A0A096MW31_PAPAN Loading...

NADH dehydrogenase [ubiquinone] 1 subunit C2

Accessory subunit of the mitochondrial membrane respiratory chain NADH dehydrogenase (Complex I), that is believed not to be involved in catalysis. Complex I functions in the transfer of electrons from NADH to the respiratory chain. The immediate electron acceptor for the enzyme is believed to be ubiquinone.

AlphaFold DB , UniProt , Accession A0A096MW31, Species PAPAN (Papio anubis, Olive baboon), Gene NDUFC2, Length 119 aa.

						>A0A096MW31_PAPAN|A0A096MW31|NDUFC2
MVPRRNPEPLRFLPDESRSLPPPKLTDPRLLYIGFLGYCAGLTDNFIRRRPVLSAGLHRHLLYITAFYFVGYYLVKREDYTYAVRDREMFGYMKLHPEDFSEKEKKTYAEIFEKFHPIR
					

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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	52.8	Low	63.6	Low	169 Å²	169	135.1 Å²	135.1	83%	0.833	69%	0.687	S	S	*	*				0	8.3	0	-68	170.5	-154.6	0	0	114.3	R85	M1-R85 HydrophobicContact CE-CB 4.27Å; M1-R85 VanDerWaalsContact CE-CD 3.48Å; M1-R85 HydrophobicContact CE-CG 3.4Å; M1-R85 VanDerWaalsContact CE-CG 3.4Å; M1-R85 HydrophobicContact SD-CB 4.17Å; M1-R85 HydrophobicContact SD-CG 3.94Å
2	V	50.8	Low	65.5	Low	135 Å²	135	130.8 Å²	130.8	82%	0.818	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-71.6	-26.7	177.2	179.9	0	0	0	0	115	R4	V2-R4 PolarHBondContact O-N 2.73Å
3	P	46.8	Very low	67.2	Low	125 Å²	125	123.5 Å²	123.5	81%	0.812	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-87.4	-4.8	-168.6	34.2	-33.8	0	0	0	115.2
4	R	57.3	Low	68.8	Low	188 Å²	188	115.5 Å²	115.5	71%	0.709	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-118.6	37.1	173.7	-85.7	-168.8	175.3	-177.8	1.1	112.9	V2 N6 E88	V2-R4 PolarHBondContact O-N 2.73Å; R4-N6 VanDerWaalsContact C-N 3.34Å; R4-N6 PolarHBondContact O-N 2.87Å; R4-E88 VanDerWaalsContact CD-OE1 3.28Å; R4-E88 WeakPolarHBondContact CD-OE1 3.47Å; R4-E88 IonicContact NH1-OE1 3.9Å
5	R	56.3	Low	70.1	Confident	206 Å²	206	113.1 Å²	113.1	78%	0.777	57%	0.574	S	S	*	*	S	Bend	trans	-63.1	104.5	158.6	-151.1	-178.2	-162.1	-172.2	5.3	105.4
6	N	56.7	Low	71.2	Confident	42 Å²	42	111.6 Å²	111.6	23%	0.225	57%	0.565	C	S	.	*			trans	11.9	132.2	176.9	-81.2	-23.9	0	0	0	117.3	R4 E8	R4-N6 VanDerWaalsContact C-N 3.34Å; R4-N6 PolarHBondContact O-N 2.87Å; N6-E8 WeakPolarHBondContact CB-O 3.3Å; N6-E8 CarbonylContact O-C 3.31Å; N6-E8 PolarHBondContact O-N 3.37Å
7	P	66.1	Low	72.2	Confident	138 Å²	138	105.4 Å²	105.4	90%	0.896	53%	0.534	S	S	*	.	S	Bend	trans	-54.3	-20.1	170	23.1	-31.5	0	0	0	112.9	P9	P7-P9 WeakPolarHBondContact O-CD 3.47Å
8	E	73.2	Confident	73.2	Confident	104 Å²	104	110.2 Å²	110.2	49%	0.486	54%	0.544	S	S	.	.	S	Bend	trans	-97.9	107.3	168	-60.4	-166.3	171.3	0	0	112.1	N6 R11	N6-E8 WeakPolarHBondContact CB-O 3.3Å; N6-E8 CarbonylContact O-C 3.31Å; N6-E8 PolarHBondContact O-N 3.37Å; E8-R11 IonicContact OE1-NH1 3.52Å; E8-R11 VanDerWaalsContact OE2-CD 3.3Å; E8-R11 WeakPolarHBondContact OE2-CD 3.27Å; E8-R11 IonicContact OE2-CZ 2.59Å; E8-R11 IonicContact OE2-NE 3.74Å; E8-R11 IonicContact OE2-NH1 2.8Å; E8-R11 PolarHBondContact OE2-NH1 2.67Å
9	P	76.1	Confident	74.2	Confident	114 Å²	114	109.4 Å²	109.4	74%	0.74	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	151.7	177.9	27	-33.5	0	0	0	111.6	P7 R11	P7-P9 WeakPolarHBondContact O-CD 3.47Å; P9-R11 PolarHBondContact O-N 2.8Å; P9-R11 VanDerWaalsContact O-N 3.09Å
10	L	79.3	Confident	75.1	Confident	182 Å²	182	106.6 Å²	106.6	95%	0.953	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	1.3	174.6	-55.7	171.9	0	0	0	117.3	F12	L10-F12 PolarHBondContact O-N 3.05Å
11	R	84.6	Confident	76	Confident	83 Å²	83	106.7 Å²	106.7	31%	0.313	55%	0.545	S	S	.	.			trans	-73.5	108.7	174.9	-162.3	164	-175.3	171.2	4	111.3	E8 P9 D15	E8-R11 IonicContact OE1-NH1 3.52Å; E8-R11 VanDerWaalsContact OE2-CD 3.3Å; E8-R11 WeakPolarHBondContact OE2-CD 3.27Å; E8-R11 IonicContact OE2-CZ 2.59Å; E8-R11 IonicContact OE2-NE 3.74Å; E8-R11 IonicContact OE2-NH1 2.8Å; E8-R11 PolarHBondContact OE2-NH1 2.67Å; P9-R11 PolarHBondContact O-N 2.8Å; P9-R11 VanDerWaalsContact O-N 3.09Å; R11-D15 IonicContact CZ-OD1 3.79Å; R11-D15 IonicContact CZ-OD2 3.96Å; R11-D15 IonicContact NH1-OD2 3.52Å; R11-D15 IonicContact NH2-OD1 3.88Å; R11-D15 PolarHBondContact NH2-OD1 3.43Å; R11-D15 IonicContact NH2-OD2 3.82Å; R11-D15 PolarHBondContact NH2-OD2 3.13Å
12	F	86.3	Confident	78	Confident	83 Å²	83	102.4 Å²	102.4	36%	0.364	53%	0.53	S	S	.	.	S	Bend	trans	-63.2	-45.3	-176.4	-177.3	-90.6	0	0	0	112.5	L10 Y73 L74 R77	L10-F12 PolarHBondContact O-N 3.05Å; F12-Y73 WeakPolarHBondContact CE1-O 3.46Å; F12-L74 HydrophobicContact CZ-CD2 4.32Å; F12-R77 HydrophobicContact CE1-CB 3.95Å; F12-R77 HydrophobicContact CZ-CB 3.93Å; F12-R77 HydrophobicContact CZ-CG 4.35Å
