD2-CG 3.65Å; F52-M81 HydrophobicContact CE2-CG 4.5Å; F52-M81 HydrophobicContact CG-CG 4.34Å; R77-M81 WeakPolarHBondContact O-CG 3.36Å; R77-M81 PolarHBondContact O-N 3.16Å; C78-M81 HydrophobicContact CB-CE 4.47Å; C78-M81 PolarHBondContact O-N 2.97Å; G79-M81 PolarHBondContact O-N 2.81Å; M81-F83 VanDerWaalsContact C-N 3.32Å; M81-F83 PolarHBondContact O-N 3.01Å; M81-A84 PolarHBondContact O-N 2.93Å; M81-Q85 WeakPolarHBondContact O-CB 3.37Å; M81-Q85 PolarHBondContact O-N 3.17Å
82	I	98.5	Very high	96.6	Very high	130 Å²	130	50 Å²	50	67%	0.667	27%	0.266	S	S	*	.	H	α-helix	trans	-65.7	-38	179.2	-167.1	170.5	0	0	0	111.4	C78 G79 Q85 A86	C78-I82 PolarHBondContact O-N 3.33Å; G79-I82 WeakPolarHBondContact O-CG2 3.43Å; I82-Q85 PolarHBondContact O-N 3.31Å; I82-A86 PolarHBondContact O-N 3.36Å; I82-A86 VanDerWaalsContact O-N 3.17Å
83	F	98.4	Very high	97.1	Very high	91 Å²	91	50.5 Å²	50.5	40%	0.399	28%	0.276	S	S	.	.	H	α-helix	trans	-73.6	-39.5	178.8	-163.9	-112.2	0	0	0	112.4	G79 Q80 M81 Q85 A86 L87 F115 Y123	G79-F83 VanDerWaalsContact O-CB 3.27Å; G79-F83 WeakPolarHBondContact O-CB 3.39Å; G79-F83 PolarHBondContact O-N 3.47Å; G79-F83 VanDerWaalsContact O-N 3.07Å; Q80-F83 PolarHBondContact O-N 3.26Å; M81-F83 VanDerWaalsContact C-N 3.32Å; M81-F83 PolarHBondContact O-N 3.01Å; F83-Q85 VanDerWaalsContact C-N 3.27Å; F83-Q85 PolarHBondContact O-N 3.43Å; F83-A86 WeakPolarHBondContact O-CB 3.42Å; F83-A86 PolarHBondContact O-N 3.42Å; F83-A86 VanDerWaalsContact O-N 3.14Å; F83-L87 HydrophobicContact CD1-CD1 4.35Å; F83-L87 HydrophobicContact CE1-CD1 4.16Å; F83-L87 HydrophobicContact CE1-CG 4.4Å; F83-L87 PolarHBondContact O-N 2.99Å; F83-F115 HydrophobicContact CD1-CE1 4.21Å; F83-F115 AromaticContact CD1-CZ 3.97Å; F83-F115 HydrophobicContact CD1-CZ 3.97Å; F83-Y123 HydrophobicContact CD1-CD1 4.21Å; F83-Y123 HydrophobicContact CD1-CD2 4.24Å; F83-Y123 HydrophobicContact CD1-CE1 4.31Å; F83-Y123 HydrophobicContact CD1-CE2 4.36Å; F83-Y123 HydrophobicContact CD1-CG 4.18Å; F83-Y123 AromaticContact CE1-CD1 3.87Å; F83-Y123 HydrophobicContact CE1-CD1 3.87Å; F83-Y123 HydrophobicContact CE1-CD2 4.07Å; F83-Y123 AromaticContact CE1-CE1 3.52Å; F83-Y123 HydrophobicContact CE1-CE1 3.52Å; F83-Y123 AromaticContact CE1-CE2 3.76Å; F83-Y123 HydrophobicContact CE1-CE2 3.76Å; F83-Y123 HydrophobicContact CE1-CG 4.13Å; F83-Y123 AromaticContact CE1-CZ 3.48Å; F83-Y123 VanDerWaalsContact CE1-CZ 3.48Å; F83-Y123 HydrophobicContact CZ-CE1 4.29Å
84	A	98.6	Very high	97.4	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-61.6	-37.9	172	0	0	0	0	0	111.6	L50 F52 Q80 M81 A86 L87 V88 F115	L50-A84 HydrophobicContact CB-CB 4.13Å; L50-A84 HydrophobicContact CD1-CB 3.93Å; F52-A84 HydrophobicContact CE2-CB 3.53Å; F52-A84 HydrophobicContact CZ-CB 3.99Å; Q80-A84 WeakPolarHBondContact O-CB 3.45Å; Q80-A84 PolarHBondContact O-N 2.9Å; M81-A84 PolarHBondContact O-N 2.93Å; A84-A86 VanDerWaalsContact C-N 3.31Å; A84-A86 PolarHBondContact O-N 2.79Å; A84-L87 CarbonylContact O-C 3.58Å; A84-L87 PolarHBondContact O-N 3.09Å; A84-V88 WeakPolarHBondContact O-CG2 3.31Å; A84-V88 PolarHBondContact O-N 3.2Å; A84-F115 VanDerWaalsContact CA-CZ 3.41Å; A84-F115 HydrophobicContact CB-CD1 4.5Å; A84-F115 HydrophobicContact CB-CD2 4.03Å; A84-F115 HydrophobicContact CB-CE1 4Å; A84-F115 HydrophobicContact CB-CE2 3.49Å; A84-F115 VanDerWaalsContact CB-CE2 3.49Å; A84-F115 HydrophobicContact CB-CZ 3.48Å; A84-F115 VanDerWaalsContact CB-CZ 3.48Å
85	Q	98.8	Very high	97.7	Very high	25 Å²	25	54.8 Å²	54.8	12%	0.117	29%	0.292	C	S	.	.	H	α-helix	trans	-61.6	-39.4	173.9	176.6	53.1	34.2	0	0	112.1	L29 M81 I82 F83 V88 C89	L29-Q85 HydrophobicContact CD1-CG 3.78Å; M81-Q85 WeakPolarHBondContact O-CB 3.37Å; M81-Q85 PolarHBondContact O-N 3.17Å; I82-Q85 PolarHBondContact O-N 3.31Å; F83-Q85 VanDerWaalsContact C-N 3.27Å; F83-Q85 PolarHBondContact O-N 3.43Å; Q85-V88 PolarHBondContact O-N 3.21Å; Q85-C89 PolarHBondContact NE2-SG 3.21Å; Q85-C89 PolarHBondContact O-N 3.36Å
86	A	98.8	Very high	98	Very high	53 Å²	53	51.1 Å²	51.1	44%	0.438	27%	0.272	S	S	.	.	H	α-helix	trans	-62.3	-42.7	173.1	0	0	0	0	0	111.8	I82 F83 A84 C89 R90	I82-A86 PolarHBondContact O-N 3.36Å; I82-A86 VanDerWaalsContact O-N 3.17Å; F83-A86 WeakPolarHBondContact O-CB 3.42Å; F83-A86 PolarHBondContact O-N 3.42Å; F83-A86 VanDerWaalsContact O-N 3.14Å; A84-A86 VanDerWaalsContact C-N 3.31Å; A84-A86 PolarHBondContact O-N 2.79Å; A86-C89 PolarHBondContact O-N 3.28Å; A86-R90 WeakPolarHBondContact O-CB 3.33Å; A86-R90 PolarHBondContact O-N 3.34Å
87	L	98.7	Very high	98.2	Very high	27 Å²	27	52.4 Å²	52.4	14%	0.141	28%	0.276	C	S	.	.	H	α-helix	trans	-66.6	-38.9	176.2	-67.9	-178.1	0	0	0	112.7	F83 A84 R90 H91 V111 F115 Y123	F83-L87 HydrophobicContact CD1-CD1 4.35Å; F83-L87 HydrophobicContact CE1-CD1 4.16Å; F83-L87 HydrophobicContact CE1-CG 4.4Å; F83-L87 PolarHBondContact O-N 2.99Å; A84-L87 CarbonylContact O-C 3.58Å; A84-L87 PolarHBondContact O-N 3.09Å; L87-R90 PolarHBondContact O-N 3.5Å; L87-H91 WeakPolarHBondContact O-CB 3.47Å; L87-H91 PolarHBondContact O-CD2 2.98Å; L87-H91 PolarHBondContact O-N 2.77Å; L87-V111 HydrophobicContact CB-CG1 3.84Å; L87-V111 HydrophobicContact CB-CG2 4.11Å; L87-F115 HydrophobicContact CD1-CE2 3.8Å; L87-F115 HydrophobicContact CD1-CZ 3.81Å; L87-Y123 HydrophobicContact CD1-CD2 4.14Å; L87-Y123 HydrophobicContact CD1-CE2 3.68Å
88	V	98.7	Very high	98.3	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-57.8	-50.1	171.6	167.4	0	0	0	0	109.7	L50 A84 Q85 R90 H91 L92 G93 W96 V111	L50-V88 HydrophobicContact CD1-CG2 3.88Å; L50-V88 HydrophobicContact CG-CG2 4.31Å; A84-V88 WeakPolarHBondContact O-CG2 3.31Å; A84-V88 PolarHBondContact O-N 3.2Å; Q85-V88 PolarHBondContact O-N 3.21Å; V88-R90 VanDerWaalsContact C-N 3.29Å; V88-R90 PolarHBondContact O-N 3.06Å; V88-H91 PolarHBondContact O-N 3.11Å; V88-L92 HydrophobicContact CB-CD1 4.38Å; V88-L92 HydrophobicContact CG1-CB 4.37Å; V88-L92 HydrophobicContact CG1-CD1 4.07Å; V88-L92 HydrophobicContact CG2-CD1 4.17Å; V88-L92 WeakPolarHBondContact O-CA 3.24Å; V88-L92 VanDerWaalsContact O-CB 3.32Å; V88-L92 WeakPolarHBondContact O-CB 3.27Å; V88-L92 PolarHBondContact O-N 3.34Å; V88-G93 PolarHBondContact O-N 3.09Å; V88-W96 HydrophobicContact CG1-CE3 3.85Å; V88-W96 HydrophobicContact CG1-CZ3 4.23Å; V88-V111 HydrophobicContact CG2-CG1 4.27Å
89	C	98.6	Very high	98.2	Very high	53 Å²	53	56.1 Å²	56.1	36%	0.358	29%	0.287	S	S	.	.	H	α-helix	trans	-58.1	-41.3	175.4	-74.6	0	0	0	0	112.4	Q85 A86 G93	Q85-C89 PolarHBondContact NE2-SG 3.21Å; Q85-C89 PolarHBondContact O-N 3.36Å; A86-C89 PolarHBondContact O-N 3.28Å; C89-G93 WeakPolarHBondContact O-CA 3.16Å; C89-G93 PolarHBondContact O-N 3.25Å
90	R	98.6	Very high	97.8	Very high	182 Å²	182	60.8 Å²	60.8	69%	0.687	30%	0.3	S	S	*	.	H	α-helix	trans	-70	-34.2	-177.7	177.6	60.2	-176.9	87	-2.3	114.2	A86 L87 V88	A86-R90 WeakPolarHBondContact O-CB 3.33Å; A86-R90 PolarHBondContact O-N 3.34Å; L87-R90 PolarHBondContact O-N 3.5Å; V88-R90 VanDerWaalsContact C-N 3.29Å; V88-R90 PolarHBondContact O-N 3.06Å
91	H	98.4	Very high	97.5	Very high	95 Å²	95	72.2 Å²	72.2	44%	0.44	34%	0.343	S	S	.	.	H	α-helix	trans	-113	-22.5	-169.7	-64.9	-68.3	0	0	0	114.8	L87 V88 V111	L87-H91 WeakPolarHBondContact O-CB 3.47Å; L87-H91 PolarHBondContact O-CD2 2.98Å; L87-H91 PolarHBondContact O-N 2.77Å; V88-H91 PolarHBondContact O-N 3.11Å; H91-V111 HydrophobicContact CB-CG2 4.13Å
92	L	98.4	Very high	97.3	Very high	32 Å²	32	76.5 Å²	76.5	17%	0.168	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121	-23.8	-178.3	-61.6	161.2	0	0	0	112.1	V88 W96 P105 S107 Y108	V88-L92 HydrophobicContact CB-CD1 4.38Å; V88-L92 HydrophobicContact CG1-CB 4.37Å; V88-L92 HydrophobicContact CG1-CD1 4.07Å; V88-L92 HydrophobicContact CG2-CD1 4.17Å; V88-L92 WeakPolarHBondContact O-CA 3.24Å; V88-L92 VanDerWaalsContact O-CB 3.32Å; V88-L92 WeakPolarHBondContact O-CB 3.27Å; V88-L92 PolarHBondContact O-N 3.34Å; L92-W96 HydrophobicContact CB-CB 3.76Å; L92-W96 HydrophobicContact CB-CD2 4.15Å; L92-W96 HydrophobicContact CB-CG 3.77Å; L92-W96 HydrophobicContact CD1-CD2 3.87Å; L92-W96 HydrophobicContact CD1-CE3 3.98Å; L92-W96 HydrophobicContact CD1-CG 4.33Å; L92-W96 HydrophobicContact CD1-CH2 4.47Å; L92-W96 HydrophobicContact CD1-CZ2 4.37Å; L92-W96 HydrophobicContact CD1-CZ3 4.27Å; L92-W96 HydrophobicContact CD2-CG 4.35Å; L92-W96 HydrophobicContact CG-CD2 4.43Å; L92-W96 HydrophobicContact CG-CG 4.39Å; L92-P105 HydrophobicContact CD2-CB 4.06Å; L92-P105 HydrophobicContact CD2-CG 3.98Å; L92-S107 WeakPolarHBondContact CD2-OG 3.28Å; L92-Y108 HydrophobicContact CD1-CD2 4.3Å
93	G	98.4	Very high	97.1	Very high	26 Å²	26	80.2 Å²	80.2	27%	0.268	37%	0.366	S	S	.	.			trans	87.3	157	-174.2	0	0	0	0	0	112.8	V88 C89 D95 W96	V88-G93 PolarHBondContact O-N 3.09Å; C89-G93 WeakPolarHBondContact O-CA 3.16Å; C89-G93 PolarHBondContact O-N 3.25Å; G93-D95 VanDerWaalsContact C-N 3.25Å; G93-D95 PolarHBondContact O-N 3.46Å; G93-W96 WeakPolarHBondContact O-CB 3.09Å; G93-W96 PolarHBondContact O-N 3.13Å
94	R	98.4	Very high	97.1	Very high	38 Å²	38	76.5 Å²	76.5	14%	0.143	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-29	-179.4	176.9	60.6	-172.8	92.7	-3.3	113	I28 L29 R31 D45 W96 R97	I28-R94 PolarHBondContact O-NH2 3.12Å; L29-R94 PolarHBondContact O-NE 3.34Å; L29-R94 VanDerWaalsContact O-NE 3.1Å; R31-R94 VanDerWaalsContact CG-NH2 3.3Å; D45-R94 IonicContact OD1-CZ 2.66Å; D45-R94 IonicContact OD1-NH1 3.63Å; D45-R94 PolarHBondContact OD1-NH1 2.84Å; D45-R94 IonicContact OD1-NH2 3.57Å; D45-R94 IonicContact OD2-CZ 3.07Å; D45-R94 IonicContact OD2-NH1 3.37Å; D45-R94 PolarHBondContact OD2-NH1 3.23Å; D45-R94 IonicContact OD2-NH2 2.72Å; D45-R94 PolarHBondContact OD2-NH2 3.21Å; R94-W96 VanDerWaalsContact C-N 3.3Å; R94-R97 VanDerWaalsContact NH1-NH2 3.15Å; R94-R97 PolarHBondContact O-NH1 3.49Å
95	D	98.3	Very high	97	Very high	107 Å²	107	79.3 Å²	79.3	57%	0.572	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-16.3	178.8	-69.8	-67.9	0	0	0	113.7	R31 G93 R97	R31-D95 IonicContact CZ-OD1 3.85Å; R31-D95 IonicContact NH1-OD1 3.24Å; R31-D95 PolarHBondContact NH1-OD1 2.92Å; R31-D95 IonicContact NH2-OD1 3.11Å; R31-D95 PolarHBondContact NH2-OD1 3.35Å; R31-D95 IonicContact NH2-OD2 3.41Å; R31-D95 PolarHBondContact NH2-OD2 2.9Å; R31-D95 VanDerWaalsContact NH2-OD2 3.07Å; G93-D95 VanDerWaalsContact C-N 3.25Å; G93-D95 PolarHBondContact O-N 3.46Å; D95-R97 PolarHBondContact O-N 2.86Å; D95-R97 PolarHBondContact O-NH1 3.46Å