13	L	87.7	Confident	80	Confident	36 Å²	36	96.5 Å²	96.5	19%	0.188	49%	0.494	C	S	.	.	S	Bend	trans	-131.3	115.2	173.1	-78.8	163.6	0	0	0	108.7	Y73 K76 R77	L13-Y73 HydrophobicContact CD1-CD1 4.1Å; L13-K76 HydrophobicContact CD1-CB 4.47Å; L13-K76 HydrophobicContact CD1-CD 3.77Å; L13-K76 HydrophobicContact CD1-CG 4.04Å; L13-K76 HydrophobicContact CD2-CD 4.48Å; L13-K76 HydrophobicContact CD2-CG 3.99Å; L13-R77 HydrophobicContact CD2-CB 4.27Å
14	P	89	Confident	82.3	Confident	12 Å²	12	98 Å²	98	8%	0.078	49%	0.488	C	S	.	.			trans	-74.7	162.8	177.1	28.7	-30.8	0	0	0	111.5	E16 S17 Y80	P14-E16 PolarHBondContact O-N 3.23Å; P14-S17 VanDerWaalsContact O-CB 3.27Å; P14-S17 WeakPolarHBondContact O-CB 3.37Å; P14-S17 PolarHBondContact O-N 3.26Å; P14-S17 PolarHBondContact O-OG 3.05Å; P14-Y80 HydrophobicContact CG-CD1 4.24Å; P14-Y80 HydrophobicContact CG-CE1 3.44Å; P14-Y80 VanDerWaalsContact CG-CE1 3.44Å; P14-Y80 HydrophobicContact CG-CE2 3.77Å; P14-Y80 WeakPolarHBondContact CG-OH 3.32Å
15	D	88.4	Confident	84	Confident	79 Å²	79	94.6 Å²	94.6	42%	0.422	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-61.1	-31.1	-179.4	-71.9	-30.4	0	0	0	112.9	R11 S17 R18	R11-D15 IonicContact CZ-OD1 3.79Å; R11-D15 IonicContact CZ-OD2 3.96Å; R11-D15 IonicContact NH1-OD2 3.52Å; R11-D15 IonicContact NH2-OD1 3.88Å; R11-D15 PolarHBondContact NH2-OD1 3.43Å; R11-D15 IonicContact NH2-OD2 3.82Å; R11-D15 PolarHBondContact NH2-OD2 3.13Å; D15-S17 PolarHBondContact O-N 2.9Å; D15-R18 VanDerWaalsContact O-CB 3.28Å; D15-R18 WeakPolarHBondContact O-CB 3.28Å; D15-R18 WeakPolarHBondContact O-CG 3.41Å; D15-R18 PolarHBondContact O-N 2.59Å; D15-R18 IonicContact OD1-CZ 3.32Å; D15-R18 IonicContact OD1-NE 3.11Å; D15-R18 IonicContact OD1-NH2 3.96Å
16	E	87.8	Confident	85.8	Confident	90 Å²	90	89.9 Å²	89.9	42%	0.421	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-57	-32	173.9	-177.4	171.6	-155.1	0	0	112.3	P14 R18 S19 R87	P14-E16 PolarHBondContact O-N 3.23Å; E16-R18 PolarHBondContact O-N 3.27Å; E16-S19 WeakPolarHBondContact O-CB 3.17Å; E16-S19 PolarHBondContact O-N 3.44Å; E16-S19 PolarHBondContact O-OG 3.09Å; E16-R87 IonicContact OE1-CZ 3.92Å; E16-R87 IonicContact OE1-NH1 2.67Å; E16-R87 PolarHBondContact OE1-NH1 3.04Å; E16-R87 IonicContact OE2-CZ 3.71Å; E16-R87 IonicContact OE2-NH1 3.49Å; E16-R87 PolarHBondContact OE2-NH1 2.95Å; E16-R87 IonicContact OE2-NH2 3.91Å
17	S	87.7	Confident	87.7	Confident	5 Å²	5	89 Å²	89	4%	0.035	47%	0.473	C	S	.	.	G	3₁₀ helix	trans	-62.7	-16.9	178.6	72.2	0	0	0	0	113.5	P14 D15 S19 L20 Y80	P14-S17 VanDerWaalsContact O-CB 3.27Å; P14-S17 WeakPolarHBondContact O-CB 3.37Å; P14-S17 PolarHBondContact O-N 3.26Å; P14-S17 PolarHBondContact O-OG 3.05Å; D15-S17 PolarHBondContact O-N 2.9Å; S17-S19 PolarHBondContact O-N 3.44Å; S17-L20 PolarHBondContact O-N 2.94Å; S17-Y80 VanDerWaalsContact CB-CD2 3.5Å
18	R	90.5	Very high	89.1	Confident	193 Å²	193	87.1 Å²	87.1	73%	0.728	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-71.7	-17.1	175.7	-61.2	178.5	178.3	178.8	1.4	113.1	D15 E16 L20	D15-R18 VanDerWaalsContact O-CB 3.28Å; D15-R18 WeakPolarHBondContact O-CB 3.28Å; D15-R18 WeakPolarHBondContact O-CG 3.41Å; D15-R18 PolarHBondContact O-N 2.59Å; D15-R18 IonicContact OD1-CZ 3.32Å; D15-R18 IonicContact OD1-NE 3.11Å; D15-R18 IonicContact OD1-NH2 3.96Å; E16-R18 PolarHBondContact O-N 3.27Å; R18-L20 VanDerWaalsContact C-N 3.28Å
19	S	92.4	Very high	90.2	Very high	95 Å²	95	86.6 Å²	86.6	66%	0.664	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-74.8	-20.1	174.2	65.5	0	0	0	0	112.9	E16 S17	E16-S19 WeakPolarHBondContact O-CB 3.17Å; E16-S19 PolarHBondContact O-N 3.44Å; E16-S19 PolarHBondContact O-OG 3.09Å; S17-S19 PolarHBondContact O-N 3.44Å
20	L	93.3	Very high	91.1	Very high	52 Å²	52	81.2 Å²	81.2	27%	0.272	42%	0.419	S	S	.	.	S	Bend	trans	-81.2	144	178.2	-61.8	175	0	0	0	111	S17 R18 Y80 A83	S17-L20 PolarHBondContact O-N 2.94Å; R18-L20 VanDerWaalsContact C-N 3.28Å; L20-Y80 HydrophobicContact CD1-CD2 3.89Å; L20-Y80 HydrophobicContact CD1-CG 4.48Å; L20-A83 HydrophobicContact CD1-CB 3.68Å; L20-A83 HydrophobicContact CD2-CB 3.82Å; L20-A83 HydrophobicContact CG-CB 4.41Å
21	P	94	Very high	91.8	Very high	110 Å²	110	77.1 Å²	77.1	71%	0.714	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-62.9	126.7	173.6	26.9	-33.1	0	0	0	109.4
22	P	93.1	Very high	92.4	Very high	78 Å²	78	80 Å²	80	51%	0.506	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-69.5	154.6	179.2	28.7	-34.4	0	0	0	111.3	K24	P22-K24 PolarHBondContact O-N 2.91Å