96	W	98.4	Very high	97	Very high	29 Å²	29	82.7 Å²	82.7	11%	0.11	39%	0.386	C	S	.	.			trans	-60.7	138.4	177.6	175	84.5	0	0	0	111.2	S48 R49 V88 L92 G93 R94 W98 Q104 Y108	S48-W96 WeakPolarHBondContact O-CZ3 2.96Å; R49-W96 PolarHBondContact NH2-O 3.26Å; V88-W96 HydrophobicContact CG1-CE3 3.85Å; V88-W96 HydrophobicContact CG1-CZ3 4.23Å; L92-W96 HydrophobicContact CB-CB 3.76Å; L92-W96 HydrophobicContact CB-CD2 4.15Å; L92-W96 HydrophobicContact CB-CG 3.77Å; L92-W96 HydrophobicContact CD1-CD2 3.87Å; L92-W96 HydrophobicContact CD1-CE3 3.98Å; L92-W96 HydrophobicContact CD1-CG 4.33Å; L92-W96 HydrophobicContact CD1-CH2 4.47Å; L92-W96 HydrophobicContact CD1-CZ2 4.37Å; L92-W96 HydrophobicContact CD1-CZ3 4.27Å; L92-W96 HydrophobicContact CD2-CG 4.35Å; L92-W96 HydrophobicContact CG-CD2 4.43Å; L92-W96 HydrophobicContact CG-CG 4.39Å; G93-W96 WeakPolarHBondContact O-CB 3.09Å; G93-W96 PolarHBondContact O-N 3.13Å; R94-W96 VanDerWaalsContact C-N 3.3Å; W96-W98 HydrophobicContact CH2-CB 3.68Å; W96-W98 HydrophobicContact CH2-CG 4.4Å; W96-W98 HydrophobicContact CZ2-CB 4Å; W96-W98 HydrophobicContact CZ3-CB 4.38Å; W96-Q104 VanDerWaalsContact CZ2-OE1 3.28Å; W96-Y108 AromaticContact CH2-CD2 3.32Å; W96-Y108 HydrophobicContact CH2-CD2 3.32Å; W96-Y108 AromaticContact CH2-CE2 3.51Å; W96-Y108 HydrophobicContact CH2-CE2 3.51Å; W96-Y108 HydrophobicContact CH2-CG 4.34Å; W96-Y108 AromaticContact CZ2-CD2 3.41Å; W96-Y108 HydrophobicContact CZ2-CD2 3.41Å; W96-Y108 VanDerWaalsContact CZ2-CD2 3.41Å; W96-Y108 AromaticContact CZ2-CE2 3.92Å; W96-Y108 HydrophobicContact CZ2-CE2 3.92Å; W96-Y108 AromaticContact CZ2-CG 4Å; W96-Y108 HydrophobicContact CZ2-CG 4Å; W96-Y108 HydrophobicContact CZ3-CD2 4.31Å
97	R	98.3	Very high	96.9	Very high	51 Å²	51	81.9 Å²	81.9	19%	0.192	38%	0.377	C	S	.	.			trans	-129	137	175.2	-65.3	-65.9	177.2	-80.2	3.5	109.5	Y33 D45 S48 R94 D95	Y33-R97 PolarHBondContact OH-NH2 3.4Å; Y33-R97 VanDerWaalsContact OH-NH2 3.11Å; D45-R97 VanDerWaalsContact CG-CZ 3.47Å; D45-R97 IonicContact OD1-CZ 3.58Å; D45-R97 IonicContact OD1-NE 3.92Å; D45-R97 PolarHBondContact OD1-NE 3.34Å; D45-R97 IonicContact OD1-NH1 3.07Å; D45-R97 IonicContact OD1-NH2 2.84Å; D45-R97 PolarHBondContact OD1-NH2 2.99Å; D45-R97 VanDerWaalsContact OD1-NH2 3.16Å; D45-R97 IonicContact OD2-CZ 2.64Å; D45-R97 IonicContact OD2-NH2 3.19Å; D45-R97 PolarHBondContact OD2-NH2 3.3Å; S48-R97 VanDerWaalsContact OG-CA 3.28Å; S48-R97 WeakPolarHBondContact OG-CA 3.05Å; S48-R97 WeakPolarHBondContact OG-CD 3.45Å; R94-R97 VanDerWaalsContact NH1-NH2 3.15Å; R94-R97 PolarHBondContact O-NH1 3.49Å; D95-R97 PolarHBondContact O-N 2.86Å; D95-R97 PolarHBondContact O-NH1 3.46Å
98	W	97.9	Very high	96.9	Very high	92 Å²	92	81.9 Å²	81.9	35%	0.348	38%	0.376	S	S	.	.			trans	-74.9	144.9	169	-175.5	82.1	0	0	0	109.3	S48 W96 Q100	S48-W98 PolarHBondContact OG-N 3.46Å; W96-W98 HydrophobicContact CH2-CB 3.68Å; W96-W98 HydrophobicContact CH2-CG 4.4Å; W96-W98 HydrophobicContact CZ2-CB 4Å; W96-W98 HydrophobicContact CZ3-CB 4.38Å; W98-Q100 HydrophobicContact CH2-CB 3.6Å; W98-Q100 HydrophobicContact CH2-CG 3.78Å; W98-Q100 HydrophobicContact CZ2-CB 4.28Å; W98-Q100 HydrophobicContact CZ2-CG 4.38Å; W98-Q100 HydrophobicContact CZ3-CB 3.92Å
99	T	94.8	Very high	96.9	Very high	56 Å²	56	86.3 Å²	86.3	34%	0.344	40%	0.395	S	S	.	.			trans	-140.9	127.3	172	-48.9	0	0	0	0	108.5	R101 K102 Q104	T99-R101 PolarHBondContact O-N 3.1Å; T99-K102 HydrophobicContact CG2-CD 3.9Å; T99-K102 HydrophobicContact CG2-CG 4Å; T99-K102 PolarHBondContact O-N 3.11Å; T99-Q104 PolarHBondContact O-NE2 3.29Å
100	Q	88.5	Confident	96.9	Very high	133 Å²	133	88.9 Å²	88.9	62%	0.621	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	140.2	174.8	-157.9	-177.8	4.6	0	0	109.6	W98 K102	W98-Q100 HydrophobicContact CH2-CB 3.6Å; W98-Q100 HydrophobicContact CH2-CG 3.78Å; W98-Q100 HydrophobicContact CZ2-CB 4.28Å; W98-Q100 HydrophobicContact CZ2-CG 4.38Å; W98-Q100 HydrophobicContact CZ3-CB 3.92Å; Q100-K102 PolarHBondContact O-N 3.14Å; Q100-K102 VanDerWaalsContact O-N 3.12Å
101	R	90.6	Very high	96.9	Very high	241 Å²	241	80.5 Å²	80.5	91%	0.909	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	3.8	179.3	-47	-180	177.2	172.3	-1.4	115.8	T99	T99-R101 PolarHBondContact O-N 3.1Å
102	K	94.8	Very high	96.8	Very high	145 Å²	145	78 Å²	78	63%	0.63	36%	0.364	S	S	*	.	S	Bend	trans	-97.4	139	165.6	-66.6	-168.7	178.9	174.3	0	110.1	T99 Q100 Q104	T99-K102 HydrophobicContact CG2-CD 3.9Å; T99-K102 HydrophobicContact CG2-CG 4Å; T99-K102 PolarHBondContact O-N 3.11Å; Q100-K102 PolarHBondContact O-N 3.14Å; Q100-K102 VanDerWaalsContact O-N 3.12Å; K102-Q104 PolarHBondContact O-N 2.8Å; K102-Q104 PolarHBondContact O-NE2 3.38Å