23	P	94.6	Very high	92.9	Very high	12 Å²	12	77.8 Å²	77.8	8%	0.078	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-61.4	139	174.7	24.9	-32.1	0	0	0	110.2	Y72 V75 K76	P23-Y72 HydrophobicContact CG-CD2 4.06Å; P23-Y72 HydrophobicContact CG-CE2 3.74Å; P23-Y72 WeakPolarHBondContact O-CE2 3.34Å; P23-V75 HydrophobicContact CB-CG1 3.89Å; P23-V75 HydrophobicContact CG-CG1 4.14Å; P23-K76 HydrophobicContact CG-CB 4.36Å
24	K	95.1	Very high	93.3	Very high	157 Å²	157	76.4 Å²	76.4	68%	0.683	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-70.3	151.2	176	-64.7	179.8	-178.5	177.2	0	109.5	P22 T26 D27	P22-K24 PolarHBondContact O-N 2.91Å; K24-T26 PolarHBondContact O-N 2.86Å; K24-D27 VanDerWaalsContact O-CB 3.24Å; K24-D27 WeakPolarHBondContact O-CB 3.4Å; K24-D27 PolarHBondContact O-N 3.27Å
25	L	92.8	Very high	93.7	Very high	116 Å²	116	81.4 Å²	81.4	61%	0.607	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-24.9	175.1	-64.4	177.9	0	0	0	112.6	Y68	L25-Y68 VanDerWaalsContact CA-OH 3.27Å; L25-Y68 WeakPolarHBondContact CA-OH 3.37Å; L25-Y68 WeakPolarHBondContact CB-OH 3.29Å; L25-Y68 HydrophobicContact CD2-CE1 4.25Å; L25-Y68 PolarHBondContact O-OH 3.48Å
26	T	94.3	Very high	94.1	Very high	107 Å²	107	80.9 Å²	80.9	66%	0.656	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	13.4	176.7	55.6	0	0	0	0	113.4	K24	K24-T26 PolarHBondContact O-N 2.86Å
27	D	94.6	Very high	94.5	Very high	23 Å²	23	76.6 Å²	76.6	12%	0.123	39%	0.393	C	S	.	.			trans	-58.7	126.7	176	-173.7	-29.2	0	0	0	109.6	K24 R29 L30 L31	K24-D27 VanDerWaalsContact O-CB 3.24Å; K24-D27 WeakPolarHBondContact O-CB 3.4Å; K24-D27 PolarHBondContact O-N 3.27Å; D27-R29 PolarHBondContact O-N 3.33Å; D27-R29 WeakPolarHBondContact OD1-CB 3.4Å; D27-R29 WeakPolarHBondContact OD1-CG 3.4Å; D27-R29 PolarHBondContact OD1-N 2.94Å; D27-R29 IonicContact OD1-NE 3.77Å; D27-R29 PolarHBondContact OD1-NE 3.25Å; D27-R29 IonicContact OD2-CZ 3.62Å; D27-R29 IonicContact OD2-NE 3.68Å; D27-R29 PolarHBondContact OD2-NE 3.03Å; D27-R29 IonicContact OD2-NH2 3.59Å; D27-R29 PolarHBondContact OD2-NH2 3.49Å; D27-L30 HydrophobicContact CB-CB 4.19Å; D27-L30 WeakPolarHBondContact O-CB 3.28Å; D27-L30 PolarHBondContact O-N 3.27Å; D27-L31 PolarHBondContact O-N 2.97Å
28	P	96.3	Very high	94.8	Very high	98 Å²	98	80.2 Å²	80.2	64%	0.636	41%	0.407	S	S	*	.	H	α-helix	trans	-56.9	-32	-180	23.5	-35.5	0	0	0	113.1	L30 L31 Y32	P28-L30 VanDerWaalsContact C-N 3.32Å; P28-L30 PolarHBondContact O-N 3.04Å; P28-L31 PolarHBondContact O-N 3.23Å; P28-Y32 WeakPolarHBondContact O-CB 3.38Å; P28-Y32 PolarHBondContact O-N 3.47Å
29	R	95.7	Very high	95	Very high	93 Å²	93	73 Å²	73	35%	0.351	39%	0.385	S	S	.	.	H	α-helix	trans	-61.7	-43.8	175.5	-61.6	179.9	-70.3	175.9	-0.7	110.8	D27 Y32 I33 V75 E78 D79	D27-R29 PolarHBondContact O-N 3.33Å; D27-R29 WeakPolarHBondContact OD1-CB 3.4Å; D27-R29 WeakPolarHBondContact OD1-CG 3.4Å; D27-R29 PolarHBondContact OD1-N 2.94Å; D27-R29 IonicContact OD1-NE 3.77Å; D27-R29 PolarHBondContact OD1-NE 3.25Å; D27-R29 IonicContact OD2-CZ 3.62Å; D27-R29 IonicContact OD2-NE 3.68Å; D27-R29 PolarHBondContact OD2-NE 3.03Å; D27-R29 IonicContact OD2-NH2 3.59Å; D27-R29 PolarHBondContact OD2-NH2 3.49Å; R29-Y32 PolarHBondContact O-N 2.99Å; R29-I33 VanDerWaalsContact O-CG1 3.29Å; R29-I33 WeakPolarHBondContact O-CG1 3.33Å; R29-I33 PolarHBondContact O-N 3.02Å; R29-V75 HydrophobicContact CB-CG2 4.38Å; R29-V75 VanDerWaalsContact CZ-CG1 3.47Å; R29-V75 VanDerWaalsContact NH2-CG1 3.34Å; R29-E78 IonicContact NH1-OE2 3.04Å; R29-D79 IonicContact CZ-OD1 3.18Å; R29-D79 IonicContact CZ-OD2 3.36Å; R29-D79 IonicContact NH1-OD1 2.91Å; R29-D79 PolarHBondContact NH1-OD1 2.95Å; R29-D79 IonicContact NH1-OD2 2.8Å; R29-D79 IonicContact NH2-OD1 3.4Å; R29-D79 PolarHBondContact NH2-OD1 2.9Å; R29-D79 IonicContact NH2-OD2 3.87Å; R29-D79 PolarHBondContact NH2-OD2 3.28Å; R29-D79 VanDerWaalsContact NH2-OD2 3.11Å
30	L	94.9	Very high	95.1	Very high	1 Å²	1	69.9 Å²	69.9	1%	0.005	37%	0.366	C	S	.	.	H	α-helix	trans	-72.4	-39.6	-178.6	-171.8	61.7	0	0	0	111.9	D27 P28 Y32 I33 G34 Y68 Y72	D27-L30 HydrophobicContact CB-CB 4.19Å; D27-L30 WeakPolarHBondContact O-CB 3.28Å; D27-L30 PolarHBondContact O-N 3.27Å; P28-L30 VanDerWaalsContact C-N 3.32Å; P28-L30 PolarHBondContact O-N 3.04Å; L30-Y32 VanDerWaalsContact C-N 3.31Å; L30-Y32 PolarHBondContact O-N 3.05Å; L30-I33 PolarHBondContact O-N 3.31Å; L30-G34 PolarHBondContact O-N 3.2Å; L30-Y68 HydrophobicContact CD1-CD1 4.48Å; L30-Y68 HydrophobicContact CD1-CD2 4.18Å; L30-Y68 HydrophobicContact CD1-CE2 4.28Å; L30-Y68 HydrophobicContact CD1-CG 4.3Å; L30-Y68 WeakPolarHBondContact CD1-O 3.25Å; L30-Y68 HydrophobicContact CD2-CD1 4.45Å; L30-Y68 HydrophobicContact CD2-CD2 4.36Å; L30-Y68 HydrophobicContact CD2-CE1 3.74Å; L30-Y68 HydrophobicContact CD2-CE2 3.66Å; L30-Y68 VanDerWaalsContact CD2-OH 3.29Å; L30-Y68 WeakPolarHBondContact CD2-OH 3.27Å; L30-Y68 HydrophobicContact CG-CD2 3.81Å; L30-Y68 HydrophobicContact CG-CE1 4.21Å; L30-Y68 HydrophobicContact CG-CE2 3.46Å; L30-Y68 VanDerWaalsContact CG-CE2 3.46Å; L30-Y68 HydrophobicContact CG-CG 4.34Å; L30-Y72 HydrophobicContact CD2-CD2 3.95Å