103	R	95.2	Very high	96.8	Very high	209 Å²	209	80.1 Å²	80.1	79%	0.789	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-63.1	125.2	171.6	-178	176	175.4	-159	-4.6	108.6	D106	R103-D106 IonicContact NH2-OD1 2.85Å; R103-D106 PolarHBondContact NH2-OD1 3.26Å; R103-D106 VanDerWaalsContact NH2-OD1 3.11Å; R103-D106 IonicContact NH2-OD2 3.42Å
104	Q	97.6	Very high	96.8	Very high	13 Å²	13	79.3 Å²	79.3	6%	0.061	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-86.4	155.4	175.1	-59.1	-54.7	-42.3	0	0	110.5	W96 T99 K102 Y108 F109	W96-Q104 VanDerWaalsContact CZ2-OE1 3.28Å; T99-Q104 PolarHBondContact O-NE2 3.29Å; K102-Q104 PolarHBondContact O-N 2.8Å; K102-Q104 PolarHBondContact O-NE2 3.38Å; Q104-Y108 HydrophobicContact CB-CD1 3.52Å; Q104-Y108 HydrophobicContact CB-CE1 4.21Å; Q104-Y108 HydrophobicContact CB-CG 3.92Å; Q104-Y108 HydrophobicContact CG-CD1 3.95Å; Q104-Y108 HydrophobicContact CG-CE1 4.16Å; Q104-Y108 HydrophobicContact CG-CG 4.39Å; Q104-F109 HydrophobicContact CB-CE2 3.99Å; Q104-F109 HydrophobicContact CB-CZ 4.29Å
105	P	97.3	Very high	96.8	Very high	58 Å²	58	77.6 Å²	77.6	38%	0.377	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-58.3	150.3	174	-22.7	33.9	0	0	0	111.7	L92 S107 Y108	L92-P105 HydrophobicContact CD2-CB 4.06Å; L92-P105 HydrophobicContact CD2-CG 3.98Å; P105-S107 PolarHBondContact O-N 3.18Å; P105-S107 VanDerWaalsContact O-N 3.16Å; P105-Y108 VanDerWaalsContact O-CB 3.3Å; P105-Y108 WeakPolarHBondContact O-CB 3.32Å; P105-Y108 PolarHBondContact O-N 3.27Å
106	D	97.9	Very high	96.8	Very high	96 Å²	96	75.5 Å²	75.5	51%	0.513	35%	0.348	S	S	.	.	H	α-helix	trans	-61.4	-29	178.6	-60.2	-19.6	0	0	0	111.5	R103 Y108 F109 N110	R103-D106 IonicContact NH2-OD1 2.85Å; R103-D106 PolarHBondContact NH2-OD1 3.26Å; R103-D106 VanDerWaalsContact NH2-OD1 3.11Å; R103-D106 IonicContact NH2-OD2 3.42Å; D106-Y108 VanDerWaalsContact C-N 3.27Å; D106-Y108 PolarHBondContact O-N 3.19Å; D106-F109 PolarHBondContact O-N 2.8Å; D106-N110 PolarHBondContact O-N 2.65Å
107	S	97.8	Very high	96.7	Very high	36 Å²	36	75.6 Å²	75.6	25%	0.252	35%	0.351	S	S	.	.	H	α-helix	trans	-61.8	-30	173	55.5	0	0	0	0	113.6	L92 P105 N110 V111	L92-S107 WeakPolarHBondContact CD2-OG 3.28Å; P105-S107 PolarHBondContact O-N 3.18Å; P105-S107 VanDerWaalsContact O-N 3.16Å; S107-N110 PolarHBondContact O-N 3.46Å; S107-V111 WeakPolarHBondContact O-CG2 3.23Å; S107-V111 PolarHBondContact O-N 3.12Å
108	Y	98.4	Very high	96.5	Very high	28 Å²	28	79.4 Å²	79.4	11%	0.11	37%	0.365	C	S	.	.	H	α-helix	trans	-65	-46.6	173.3	162.1	-95.4	0	0	0	110.9	L50 L92 W96 Q104 P105 D106 N110 V111 L112	L50-Y108 HydrophobicContact CD2-CE2 3.82Å; L92-Y108 HydrophobicContact CD1-CD2 4.3Å; W96-Y108 AromaticContact CH2-CD2 3.32Å; W96-Y108 HydrophobicContact CH2-CD2 3.32Å; W96-Y108 AromaticContact CH2-CE2 3.51Å; W96-Y108 HydrophobicContact CH2-CE2 3.51Å; W96-Y108 HydrophobicContact CH2-CG 4.34Å; W96-Y108 AromaticContact CZ2-CD2 3.41Å; W96-Y108 HydrophobicContact CZ2-CD2 3.41Å; W96-Y108 VanDerWaalsContact CZ2-CD2 3.41Å; W96-Y108 AromaticContact CZ2-CE2 3.92Å; W96-Y108 HydrophobicContact CZ2-CE2 3.92Å; W96-Y108 AromaticContact CZ2-CG 4Å; W96-Y108 HydrophobicContact CZ2-CG 4Å; W96-Y108 HydrophobicContact CZ3-CD2 4.31Å; Q104-Y108 HydrophobicContact CB-CD1 3.52Å; Q104-Y108 HydrophobicContact CB-CE1 4.21Å; Q104-Y108 HydrophobicContact CB-CG 3.92Å; Q104-Y108 HydrophobicContact CG-CD1 3.95Å; Q104-Y108 HydrophobicContact CG-CE1 4.16Å; Q104-Y108 HydrophobicContact CG-CG 4.39Å; P105-Y108 VanDerWaalsContact O-CB 3.3Å; P105-Y108 WeakPolarHBondContact O-CB 3.32Å; P105-Y108 PolarHBondContact O-N 3.27Å; D106-Y108 VanDerWaalsContact C-N 3.27Å; D106-Y108 PolarHBondContact O-N 3.19Å; Y108-N110 VanDerWaalsContact C-N 3.3Å; Y108-N110 PolarHBondContact O-N 3.23Å; Y108-V111 PolarHBondContact O-N 2.74Å; Y108-L112 HydrophobicContact CE1-CD2 4.28Å; Y108-L112 WeakPolarHBondContact O-CB 3.49Å; Y108-L112 PolarHBondContact O-N 3.28Å
109	F	98.1	Very high	96.3	Very high	92 Å²	92	80 Å²	80	40%	0.404	37%	0.37	S	S	.	.	H	α-helix	trans	-64.9	-36.4	177.4	-65.3	-75.2	0	0	0	111.4	Q104 D106 L112 N113	Q104-F109 HydrophobicContact CB-CE2 3.99Å; Q104-F109 HydrophobicContact CB-CZ 4.29Å; D106-F109 PolarHBondContact O-N 2.8Å; F109-L112 PolarHBondContact O-N 2.79Å; F109-N113 WeakPolarHBondContact O-CB 3.48Å; F109-N113 PolarHBondContact O-N 2.75Å; F109-N113 PolarHBondContact O-ND2 2.86Å; F109-N113 VanDerWaalsContact O-ND2 3.14Å
110	N	98	Very high	96.3	Very high	108 Å²	108	82.4 Å²	82.4	58%	0.578	38%	0.381	S	S	*	.	H	α-helix	trans	-62.7	-43.2	174.6	-68.4	-19.6	0	0	0	112.3	D106 S107 Y108 A114	D106-N110 PolarHBondContact O-N 2.65Å; S107-N110 PolarHBondContact O-N 3.46Å; Y108-N110 VanDerWaalsContact C-N 3.3Å; Y108-N110 PolarHBondContact O-N 3.23Å; N110-A114 PolarHBondContact O-N 3.46Å
111	V	98.5	Very high	96.7	Very high	6 Å²	6	76.5 Å²	76.5	4%	0.036	36%	0.355	C	S	.	.	H	α-helix	trans	-62.7	-51.5	174.3	174.6	0	0	0	0	109.9	L50 L87 V88 H91 S107 Y108 N113 A114 F115	L50-V111 HydrophobicContact CD1-CG1 3.68Å; L87-V111 HydrophobicContact CB-CG1 3.84Å; L87-V111 HydrophobicContact CB-CG2 4.11Å; V88-V111 HydrophobicContact CG2-CG1 4.27Å; H91-V111 HydrophobicContact CB-CG2 4.13Å; S107-V111 WeakPolarHBondContact O-CG2 3.23Å; S107-V111 PolarHBondContact O-N 3.12Å; Y108-V111 PolarHBondContact O-N 2.74Å; V111-N113 VanDerWaalsContact C-N 3.33Å; V111-N113 PolarHBondContact O-N 3.04Å; V111-A114 VanDerWaalsContact O-CB 3.31Å; V111-A114 WeakPolarHBondContact O-CB 3.5Å; V111-A114 PolarHBondContact O-N 3.24Å; V111-A114 VanDerWaalsContact O-N 3.09Å; V111-F115 HydrophobicContact CG1-CE2 4.11Å; V111-F115 WeakPolarHBondContact O-CD2 3.3Å