31	L	95.6	Very high	95.2	Very high	97 Å²	97	67.5 Å²	67.5	51%	0.508	35%	0.353	S	S	.	.	H	α-helix	trans	-61	-41.8	172.4	-67	175.9	0	0	0	111.5	D27 P28 G34 F35	D27-L31 PolarHBondContact O-N 2.97Å; P28-L31 PolarHBondContact O-N 3.23Å; L31-G34 PolarHBondContact O-N 3.18Å; L31-F35 PolarHBondContact O-N 2.94Å
32	Y	96.7	Very high	95.1	Very high	143 Å²	143	64 Å²	64	56%	0.561	33%	0.328	S	S	*	.	H	α-helix	trans	-63.6	-41.5	175.5	-175.7	-103.7	0	0	0	112.1	P28 R29 L30 G34 F35 L36	P28-Y32 WeakPolarHBondContact O-CB 3.38Å; P28-Y32 PolarHBondContact O-N 3.47Å; R29-Y32 PolarHBondContact O-N 2.99Å; L30-Y32 VanDerWaalsContact C-N 3.31Å; L30-Y32 PolarHBondContact O-N 3.05Å; Y32-G34 VanDerWaalsContact C-N 3.34Å; Y32-G34 PolarHBondContact O-N 2.6Å; Y32-F35 HydrophobicContact CE2-CD1 4.49Å; Y32-F35 CarbonylContact O-C 3.56Å; Y32-F35 WeakPolarHBondContact O-CB 3.41Å; Y32-F35 PolarHBondContact O-N 2.65Å; Y32-F35 VanDerWaalsContact O-N 3.16Å; Y32-L36 HydrophobicContact CD1-CD1 4.13Å; Y32-L36 HydrophobicContact CD1-CG 4.32Å; Y32-L36 HydrophobicContact CE1-CD1 3.8Å; Y32-L36 HydrophobicContact CE1-CD2 4.21Å; Y32-L36 HydrophobicContact CE1-CG 4.01Å; Y32-L36 WeakPolarHBondContact O-CG 3.45Å; Y32-L36 PolarHBondContact O-N 3.02Å
33	I	96.7	Very high	95.2	Very high	36 Å²	36	63.9 Å²	63.9	19%	0.185	33%	0.326	C	S	.	.	H	α-helix	trans	-63.4	-40.5	174.5	-65.9	163.2	0	0	0	111.3	R29 L30 F35 L36 G37 F67 V75	R29-I33 VanDerWaalsContact O-CG1 3.29Å; R29-I33 WeakPolarHBondContact O-CG1 3.33Å; R29-I33 PolarHBondContact O-N 3.02Å; L30-I33 PolarHBondContact O-N 3.31Å; I33-F35 VanDerWaalsContact C-N 3.31Å; I33-F35 PolarHBondContact O-N 3.41Å; I33-L36 WeakPolarHBondContact O-CB 3.4Å; I33-L36 PolarHBondContact O-N 3.42Å; I33-G37 PolarHBondContact O-N 3.29Å; I33-F67 HydrophobicContact CG2-CB 4.12Å; I33-F67 HydrophobicContact CG2-CD1 4.32Å; I33-F67 VanDerWaalsContact CG2-O 3.25Å; I33-F67 WeakPolarHBondContact CG2-O 3.27Å; I33-V75 HydrophobicContact CD1-CG2 4Å
34	G	95.9	Very high	95.2	Very high	7 Å²	7	64.4 Å²	64.4	7%	0.072	33%	0.328	C	S	.	.	H	α-helix	trans	-60.3	-41	172.2	0	0	0	0	0	112.4	L30 L31 Y32 G37 Y38	L30-G34 PolarHBondContact O-N 3.2Å; L31-G34 PolarHBondContact O-N 3.18Å; Y32-G34 VanDerWaalsContact C-N 3.34Å; Y32-G34 PolarHBondContact O-N 2.6Å; G34-G37 WeakPolarHBondContact O-CA 3.42Å; G34-G37 PolarHBondContact O-N 2.97Å; G34-G37 VanDerWaalsContact O-N 3.13Å; G34-Y38 PolarHBondContact O-N 3.24Å; G34-Y38 VanDerWaalsContact O-N 3.08Å
35	F	96.5	Very high	95.1	Very high	117 Å²	117	57 Å²	57	51%	0.513	30%	0.296	S	S	.	.	H	α-helix	trans	-63.6	-38.4	173.7	177.7	-105.4	0	0	0	112.5	L31 Y32 I33 G37 Y38 C39	L31-F35 PolarHBondContact O-N 2.94Å; Y32-F35 HydrophobicContact CE2-CD1 4.49Å; Y32-F35 CarbonylContact O-C 3.56Å; Y32-F35 WeakPolarHBondContact O-CB 3.41Å; Y32-F35 PolarHBondContact O-N 2.65Å; Y32-F35 VanDerWaalsContact O-N 3.16Å; I33-F35 VanDerWaalsContact C-N 3.31Å; I33-F35 PolarHBondContact O-N 3.41Å; F35-G37 VanDerWaalsContact C-N 3.27Å; F35-G37 PolarHBondContact O-N 3.06Å; F35-Y38 HydrophobicContact CD2-CD1 4.46Å; F35-Y38 HydrophobicContact CE2-CD1 4.35Å; F35-Y38 WeakPolarHBondContact O-CB 3.43Å; F35-Y38 PolarHBondContact O-N 3.35Å; F35-Y38 VanDerWaalsContact O-N 3.13Å; F35-C39 PolarHBondContact O-N 3.42Å; F35-C39 PolarHBondContact O-SG 3.44Å
36	L	97.1	Very high	95	Very high	68 Å²	68	58.8 Å²	58.8	36%	0.356	30%	0.299	S	S	.	.	H	α-helix	trans	-60.7	-37.4	171.3	-68.3	177.3	0	0	0	112	Y32 I33 C39 A40 F67	Y32-L36 HydrophobicContact CD1-CD1 4.13Å; Y32-L36 HydrophobicContact CD1-CG 4.32Å; Y32-L36 HydrophobicContact CE1-CD1 3.8Å; Y32-L36 HydrophobicContact CE1-CD2 4.21Å; Y32-L36 HydrophobicContact CE1-CG 4.01Å; Y32-L36 WeakPolarHBondContact O-CG 3.45Å; Y32-L36 PolarHBondContact O-N 3.02Å; I33-L36 WeakPolarHBondContact O-CB 3.4Å; I33-L36 PolarHBondContact O-N 3.42Å; L36-C39 PolarHBondContact O-N 2.93Å; L36-A40 WeakPolarHBondContact O-CB 3.42Å; L36-A40 PolarHBondContact O-N 2.95Å; L36-F67 HydrophobicContact CB-CD1 4.24Å; L36-F67 HydrophobicContact CB-CE1 4.36Å
37	G	95.8	Very high	95.1	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-61.5	-40.9	172.3	0	0	0	0	0	112.8	I33 G34 F35 A40 G41 Y63	I33-G37 PolarHBondContact O-N 3.29Å; G34-G37 WeakPolarHBondContact O-CA 3.42Å; G34-G37 PolarHBondContact O-N 2.97Å; G34-G37 VanDerWaalsContact O-N 3.13Å; F35-G37 VanDerWaalsContact C-N 3.27Å; F35-G37 PolarHBondContact O-N 3.06Å; G37-A40 PolarHBondContact O-N 3.11Å; G37-G41 PolarHBondContact O-N 3.34Å; G37-G41 VanDerWaalsContact O-N 3.11Å; G37-Y63 VanDerWaalsContact O-CB 3.3Å; G37-Y63 WeakPolarHBondContact O-CB 3.44Å