112	L	98.2	Very high	97	Very high	42 Å²	42	73.6 Å²	73.6	22%	0.22	35%	0.345	C	S	.	.	H	α-helix	trans	-58.5	-43.5	-179.8	179.4	61.7	0	0	0	112.3	L50 F52 Y108 F109 A114 F115 L116	L50-L112 HydrophobicContact CD2-CD1 4.05Å; F52-L112 HydrophobicContact CE1-CD1 4.3Å; Y108-L112 HydrophobicContact CE1-CD2 4.28Å; Y108-L112 WeakPolarHBondContact O-CB 3.49Å; Y108-L112 PolarHBondContact O-N 3.28Å; F109-L112 PolarHBondContact O-N 2.79Å; L112-A114 PolarHBondContact O-N 3.12Å; L112-F115 PolarHBondContact O-N 3.35Å; L112-L116 PolarHBondContact O-N 2.82Å
113	N	98.3	Very high	97.1	Very high	77 Å²	77	70.6 Å²	70.6	41%	0.412	33%	0.33	S	S	.	.	H	α-helix	trans	-59.4	-29	178.7	-77.2	-22.4	0	0	0	112.4	F109 V111 F115 S121	F109-N113 WeakPolarHBondContact O-CB 3.48Å; F109-N113 PolarHBondContact O-N 2.75Å; F109-N113 PolarHBondContact O-ND2 2.86Å; F109-N113 VanDerWaalsContact O-ND2 3.14Å; V111-N113 VanDerWaalsContact C-N 3.33Å; V111-N113 PolarHBondContact O-N 3.04Å; N113-F115 PolarHBondContact O-N 3.15Å; N113-S121 VanDerWaalsContact O-CB 3.27Å; N113-S121 WeakPolarHBondContact O-CB 3.3Å; N113-S121 PolarHBondContact O-OG 3.32Å
114	A	98.3	Very high	97.2	Very high	8 Å²	8	60.7 Å²	60.7	7%	0.066	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-18.4	176.9	0	0	0	0	0	113.2	N110 V111 L112 S121 Y122 Y123	N110-A114 PolarHBondContact O-N 3.46Å; V111-A114 VanDerWaalsContact O-CB 3.31Å; V111-A114 WeakPolarHBondContact O-CB 3.5Å; V111-A114 PolarHBondContact O-N 3.24Å; V111-A114 VanDerWaalsContact O-N 3.09Å; L112-A114 PolarHBondContact O-N 3.12Å; A114-S121 CarbonylContact O-C 3.58Å; A114-Y122 HydrophobicContact CB-CD2 4.26Å; A114-Y122 PolarHBondContact O-N 3.1Å; A114-Y123 HydrophobicContact CB-CD2 3.66Å; A114-Y123 HydrophobicContact CB-CE2 3.96Å; A114-Y123 CarbonylContact O-C 3.6Å; A114-Y123 WeakPolarHBondContact O-CA 3.29Å; A114-Y123 PolarHBondContact O-N 3.29Å
115	F	98.4	Very high	97.1	Very high	3 Å²	3	60 Å²	60	1%	0.013	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-2.4	-176.3	-62.8	-86.9	0	0	0	114.9	F52 Q80 F83 A84 L87 V111 L112 N113 Y123	F52-F115 HydrophobicContact CD1-CB 4.37Å; F52-F115 HydrophobicContact CE1-CB 3.56Å; F52-F115 HydrophobicContact CE1-CG 4.18Å; F52-F115 HydrophobicContact CE2-CB 4.17Å; F52-F115 HydrophobicContact CE2-CD1 4.04Å; F52-F115 HydrophobicContact CE2-CD2 4.39Å; F52-F115 AromaticContact CE2-CG 3.94Å; F52-F115 HydrophobicContact CE2-CG 3.94Å; F52-F115 HydrophobicContact CZ-CB 3.43Å; F52-F115 VanDerWaalsContact CZ-CB 3.43Å; F52-F115 HydrophobicContact CZ-CD1 4.09Å; F52-F115 AromaticContact CZ-CD2 3.84Å; F52-F115 HydrophobicContact CZ-CD2 3.84Å; F52-F115 AromaticContact CZ-CG 3.52Å; F52-F115 HydrophobicContact CZ-CG 3.52Å; Q80-F115 HydrophobicContact CB-CD1 3.84Å; Q80-F115 HydrophobicContact CB-CE1 4.2Å; Q80-F115 HydrophobicContact CG-CD1 3.96Å; Q80-F115 HydrophobicContact CG-CE1 4.48Å; Q80-F115 WeakPolarHBondContact O-CE1 3.48Å; F83-F115 HydrophobicContact CD1-CE1 4.21Å; F83-F115 AromaticContact CD1-CZ 3.97Å; F83-F115 HydrophobicContact CD1-CZ 3.97Å; A84-F115 VanDerWaalsContact CA-CZ 3.41Å; A84-F115 HydrophobicContact CB-CD1 4.5Å; A84-F115 HydrophobicContact CB-CD2 4.03Å; A84-F115 HydrophobicContact CB-CE1 4Å; A84-F115 HydrophobicContact CB-CE2 3.49Å; A84-F115 VanDerWaalsContact CB-CE2 3.49Å; A84-F115 HydrophobicContact CB-CZ 3.48Å; A84-F115 VanDerWaalsContact CB-CZ 3.48Å; L87-F115 HydrophobicContact CD1-CE2 3.8Å; L87-F115 HydrophobicContact CD1-CZ 3.81Å; V111-F115 HydrophobicContact CG1-CE2 4.11Å; V111-F115 WeakPolarHBondContact O-CD2 3.3Å; L112-F115 PolarHBondContact O-N 3.35Å; N113-F115 PolarHBondContact O-N 3.15Å; F115-Y123 AromaticContact CE1-CD2 3.97Å; F115-Y123 HydrophobicContact CE1-CD2 3.97Å; F115-Y123 HydrophobicContact CE1-CG 4.03Å; F115-Y123 HydrophobicContact CE2-CD2 4.14Å; F115-Y123 AromaticContact CZ-CD2 3.73Å; F115-Y123 HydrophobicContact CZ-CD2 3.73Å; F115-Y123 HydrophobicContact CZ-CG 4.24Å
116	L	97.6	Very high	96.9	Very high	62 Å²	62	57.5 Å²	57.5	33%	0.325	27%	0.273	S	S	.	.	S	Bend	trans	-57.8	147.7	177.6	-63.4	177.6	0	0	0	110.8	L112 R118 S121 S124	L112-L116 PolarHBondContact O-N 2.82Å; L116-R118 HydrophobicContact CB-CG 4.39Å; L116-R118 PolarHBondContact O-N 2.81Å; L116-S121 VanDerWaalsContact O-CB 3.24Å; L116-S121 WeakPolarHBondContact O-CB 3.34Å; L116-S124 WeakPolarHBondContact O-CB 3.41Å