38	Y	95	Very high	95	Very high	82 Å²	82	64.7 Å²	64.7	32%	0.322	32%	0.316	S	S	.	.	H	α-helix	trans	-62.6	-47.6	173	178.5	-113.4	0	0	0	111.8	G34 F35 A40 G41 L42 I64	G34-Y38 PolarHBondContact O-N 3.24Å; G34-Y38 VanDerWaalsContact O-N 3.08Å; F35-Y38 HydrophobicContact CD2-CD1 4.46Å; F35-Y38 HydrophobicContact CE2-CD1 4.35Å; F35-Y38 WeakPolarHBondContact O-CB 3.43Å; F35-Y38 PolarHBondContact O-N 3.35Å; F35-Y38 VanDerWaalsContact O-N 3.13Å; Y38-A40 VanDerWaalsContact C-N 3.29Å; Y38-A40 PolarHBondContact O-N 2.95Å; Y38-G41 PolarHBondContact O-N 2.69Å; Y38-G41 VanDerWaalsContact O-N 3.09Å; Y38-L42 HydrophobicContact CD1-CD1 4.03Å; Y38-L42 HydrophobicContact CE1-CD1 3.61Å; Y38-L42 HydrophobicContact CE1-CD2 4.4Å; Y38-L42 HydrophobicContact CE1-CG 4.18Å; Y38-L42 HydrophobicContact CE2-CD2 4.26Å; Y38-L42 HydrophobicContact CE2-CG 4.48Å; Y38-L42 WeakPolarHBondContact O-CG 3.37Å; Y38-L42 PolarHBondContact O-N 3.43Å; Y38-I64 HydrophobicContact CD2-CD1 4.08Å; Y38-I64 HydrophobicContact CG-CD1 4.47Å
39	C	95.2	Very high	94.7	Very high	40 Å²	40	71.4 Å²	71.4	27%	0.27	33%	0.329	S	S	.	.	H	α-helix	trans	-57.7	-41.1	175.4	-70.4	0	0	0	0	112.1	F35 L36 G41 L42 T43	F35-C39 PolarHBondContact O-N 3.42Å; F35-C39 PolarHBondContact O-SG 3.44Å; L36-C39 PolarHBondContact O-N 2.93Å; C39-G41 VanDerWaalsContact C-N 3.31Å; C39-G41 PolarHBondContact O-N 3.35Å; C39-L42 WeakPolarHBondContact O-CB 3.05Å; C39-L42 PolarHBondContact O-N 3.36Å; C39-L42 VanDerWaalsContact O-N 3.16Å; C39-T43 PolarHBondContact O-N 3.49Å; C39-T43 PolarHBondContact O-OG1 3.01Å
40	A	95	Very high	94.4	Very high	31 Å²	31	72.1 Å²	72.1	26%	0.256	33%	0.331	S	S	.	.	H	α-helix	trans	-60.7	-40	175.6	0	0	0	0	0	112.2	L36 G37 Y38 T43 D44 F67	L36-A40 WeakPolarHBondContact O-CB 3.42Å; L36-A40 PolarHBondContact O-N 2.95Å; G37-A40 PolarHBondContact O-N 3.11Å; Y38-A40 VanDerWaalsContact C-N 3.29Å; Y38-A40 PolarHBondContact O-N 2.95Å; A40-T43 PolarHBondContact O-N 2.96Å; A40-D44 PolarHBondContact O-N 3.2Å; A40-F67 HydrophobicContact CB-CE2 4.48Å; A40-F67 HydrophobicContact CB-CZ 4.28Å
41	G	93.6	Very high	94.2	Very high	1 Å²	1	76.2 Å²	76.2	1%	0.01	36%	0.358	C	S	.	.	H	α-helix	trans	-63.1	-40.5	173.4	0	0	0	0	0	113.1	G37 Y38 C39 D44 N45 H60	G37-G41 PolarHBondContact O-N 3.34Å; G37-G41 VanDerWaalsContact O-N 3.11Å; Y38-G41 PolarHBondContact O-N 2.69Å; Y38-G41 VanDerWaalsContact O-N 3.09Å; C39-G41 VanDerWaalsContact C-N 3.31Å; C39-G41 PolarHBondContact O-N 3.35Å; G41-D44 PolarHBondContact O-N 3.13Å; G41-N45 PolarHBondContact O-N 3.05Å; G41-N45 VanDerWaalsContact O-N 3.17Å; G41-H60 PolarHBondContact O-CE1 3.37Å
42	L	93.7	Very high	93.7	Very high	38 Å²	38	74 Å²	74	20%	0.199	35%	0.348	C	S	.	.	H	α-helix	trans	-63.9	-43.1	174.6	-61.3	175	0	0	0	111.2	Y38 C39 N45 F46 V52 L53	Y38-L42 HydrophobicContact CD1-CD1 4.03Å; Y38-L42 HydrophobicContact CE1-CD1 3.61Å; Y38-L42 HydrophobicContact CE1-CD2 4.4Å; Y38-L42 HydrophobicContact CE1-CG 4.18Å; Y38-L42 HydrophobicContact CE2-CD2 4.26Å; Y38-L42 HydrophobicContact CE2-CG 4.48Å; Y38-L42 WeakPolarHBondContact O-CG 3.37Å; Y38-L42 PolarHBondContact O-N 3.43Å; C39-L42 WeakPolarHBondContact O-CB 3.05Å; C39-L42 PolarHBondContact O-N 3.36Å; C39-L42 VanDerWaalsContact O-N 3.16Å; L42-N45 PolarHBondContact O-N 3.45Å; L42-F46 WeakPolarHBondContact O-CB 3.49Å; L42-F46 PolarHBondContact O-N 2.8Å; L42-V52 HydrophobicContact CB-CG1 3.96Å; L42-V52 HydrophobicContact CD2-CG1 3.6Å; L42-V52 HydrophobicContact CG-CG1 4.33Å; L42-L53 HydrophobicContact CD2-CD2 4.03Å
43	T	94.4	Very high	93	Very high	75 Å²	75	73.4 Å²	73.4	46%	0.46	35%	0.354	S	S	.	.	H	α-helix	trans	-64.5	-41.1	177.6	-53.5	0	0	0	0	112	C39 A40 N45 F46 I47	C39-T43 PolarHBondContact O-N 3.49Å; C39-T43 PolarHBondContact O-OG1 3.01Å; A40-T43 PolarHBondContact O-N 2.96Å; T43-N45 VanDerWaalsContact C-N 3.33Å; T43-N45 PolarHBondContact O-N 3.28Å; T43-F46 WeakPolarHBondContact O-CB 3.4Å; T43-F46 PolarHBondContact O-N 3.32Å; T43-I47 HydrophobicContact CG2-CD1 3.93Å; T43-I47 HydrophobicContact CG2-CG1 4.39Å; T43-I47 VanDerWaalsContact O-CG1 3.31Å; T43-I47 WeakPolarHBondContact O-CG1 3.46Å; T43-I47 PolarHBondContact O-N 3.04Å