117	D	96.9	Very high	96.7	Very high	31 Å²	31	57.2 Å²	57.2	17%	0.166	27%	0.268	C	S	.	.	S	Bend	trans	-76.2	61.9	179.8	-51.7	-69.8	0	0	0	111.7	R55 F58 R77 I125 H126	R55-D117 VanDerWaalsContact CG-OD2 3.27Å; R55-D117 WeakPolarHBondContact CG-OD2 3.43Å; F58-D117 HydrophobicContact CB-CB 3.85Å; F58-D117 HydrophobicContact CD1-CB 4.24Å; F58-D117 HydrophobicContact CG-CB 4.26Å; R77-D117 IonicContact CZ-OD1 3.33Å; R77-D117 VanDerWaalsContact CZ-OD1 3.24Å; R77-D117 IonicContact NH1-OD1 2.72Å; R77-D117 PolarHBondContact NH1-OD1 2.75Å; R77-D117 IonicContact NH2-OD1 3.71Å; R77-D117 PolarHBondContact NH2-OD1 3.07Å; R77-D117 IonicContact NH2-OD2 3.89Å; D117-I125 HydrophobicContact CB-CG2 4.12Å; D117-I125 VanDerWaalsContact OD1-CG2 3.32Å; D117-I125 WeakPolarHBondContact OD1-CG2 3.45Å; D117-H126 PolarHBondContact O-CE1 2.95Å
118	R	93.8	Very high	96.3	Very high	132 Å²	132	57.8 Å²	57.8	50%	0.498	27%	0.268	S	S	.	.	S	Bend	trans	-131.8	152	177.3	-58.7	170	51.6	150	0.2	109.8	L116 D120 S121 S124	L116-R118 HydrophobicContact CB-CG 4.39Å; L116-R118 PolarHBondContact O-N 2.81Å; R118-D120 WeakPolarHBondContact CB-OD1 3.45Å; R118-D120 IonicContact CZ-OD1 3.69Å; R118-D120 IonicContact CZ-OD2 3.5Å; R118-D120 IonicContact NE-OD1 2.95Å; R118-D120 PolarHBondContact NE-OD1 3.13Å; R118-D120 IonicContact NE-OD2 3.56Å; R118-D120 IonicContact NH2-OD1 3.62Å; R118-D120 IonicContact NH2-OD2 2.75Å; R118-D120 PolarHBondContact NH2-OD2 2.76Å; R118-D120 PolarHBondContact O-N 2.85Å; R118-S121 PolarHBondContact O-N 3.49Å; R118-S124 WeakPolarHBondContact O-CB 3.29Å; R118-S124 PolarHBondContact O-OG 3.33Å
119	K	92.8	Very high	95.6	Very high	104 Å²	104	56.4 Å²	56.4	45%	0.452	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-24.9	-178.5	-62.1	-177.5	-179.2	-177.2	0	113	A60 H126 Q127	A60-K119 VanDerWaalsContact O-CE 3.29Å; A60-K119 WeakPolarHBondContact O-CE 3.29Å; A60-K119 PolarHBondContact O-NZ 2.72Å; K119-H126 HydrophobicContact CG-CB 4.26Å; K119-Q127 PolarHBondContact O-NE2 3.37Å
120	D	94.8	Very high	94.8	Very high	106 Å²	106	55.6 Å²	55.6	57%	0.567	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-7.4	-179.4	56.4	-18.4	0	0	0	114.1	R118	R118-D120 WeakPolarHBondContact CB-OD1 3.45Å; R118-D120 IonicContact CZ-OD1 3.69Å; R118-D120 IonicContact CZ-OD2 3.5Å; R118-D120 IonicContact NE-OD1 2.95Å; R118-D120 PolarHBondContact NE-OD1 3.13Å; R118-D120 IonicContact NE-OD2 3.56Å; R118-D120 IonicContact NH2-OD1 3.62Å; R118-D120 IonicContact NH2-OD2 2.75Å; R118-D120 PolarHBondContact NH2-OD2 2.76Å; R118-D120 PolarHBondContact O-N 2.85Å
121	S	97.2	Very high	94	Very high	10 Å²	10	56 Å²	56	7%	0.07	26%	0.264	C	S	.	.	S	Bend	trans	-86.1	127.3	175.9	-71.5	0	0	0	0	111	N113 A114 L116 R118 Y123 S124 Q127	N113-S121 VanDerWaalsContact O-CB 3.27Å; N113-S121 WeakPolarHBondContact O-CB 3.3Å; N113-S121 PolarHBondContact O-OG 3.32Å; A114-S121 CarbonylContact O-C 3.58Å; L116-S121 VanDerWaalsContact O-CB 3.24Å; L116-S121 WeakPolarHBondContact O-CB 3.34Å; R118-S121 PolarHBondContact O-N 3.49Å; S121-Y123 VanDerWaalsContact C-N 3.32Å; S121-Y123 PolarHBondContact O-N 3.11Å; S121-S124 WeakPolarHBondContact O-CB 3Å; S121-S124 PolarHBondContact O-N 2.81Å; S121-S124 PolarHBondContact O-OG 3.27Å; S121-Q127 WeakPolarHBondContact O-CG 3.17Å
122	Y	97.1	Very high	92.7	Very high	179 Å²	179	57.4 Å²	57.4	70%	0.702	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-41.1	-170.4	-65.8	-67.1	0	0	0	115.2	A114	A114-Y122 HydrophobicContact CB-CD2 4.26Å; A114-Y122 PolarHBondContact O-N 3.1Å
123	Y	97.4	Very high	91.3	Very high	83 Å²	83	58.3 Å²	58.3	33%	0.325	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.3	28.2	-173.8	-46.1	-61.5	0	0	0	111	Q80 F83 L87 A114 F115 S121 I128	Q80-Y123 PolarHBondContact NE2-O 3.31Å; F83-Y123 HydrophobicContact CD1-CD1 4.21Å; F83-Y123 HydrophobicContact CD1-CD2 4.24Å; F83-Y123 HydrophobicContact CD1-CE1 4.31Å; F83-Y123 HydrophobicContact CD1-CE2 4.36Å; F83-Y123 HydrophobicContact CD1-CG 4.18Å; F83-Y123 AromaticContact CE1-CD1 3.87Å; F83-Y123 HydrophobicContact CE1-CD1 3.87Å; F83-Y123 HydrophobicContact CE1-CD2 4.07Å; F83-Y123 AromaticContact CE1-CE1 3.52Å; F83-Y123 HydrophobicContact CE1-CE1 3.52Å; F83-Y123 AromaticContact CE1-CE2 3.76Å; F83-Y123 HydrophobicContact CE1-CE2 3.76Å; F83-Y123 HydrophobicContact CE1-CG 4.13Å; F83-Y123 AromaticContact CE1-CZ 3.48Å; F83-Y123 VanDerWaalsContact CE1-CZ 3.48Å; F83-Y123 HydrophobicContact CZ-CE1 4.29Å; L87-Y123 HydrophobicContact CD1-CD2 4.14Å; L87-Y123 HydrophobicContact CD1-CE2 3.68Å; A114-Y123 HydrophobicContact CB-CD2 3.66Å; A114-Y123 HydrophobicContact CB-CE2 3.96Å; A114-Y123 CarbonylContact O-C 3.6Å; A114-Y123 WeakPolarHBondContact O-CA 3.29Å; A114-Y123 PolarHBondContact O-N 3.29Å; F115-Y123 AromaticContact CE1-CD2 3.97Å; F115-Y123 HydrophobicContact CE1-CD2 3.97Å; F115-Y123 HydrophobicContact CE1-CG 4.03Å; F115-Y123 HydrophobicContact CE2-CD2 4.14Å; F115-Y123 AromaticContact CZ-CD2 3.73Å; F115-Y123 HydrophobicContact CZ-CD2 3.73Å; F115-Y123 HydrophobicContact CZ-CG 4.24Å; S121-Y123 VanDerWaalsContact C-N 3.32Å; S121-Y123 PolarHBondContact O-N 3.11Å; Y123-I128 WeakPolarHBondContact O-CD1 3.31Å