44	D	93.8	Very high	92.2	Very high	22 Å²	22	76.7 Å²	76.7	12%	0.118	38%	0.38	C	S	.	.	H	α-helix	trans	-61.1	-41.9	175.9	-177.2	53.5	0	0	0	111.5	A40 G41 R48 Y63	A40-D44 PolarHBondContact O-N 3.2Å; G41-D44 PolarHBondContact O-N 3.13Å; D44-R48 WeakPolarHBondContact O-CB 3.41Å; D44-R48 VanDerWaalsContact O-CG 3.31Å; D44-R48 WeakPolarHBondContact O-CG 3.28Å; D44-R48 PolarHBondContact O-N 3.17Å; D44-R48 IonicContact OD1-CZ 3.75Å; D44-R48 IonicContact OD1-NE 2.78Å; D44-R48 PolarHBondContact OD1-NE 3.3Å; D44-R48 IonicContact OD1-NH2 2.9Å; D44-R48 PolarHBondContact OD1-NH2 3.27Å; D44-R48 IonicContact OD2-NE 3.45Å; D44-R48 PolarHBondContact OD2-NE 3.21Å; D44-R48 IonicContact OD2-NH2 3.85Å; D44-Y63 HydrophobicContact CB-CE2 4.33Å; D44-Y63 PolarHBondContact OD2-OH 3.48Å
45	N	92.6	Very high	91.7	Very high	2 Å²	2	77.3 Å²	77.3	1%	0.011	38%	0.384	C	S	.	.	H	α-helix	trans	-66.2	-39.5	175	-79.1	-16.2	0	0	0	112.6	G41 L42 T43 R48 R49 R50 V52 A55 H60	G41-N45 PolarHBondContact O-N 3.05Å; G41-N45 VanDerWaalsContact O-N 3.17Å; L42-N45 PolarHBondContact O-N 3.45Å; T43-N45 VanDerWaalsContact C-N 3.33Å; T43-N45 PolarHBondContact O-N 3.28Å; N45-R48 PolarHBondContact O-N 2.85Å; N45-R49 PolarHBondContact O-N 3.47Å; N45-R50 HydrophobicContact CB-CB 4.45Å; N45-R50 PolarHBondContact O-N 3.38Å; N45-V52 PolarHBondContact ND2-O 3.4Å; N45-A55 PolarHBondContact ND2-O 2.94Å; N45-H60 PolarHBondContact ND2-NE2 2.9Å
46	F	92.5	Very high	91.1	Very high	153 Å²	153	72.6 Å²	72.6	67%	0.671	37%	0.369	S	S	*	.	H	α-helix	trans	-62.3	-48	177	-180	-102.8	0	0	0	111.8	L42 T43 R48 R49 V52	L42-F46 WeakPolarHBondContact O-CB 3.49Å; L42-F46 PolarHBondContact O-N 2.8Å; T43-F46 WeakPolarHBondContact O-CB 3.4Å; T43-F46 PolarHBondContact O-N 3.32Å; F46-R48 VanDerWaalsContact C-N 3.27Å; F46-R48 PolarHBondContact O-N 3.18Å; F46-R49 PolarHBondContact O-N 2.99Å; F46-R49 VanDerWaalsContact O-N 3.09Å; F46-V52 HydrophobicContact CB-CG2 4.35Å
47	I	95.2	Very high	90.8	Very high	124 Å²	124	76 Å²	76	64%	0.636	39%	0.387	S	S	*	.	H	α-helix	trans	-59.4	-40.5	178	-67.9	165.8	0	0	0	110.9	T43 R49	T43-I47 HydrophobicContact CG2-CD1 3.93Å; T43-I47 HydrophobicContact CG2-CG1 4.39Å; T43-I47 VanDerWaalsContact O-CG1 3.31Å; T43-I47 WeakPolarHBondContact O-CG1 3.46Å; T43-I47 PolarHBondContact O-N 3.04Å; I47-R49 PolarHBondContact O-N 2.93Å
48	R	92.6	Very high	90.7	Very high	131 Å²	131	82.4 Å²	82.4	49%	0.494	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	6.9	-178.9	-63.4	177.3	-165.4	-115.4	4.1	114	D44 N45 F46 R50	D44-R48 WeakPolarHBondContact O-CB 3.41Å; D44-R48 VanDerWaalsContact O-CG 3.31Å; D44-R48 WeakPolarHBondContact O-CG 3.28Å; D44-R48 PolarHBondContact O-N 3.17Å; D44-R48 IonicContact OD1-CZ 3.75Å; D44-R48 IonicContact OD1-NE 2.78Å; D44-R48 PolarHBondContact OD1-NE 3.3Å; D44-R48 IonicContact OD1-NH2 2.9Å; D44-R48 PolarHBondContact OD1-NH2 3.27Å; D44-R48 IonicContact OD2-NE 3.45Å; D44-R48 PolarHBondContact OD2-NE 3.21Å; D44-R48 IonicContact OD2-NH2 3.85Å; N45-R48 PolarHBondContact O-N 2.85Å; F46-R48 VanDerWaalsContact C-N 3.27Å; F46-R48 PolarHBondContact O-N 3.18Å; R48-R50 HydrophobicContact CB-CG 4.09Å; R48-R50 PolarHBondContact O-N 3.11Å
49	R	91	Very high	90.5	Very high	239 Å²	239	82.2 Å²	82.2	90%	0.902	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	36	-177.8	-56.1	-177	-179.9	-167.8	-0.7	113.1	N45 F46 I47	N45-R49 PolarHBondContact O-N 3.47Å; F46-R49 PolarHBondContact O-N 2.99Å; F46-R49 VanDerWaalsContact O-N 3.09Å; I47-R49 PolarHBondContact O-N 2.93Å
50	R	89.3	Confident	90.4	Very high	108 Å²	108	80.8 Å²	80.8	41%	0.408	40%	0.404	S	S	.	.	S	Bend	trans	-95.4	156.8	175	-66.2	-179.2	-177.8	-154.3	-4.9	109.6	N45 R48 V52 A55	N45-R50 HydrophobicContact CB-CB 4.45Å; N45-R50 PolarHBondContact O-N 3.38Å; R48-R50 HydrophobicContact CB-CG 4.09Å; R48-R50 PolarHBondContact O-N 3.11Å; R50-V52 PolarHBondContact O-N 3.33Å; R50-A55 HydrophobicContact CB-CB 4.01Å
51	P	89.2	Confident	90.4	Very high	86 Å²	86	84.5 Å²	84.5	56%	0.558	42%	0.419	S	S	*	.			trans	-61.2	116.1	174.6	23.6	-31	0	0	0	109.7	L53 S54 A55	P51-L53 PolarHBondContact O-N 2.89Å; P51-S54 PolarHBondContact O-N 3.21Å; P51-A55 HydrophobicContact CG-CB 4.01Å; P51-A55 VanDerWaalsContact O-CB 3.25Å; P51-A55 WeakPolarHBondContact O-CB 3.37Å; P51-A55 PolarHBondContact O-N 3.41Å
52	V	85.3	Confident	90.5	Very high	50 Å²	50	89.5 Å²	89.5	30%	0.303	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-44.9	-164	174.4	0	0	0	0	112.8	L42 N45 F46 R50	L42-V52 HydrophobicContact CB-CG1 3.96Å; L42-V52 HydrophobicContact CD2-CG1 3.6Å; L42-V52 HydrophobicContact CG-CG1 4.33Å; N45-V52 PolarHBondContact ND2-O 3.4Å; F46-V52 HydrophobicContact CB-CG2 4.35Å; R50-V52 PolarHBondContact O-N 3.33Å
53	L	82.3	Confident	90.6	Very high	132 Å²	132	90.7 Å²	90.7	69%	0.691	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-32.6	-174.7	-63.1	172.5	0	0	0	113.5	L42 P51	L42-L53 HydrophobicContact CD2-CD2 4.03Å; P51-L53 PolarHBondContact O-N 2.89Å
54	S	80.7	Confident	90.7	Very high	105 Å²	105	90 Å²	90	73%	0.734	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-26.4	-169.7	-44.5	0	0	0	0	113.4	P51	P51-S54 PolarHBondContact O-N 3.21Å
55	A	84.8	Confident	90.9	Very high	19 Å²	19	92.6 Å²	92.6	16%	0.157	46%	0.457	C	S	.	.	S	Bend	trans	-80.5	128.9	-177.3	0	0	0	0	0	112	N45 R50 P51 H60	N45-A55 PolarHBondContact ND2-O 2.94Å; R50-A55 HydrophobicContact CB-CB 4.01Å; P51-A55 HydrophobicContact CG-CB 4.01Å; P51-A55 VanDerWaalsContact O-CB 3.25Å; P51-A55 WeakPolarHBondContact O-CB 3.37Å; P51-A55 PolarHBondContact O-N 3.41Å; A55-H60 PolarHBondContact O-NE2 2.66Å
56	G	84	Confident	91.1	Very high	18 Å²	18	94.4 Å²	94.4	19%	0.186	47%	0.473	C	S	.	.			trans	73.9	48.7	159.6	0	0	0	0	0	115.4	H58 R59 H60	G56-H58 PolarHBondContact O-N 2.77Å; G56-R59 WeakPolarHBondContact O-CA 3.28Å; G56-R59 WeakPolarHBondContact O-CB 3.42Å; G56-R59 PolarHBondContact O-N 3.21Å; G56-H60 PolarHBondContact O-CD2 3.04Å; G56-H60 PolarHBondContact O-N 3.47Å; G56-H60 VanDerWaalsContact O-N 3.13Å
57	L	90.4	Very high	91.3	Very high	141 Å²	141	90.9 Å²	90.9	74%	0.738	46%	0.457	S	S	*	.	H	α-helix	trans	-51	-39.4	175.3	-174.4	66.5	0	0	0	113.2	R59 H60 L61	L57-R59 VanDerWaalsContact C-N 3.25Å; L57-R59 PolarHBondContact O-N 2.91Å; L57-H60 PolarHBondContact O-N 3.04Å; L57-L61 WeakPolarHBondContact O-CB 3.4Å; L57-L61 PolarHBondContact O-N 3.19Å
58	H	93.5	Very high	91.4	Very high	133 Å²	133	88 Å²	88	62%	0.616	44%	0.439	S	S	*	.	H	α-helix	trans	-60.1	-34.1	175.2	60	-89.6	0	0	0	112.7	G56 L62	G56-H58 PolarHBondContact O-N 2.77Å; H58-L62 WeakPolarHBondContact O-CB 3.39Å; H58-L62 PolarHBondContact O-N 2.87Å
59	R	91.8	Very high	91.6	Very high	78 Å²	78	87.9 Å²	87.9	29%	0.294	44%	0.442	S	S	.	.	H	α-helix	trans	-74.3	-43.1	177	-55.5	-173.6	-179.3	-175.5	-7.7	111.1	G56 L57 L61 L62 Y63	G56-R59 WeakPolarHBondContact O-CA 3.28Å; G56-R59 WeakPolarHBondContact O-CB 3.42Å; G56-R59 PolarHBondContact O-N 3.21Å; L57-R59 VanDerWaalsContact C-N 3.25Å; L57-R59 PolarHBondContact O-N 2.91Å; R59-L61 VanDerWaalsContact C-N 3.31Å; R59-L61 PolarHBondContact O-N 3.18Å; R59-L62 WeakPolarHBondContact O-CB 3.34Å; R59-L62 PolarHBondContact O-N 3.4Å; R59-L62 VanDerWaalsContact O-N 3.17Å; R59-Y63 HydrophobicContact CB-CD2 4.4Å; R59-Y63 HydrophobicContact CB-CE2 4.22Å; R59-Y63 WeakPolarHBondContact O-CD2 3.5Å; R59-Y63 PolarHBondContact O-N 2.97Å
60	H	93	Very high	91.9	Very high	10 Å²	10	80.4 Å²	80.4	5%	0.046	42%	0.423	C	S	.	.	H	α-helix	trans	-57.4	-46.1	174.3	-72.1	-69.7	0	0	0	111.4	G41 N45 A55 G56 L57 L62 Y63 I64	G41-H60 PolarHBondContact O-CE1 3.37Å; N45-H60 PolarHBondContact ND2-NE2 2.9Å; A55-H60 PolarHBondContact O-NE2 2.66Å; G56-H60 PolarHBondContact O-CD2 3.04Å; G56-H60 PolarHBondContact O-N 3.47Å; G56-H60 VanDerWaalsContact O-N 3.13Å; L57-H60 PolarHBondContact O-N 3.04Å; H60-L62 VanDerWaalsContact C-N 3.33Å; H60-L62 PolarHBondContact O-N 3.03Å; H60-Y63 PolarHBondContact O-N 3.43Å; H60-I64 VanDerWaalsContact O-CG1 3.28Å; H60-I64 WeakPolarHBondContact O-CG1 3.38Å; H60-I64 PolarHBondContact O-N 2.87Å
61	L	95.1	Very high	92.2	Very high	109 Å²	109	75.3 Å²	75.3	57%	0.571	40%	0.404	S	S	*	.	H	α-helix	trans	-61.9	-41.5	176.1	-164.9	155.3	0	0	0	111.5	L57 R59 T65	L57-L61 WeakPolarHBondContact O-CB 3.4Å; L57-L61 PolarHBondContact O-N 3.19Å; R59-L61 VanDerWaalsContact C-N 3.31Å; R59-L61 PolarHBondContact O-N 3.18Å; L61-T65 HydrophobicContact CD2-CG2 3.89Å; L61-T65 WeakPolarHBondContact O-CB 3.42Å; L61-T65 WeakPolarHBondContact O-CG2 3.29Å; L61-T65 PolarHBondContact O-N 2.79Å; L61-T65 PolarHBondContact O-OG1 2.95Å
62	L	96.1	Very high	92.6	Very high	106 Å²	106	73.9 Å²	73.9	56%	0.555	39%	0.388	S	S	*	.	H	α-helix	trans	-61.6	-48.4	174.7	-171.6	163.1	0	0	0	111.5	H58 R59 H60 I64 T65 A66	H58-L62 WeakPolarHBondContact O-CB 3.39Å; H58-L62 PolarHBondContact O-N 2.87Å; R59-L62 WeakPolarHBondContact O-CB 3.34Å; R59-L62 PolarHBondContact O-N 3.4Å; R59-L62 VanDerWaalsContact O-N 3.17Å; H60-L62 VanDerWaalsContact C-N 3.33Å; H60-L62 PolarHBondContact O-N 3.03Å; L62-I64 PolarHBondContact O-N 3.03Å; L62-T65 WeakPolarHBondContact CA-OG1 3.28Å; L62-T65 PolarHBondContact O-N 3.45Å; L62-T65 PolarHBondContact O-OG1 3.36Å; L62-A66 HydrophobicContact CD2-CB 4.44Å; L62-A66 WeakPolarHBondContact O-CB 3.48Å; L62-A66 PolarHBondContact O-N 2.86Å