124	S	97	Very high	89.9	Confident	0 Å²	0	59 Å²	59	0%	0	28%	0.283	C	S	.	.	S	Bend	trans	-67.2	162	176.5	69.1	0	0	0	0	112.1	L116 R118 S121 H126 Q127 I128	L116-S124 WeakPolarHBondContact O-CB 3.41Å; R118-S124 WeakPolarHBondContact O-CB 3.29Å; R118-S124 PolarHBondContact O-OG 3.33Å; S121-S124 WeakPolarHBondContact O-CB 3Å; S121-S124 PolarHBondContact O-N 2.81Å; S121-S124 PolarHBondContact O-OG 3.27Å; S124-H126 PolarHBondContact O-N 3.16Å; S124-H126 VanDerWaalsContact O-N 3.15Å; S124-H126 WeakPolarHBondContact OG-CB 3.17Å; S124-H126 PolarHBondContact OG-N 3.19Å; S124-Q127 PolarHBondContact O-N 3.44Å; S124-Q127 VanDerWaalsContact O-N 3.12Å; S124-Q127 PolarHBondContact OG-N 2.7Å; S124-I128 WeakPolarHBondContact O-CG1 3.37Å; S124-I128 PolarHBondContact O-N 3.1Å
125	I	95	Very high	88.2	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-58.6	-25.6	171.6	-162.5	65	0	0	0	111.7	F58 I61 D69 W72 L76 D117 G129	F58-I125 HydrophobicContact CD1-CG2 4.44Å; F58-I125 HydrophobicContact CE1-CG2 4.19Å; F58-I125 HydrophobicContact CE2-CG2 4.39Å; F58-I125 HydrophobicContact CZ-CG2 4.15Å; I61-I125 HydrophobicContact CD1-CG1 4.47Å; D69-I125 HydrophobicContact CB-CD1 4.31Å; D69-I125 HydrophobicContact CB-CG1 4.04Å; W72-I125 HydrophobicContact CH2-CG1 4.26Å; L76-I125 HydrophobicContact CB-CD1 3.78Å; L76-I125 HydrophobicContact CD1-CD1 3.66Å; L76-I125 HydrophobicContact CG-CD1 4.37Å; D117-I125 HydrophobicContact CB-CG2 4.12Å; D117-I125 VanDerWaalsContact OD1-CG2 3.32Å; D117-I125 WeakPolarHBondContact OD1-CG2 3.45Å; I125-G129 VanDerWaalsContact O-CA 3.28Å; I125-G129 WeakPolarHBondContact O-CA 3.27Å; I125-G129 PolarHBondContact O-N 3.37Å
126	H	93.5	Very high	86.5	Confident	5 Å²	5	68.1 Å²	68.1	2%	0.023	33%	0.33	C	S	.	.	H	α-helix	trans	-67.7	-48.6	174.4	-56.6	74.8	0	0	0	111.9	F58 P59 D117 K119 S124 N130	F58-H126 AromaticContact CD2-CE1 3.87Å; F58-H126 AromaticContact CD2-NE2 3.69Å; P59-H126 PolarHBondContact O-CD2 2.75Å; P59-H126 PolarHBondContact O-NE2 3.4Å; D117-H126 PolarHBondContact O-CE1 2.95Å; K119-H126 HydrophobicContact CG-CB 4.26Å; S124-H126 PolarHBondContact O-N 3.16Å; S124-H126 VanDerWaalsContact O-N 3.15Å; S124-H126 WeakPolarHBondContact OG-CB 3.17Å; S124-H126 PolarHBondContact OG-N 3.19Å; H126-N130 WeakPolarHBondContact O-CB 3.06Å; H126-N130 PolarHBondContact O-N 2.81Å
127	Q	93.1	Very high	84.6	Confident	89 Å²	89	68 Å²	68	42%	0.416	34%	0.343	S	S	.	.	H	α-helix	trans	-66.7	-47.5	-178.7	-68.3	-59.9	-26.3	0	0	110.9	K119 S121 S124 L131	K119-Q127 PolarHBondContact O-NE2 3.37Å; S121-Q127 WeakPolarHBondContact O-CG 3.17Å; S124-Q127 PolarHBondContact O-N 3.44Å; S124-Q127 VanDerWaalsContact O-N 3.12Å; S124-Q127 PolarHBondContact OG-N 2.7Å; Q127-L131 PolarHBondContact O-N 3.01Å
128	I	90.1	Very high	82.5	Confident	48 Å²	48	70.1 Å²	70.1	25%	0.246	36%	0.357	C	S	.	.	H	α-helix	trans	-66.5	-46.7	179.6	-57.6	167.3	0	0	0	110.4	L76 Q80 Y123 S124 L131 L132	L76-I128 HydrophobicContact CD1-CG2 4.3Å; L76-I128 HydrophobicContact CD2-CG2 3.85Å; L76-I128 HydrophobicContact CG-CG2 4.45Å; Q80-I128 HydrophobicContact CG-CD1 3.77Å; Y123-I128 WeakPolarHBondContact O-CD1 3.31Å; S124-I128 WeakPolarHBondContact O-CG1 3.37Å; S124-I128 PolarHBondContact O-N 3.1Å; I128-L131 PolarHBondContact O-N 3.03Å; I128-L132 HydrophobicContact CG2-CD1 4.13Å; I128-L132 WeakPolarHBondContact O-CG 3.45Å; I128-L132 PolarHBondContact O-N 3.16Å
129	G	82.9	Confident	80.5	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-62	-48.6	178.7	0	0	0	0	0	112	I125 L131 L132 Y133	I125-G129 VanDerWaalsContact O-CA 3.28Å; I125-G129 WeakPolarHBondContact O-CA 3.27Å; I125-G129 PolarHBondContact O-N 3.37Å; G129-L131 VanDerWaalsContact C-N 3.3Å; G129-L131 PolarHBondContact O-N 3.26Å; G129-L132 PolarHBondContact O-N 3.14Å; G129-L132 VanDerWaalsContact O-N 3.12Å; G129-Y133 WeakPolarHBondContact O-CB 3.28Å; G129-Y133 VanDerWaalsContact O-CD2 3.23Å; G129-Y133 WeakPolarHBondContact O-CD2 3.29Å; G129-Y133 PolarHBondContact O-N 3.22Å
130	N	82.8	Confident	78.7	Confident	75 Å²	75	65.8 Å²	65.8	40%	0.401	34%	0.34	S	S	.	.	H	α-helix	trans	-62.5	-37.2	-177.4	-169.1	58.7	0	0	0	112.6	I61 H126 S134	I61-N130 HydrophobicContact CG2-CB 4.47Å; H126-N130 WeakPolarHBondContact O-CB 3.06Å; H126-N130 PolarHBondContact O-N 2.81Å; N130-S134 WeakPolarHBondContact O-CB 3.26Å; N130-S134 PolarHBondContact O-N 3.11Å; N130-S134 PolarHBondContact O-OG 3.34Å
131	L	79.6	Confident	76.4	Confident	117 Å²	117	67 Å²	67	61%	0.613	35%	0.346	S	S	*	.	H	α-helix	trans	-59	-50.6	172.8	-177.2	68.3	0	0	0	110.8	Q127 I128 G129 S134 T135	Q127-L131 PolarHBondContact O-N 3.01Å; I128-L131 PolarHBondContact O-N 3.03Å; G129-L131 VanDerWaalsContact C-N 3.3Å; G129-L131 PolarHBondContact O-N 3.26Å; L131-S134 PolarHBondContact O-N 3.28Å; L131-T135 WeakPolarHBondContact O-CG2 3.43Å; L131-T135 PolarHBondContact O-N 3.38Å; L131-T135 VanDerWaalsContact O-N 3.13Å; L131-T135 PolarHBondContact O-OG1 3.23Å; L131-T135 VanDerWaalsContact O-OG1 3.09Å
132	L	72.2	Confident	73.9	Confident	35 Å²	35	72.9 Å²	72.9	18%	0.183	37%	0.37	C	S	.	.	H	α-helix	trans	-67.4	-39.1	-178.4	-67	170.8	0	0	0	113.3	L76 I128 G129 S134 T135 H136	L76-L132 HydrophobicContact CD1-CD1 4.13Å; L76-L132 HydrophobicContact CD2-CD1 3.54Å; L76-L132 HydrophobicContact CG-CD1 4.49Å; I128-L132 HydrophobicContact CG2-CD1 4.13Å; I128-L132 WeakPolarHBondContact O-CG 3.45Å; I128-L132 PolarHBondContact O-N 3.16Å; G129-L132 PolarHBondContact O-N 3.14Å; G129-L132 VanDerWaalsContact O-N 3.12Å; L132-S134 VanDerWaalsContact C-N 3.34Å; L132-T135 PolarHBondContact O-N 3.08Å; L132-T135 PolarHBondContact O-OG1 3.3Å; L132-H136 PolarHBondContact O-N 2.89Å
133	Y	68.8	Low	71.5	Confident	61 Å²	61	71.9 Å²	71.9	24%	0.239	38%	0.383	C	S	.	.	H	α-helix	trans	-61.3	-44	174.4	-92.4	-78.2	0	0	0	111.3	I61 P66 G129 T135 G137 P139	I61-Y133 HydrophobicContact CG2-CD2 4.41Å; P66-Y133 WeakPolarHBondContact CD-OH 3.25Å; P66-Y133 WeakPolarHBondContact CG-OH 3.36Å; G129-Y133 WeakPolarHBondContact O-CB 3.28Å; G129-Y133 VanDerWaalsContact O-CD2 3.23Å; G129-Y133 WeakPolarHBondContact O-CD2 3.29Å; G129-Y133 PolarHBondContact O-N 3.22Å; Y133-T135 VanDerWaalsContact C-N 3.34Å; Y133-T135 PolarHBondContact O-N 3.04Å; Y133-G137 WeakPolarHBondContact O-CA 3.22Å; Y133-G137 PolarHBondContact O-N 2.97Å; Y133-G137 VanDerWaalsContact O-N 3.07Å; Y133-P139 HydrophobicContact CD2-CB 4.44Å; Y133-P139 HydrophobicContact CE1-CG 3.86Å; Y133-P139 HydrophobicContact CE2-CB 3.99Å; Y133-P139 HydrophobicContact CE2-CG 3.74Å; Y133-P139 VanDerWaalsContact CZ-CD 3.46Å; Y133-P139 VanDerWaalsContact OH-CG 3.3Å; Y133-P139 WeakPolarHBondContact OH-CG 3.43Å
134	S	68.1	Low	70.2	Confident	91 Å²	91	71.3 Å²	71.3	64%	0.636	39%	0.386	S	S	*	.	H	α-helix	trans	-70	-30.6	-177.7	-57.4	0	0	0	0	112.6	N130 L131 L132	N130-S134 WeakPolarHBondContact O-CB 3.26Å; N130-S134 PolarHBondContact O-N 3.11Å; N130-S134 PolarHBondContact O-OG 3.34Å; L131-S134 PolarHBondContact O-N 3.28Å; L132-S134 VanDerWaalsContact C-N 3.34Å
135	T	63	Low	68.7	Low	83 Å²	83	75.1 Å²	75.1	51%	0.509	41%	0.406	S	S	.	.	H	α-helix	trans	-91.2	-31.8	-177.9	55.2	0	0	0	0	114.1	L131 L132 Y133	L131-T135 WeakPolarHBondContact O-CG2 3.43Å; L131-T135 PolarHBondContact O-N 3.38Å; L131-T135 VanDerWaalsContact O-N 3.13Å; L131-T135 PolarHBondContact O-OG1 3.23Å; L131-T135 VanDerWaalsContact O-OG1 3.09Å; L132-T135 PolarHBondContact O-N 3.08Å; L132-T135 PolarHBondContact O-OG1 3.3Å; Y133-T135 VanDerWaalsContact C-N 3.34Å; Y133-T135 PolarHBondContact O-N 3.04Å
136	H	63.3	Low	67.3	Low	120 Å²	120	79.2 Å²	79.2	56%	0.556	43%	0.428	S	S	*	.	H	α-helix	trans	-122.7	-2.2	-170.7	-61.6	-61.1	0	0	0	115.1	L132 V138	L132-H136 PolarHBondContact O-N 2.89Å; H136-V138 PolarHBondContact O-N 3.36Å
137	G	57	Low	65.7	Low	59 Å²	59	83.6 Å²	83.6	61%	0.608	45%	0.452	S	S	*	.	S	Bend	trans	69	-11.3	174.8	0	0	0	0	0	115.8	Y133	Y133-G137 WeakPolarHBondContact O-CA 3.22Å; Y133-G137 PolarHBondContact O-N 2.97Å; Y133-G137 VanDerWaalsContact O-N 3.07Å
138	V	52.8	Low	64	Low	75 Å²	75	83.3 Å²	83.3	46%	0.455	46%	0.455	S	S	.	.			trans	-155.6	131.1	172.7	-110.9	0	0	0	0	110.1	H136 W140	H136-V138 PolarHBondContact O-N 3.36Å; V138-W140 PolarHBondContact O-N 2.76Å
139	P	52.9	Low	62.3	Low	13 Å²	13	85.6 Å²	85.6	8%	0.084	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-2.5	179.7	36.4	-42.1	0	0	0	113.6	W72 Y133 L141	W72-P139 HydrophobicContact CE3-CB 4.06Å; W72-P139 HydrophobicContact CE3-CG 4.38Å; W72-P139 HydrophobicContact CZ3-CB 4.26Å; Y133-P139 HydrophobicContact CD2-CB 4.44Å; Y133-P139 HydrophobicContact CE1-CG 3.86Å; Y133-P139 HydrophobicContact CE2-CB 3.99Å; Y133-P139 HydrophobicContact CE2-CG 3.74Å; Y133-P139 VanDerWaalsContact CZ-CD 3.46Å; Y133-P139 VanDerWaalsContact OH-CG 3.3Å; Y133-P139 WeakPolarHBondContact OH-CG 3.43Å; P139-L141 VanDerWaalsContact C-N 3.27Å; P139-L141 PolarHBondContact O-N 3.22Å
140	W	53.7	Low	60.8	Low	132 Å²	132	91.7 Å²	91.7	50%	0.5	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	3.6	-168.7	-54	102.5	0	0	0	115	W72 V138 F142 T143	W72-W140 HydrophobicContact CB-CD2 4.4Å; W72-W140 HydrophobicContact CB-CE3 3.56Å; W72-W140 HydrophobicContact CB-CH2 4.16Å; W72-W140 HydrophobicContact CB-CZ3 3.45Å; W72-W140 VanDerWaalsContact CB-CZ3 3.45Å; W72-W140 AromaticContact CD1-CH2 3.58Å; W72-W140 AromaticContact CD1-CZ3 3.72Å; W72-W140 HydrophobicContact CG-CE3 4.27Å; W72-W140 HydrophobicContact CG-CH2 4.04Å; W72-W140 AromaticContact CG-CZ3 3.84Å; W72-W140 HydrophobicContact CG-CZ3 3.84Å; V138-W140 PolarHBondContact O-N 2.76Å; W140-F142 PolarHBondContact O-N 3.1Å; W140-F142 VanDerWaalsContact O-N 3.1Å; W140-T143 PolarHBondContact O-OG1 3.11Å
141	L	47.3	Very low	59.1	Low	132 Å²	132	93 Å²	93	69%	0.691	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	13.2	-174	-93.4	160.5	0	0	0	115.6	P139	P139-L141 VanDerWaalsContact C-N 3.27Å; P139-L141 PolarHBondContact O-N 3.22Å
142	F	44	Very low	57.4	Low	134 Å²	134	91 Å²	91	59%	0.588	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.7	19.4	175.9	-64	-71.4	0	0	0	114.2	M75 W140	M75-F142 HydrophobicContact CB-CB 4.4Å; W140-F142 PolarHBondContact O-N 3.1Å; W140-F142 VanDerWaalsContact O-N 3.1Å
143	T	46.3	Very low	56.1	Low	157 Å²	157	96.1 Å²	96.1	96%	0.963	53%	0.53	S	S	*	.			trans	-85.3	0	163.4	59.6	0	0	0	0	110.9	W140	W140-T143 PolarHBondContact O-OG1 3.11Å

Retrieved 143 of 143 residues in 75.9 ms (Link to these results)

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