63	Y	96.1	Very high	93.1	Very high	63 Å²	63	76.1 Å²	76.1	25%	0.247	39%	0.391	C	S	.	.	H	α-helix	trans	-60.8	-45.1	179.2	-74.5	-63.5	0	0	0	111.9	G37 D44 R59 H60 F67	G37-Y63 VanDerWaalsContact O-CB 3.3Å; G37-Y63 WeakPolarHBondContact O-CB 3.44Å; D44-Y63 HydrophobicContact CB-CE2 4.33Å; D44-Y63 PolarHBondContact OD2-OH 3.48Å; R59-Y63 HydrophobicContact CB-CD2 4.4Å; R59-Y63 HydrophobicContact CB-CE2 4.22Å; R59-Y63 WeakPolarHBondContact O-CD2 3.5Å; R59-Y63 PolarHBondContact O-N 2.97Å; H60-Y63 PolarHBondContact O-N 3.43Å; Y63-F67 WeakPolarHBondContact O-CB 3.4Å; Y63-F67 VanDerWaalsContact O-CD2 3.29Å; Y63-F67 WeakPolarHBondContact O-CD2 3.24Å; Y63-F67 PolarHBondContact O-N 3.49Å
64	I	96.4	Very high	93.7	Very high	61 Å²	61	74.3 Å²	74.3	31%	0.313	38%	0.382	S	S	.	.	H	α-helix	trans	-61	-50.5	177.5	-66.3	164.2	0	0	0	110.5	Y38 H60 L62 A66 F67 Y68	Y38-I64 HydrophobicContact CD2-CD1 4.08Å; Y38-I64 HydrophobicContact CG-CD1 4.47Å; H60-I64 VanDerWaalsContact O-CG1 3.28Å; H60-I64 WeakPolarHBondContact O-CG1 3.38Å; H60-I64 PolarHBondContact O-N 2.87Å; L62-I64 PolarHBondContact O-N 3.03Å; I64-A66 PolarHBondContact O-N 2.94Å; I64-F67 PolarHBondContact O-N 3.47Å; I64-Y68 WeakPolarHBondContact O-CB 3.21Å; I64-Y68 PolarHBondContact O-N 2.98Å
65	T	97	Very high	94.4	Very high	76 Å²	76	69.6 Å²	69.6	47%	0.466	35%	0.348	S	S	.	.	H	α-helix	trans	-66	-38.7	-177.6	51.5	0	0	0	0	112.4	L61 L62 F69	L61-T65 HydrophobicContact CD2-CG2 3.89Å; L61-T65 WeakPolarHBondContact O-CB 3.42Å; L61-T65 WeakPolarHBondContact O-CG2 3.29Å; L61-T65 PolarHBondContact O-N 2.79Å; L61-T65 PolarHBondContact O-OG1 2.95Å; L62-T65 WeakPolarHBondContact CA-OG1 3.28Å; L62-T65 PolarHBondContact O-N 3.45Å; L62-T65 PolarHBondContact O-OG1 3.36Å; T65-F69 VanDerWaalsContact O-CB 3.28Å; T65-F69 WeakPolarHBondContact O-CB 3.32Å; T65-F69 PolarHBondContact O-N 3Å
66	A	97.4	Very high	94.9	Very high	41 Å²	41	71 Å²	71	34%	0.339	35%	0.351	S	S	.	.	H	α-helix	trans	-64.8	-47.8	175.8	0	0	0	0	0	112	L62 I64 F69 V70	L62-A66 HydrophobicContact CD2-CB 4.44Å; L62-A66 WeakPolarHBondContact O-CB 3.48Å; L62-A66 PolarHBondContact O-N 2.86Å; I64-A66 PolarHBondContact O-N 2.94Å; A66-F69 PolarHBondContact O-N 3.41Å; A66-V70 WeakPolarHBondContact O-CG2 3.43Å; A66-V70 PolarHBondContact O-N 2.92Å
67	F	96.9	Very high	95.3	Very high	79 Å²	79	74.1 Å²	74.1	35%	0.346	36%	0.357	S	S	.	.	H	α-helix	trans	-63.5	-42.7	176.9	-90	-116.6	0	0	0	111.5	I33 L36 A40 Y63 I64 G71	I33-F67 HydrophobicContact CG2-CB 4.12Å; I33-F67 HydrophobicContact CG2-CD1 4.32Å; I33-F67 VanDerWaalsContact CG2-O 3.25Å; I33-F67 WeakPolarHBondContact CG2-O 3.27Å; L36-F67 HydrophobicContact CB-CD1 4.24Å; L36-F67 HydrophobicContact CB-CE1 4.36Å; A40-F67 HydrophobicContact CB-CE2 4.48Å; A40-F67 HydrophobicContact CB-CZ 4.28Å; Y63-F67 WeakPolarHBondContact O-CB 3.4Å; Y63-F67 VanDerWaalsContact O-CD2 3.29Å; Y63-F67 WeakPolarHBondContact O-CD2 3.24Å; Y63-F67 PolarHBondContact O-N 3.49Å; I64-F67 PolarHBondContact O-N 3.47Å; F67-G71 WeakPolarHBondContact O-CA 3.18Å; F67-G71 PolarHBondContact O-N 3.19Å
68	Y	96.4	Very high	95.5	Very high	64 Å²	64	71 Å²	71	25%	0.251	34%	0.339	S	S	.	.	H	α-helix	trans	-62.2	-45	177.3	-168.9	-84.3	0	0	0	111.5	L25 L30 I64 G71 Y72	L25-Y68 VanDerWaalsContact CA-OH 3.27Å; L25-Y68 WeakPolarHBondContact CA-OH 3.37Å; L25-Y68 WeakPolarHBondContact CB-OH 3.29Å; L25-Y68 HydrophobicContact CD2-CE1 4.25Å; L25-Y68 PolarHBondContact O-OH 3.48Å; L30-Y68 HydrophobicContact CD1-CD1 4.48Å; L30-Y68 HydrophobicContact CD1-CD2 4.18Å; L30-Y68 HydrophobicContact CD1-CE2 4.28Å; L30-Y68 HydrophobicContact CD1-CG 4.3Å; L30-Y68 WeakPolarHBondContact CD1-O 3.25Å; L30-Y68 HydrophobicContact CD2-CD1 4.45Å; L30-Y68 HydrophobicContact CD2-CD2 4.36Å; L30-Y68 HydrophobicContact CD2-CE1 3.74Å; L30-Y68 HydrophobicContact CD2-CE2 3.66Å; L30-Y68 VanDerWaalsContact CD2-OH 3.29Å; L30-Y68 WeakPolarHBondContact CD2-OH 3.27Å; L30-Y68 HydrophobicContact CG-CD2 3.81Å; L30-Y68 HydrophobicContact CG-CE1 4.21Å; L30-Y68 HydrophobicContact CG-CE2 3.46Å; L30-Y68 VanDerWaalsContact CG-CE2 3.46Å; L30-Y68 HydrophobicContact CG-CG 4.34Å; I64-Y68 WeakPolarHBondContact O-CB 3.21Å; I64-Y68 PolarHBondContact O-N 2.98Å; Y68-G71 PolarHBondContact O-N 2.83Å; Y68-Y72 WeakPolarHBondContact O-CB 3.44Å; Y68-Y72 PolarHBondContact O-N 3.29Å
69	F	97	Very high	95.5	Very high	128 Å²	128	66.9 Å²	66.9	56%	0.561	32%	0.321	S	S	*	.	H	α-helix	trans	-62.4	-50.8	178.1	-179.3	-98.7	0	0	0	112.1	T65 A66 Y72 Y73	T65-F69 VanDerWaalsContact O-CB 3.28Å; T65-F69 WeakPolarHBondContact O-CB 3.32Å; T65-F69 PolarHBondContact O-N 3Å; A66-F69 PolarHBondContact O-N 3.41Å; F69-Y72 PolarHBondContact O-N 3.17Å; F69-Y73 HydrophobicContact CD1-CE2 4.43Å; F69-Y73 HydrophobicContact CD2-CE2 4.15Å; F69-Y73 HydrophobicContact CE1-CD2 4.32Å; F69-Y73 AromaticContact CE1-CE2 3.95Å; F69-Y73 HydrophobicContact CE1-CE2 3.95Å; F69-Y73 AromaticContact CE2-CE2 3.64Å; F69-Y73 HydrophobicContact CE2-CE2 3.64Å; F69-Y73 HydrophobicContact CZ-CD2 4.34Å; F69-Y73 AromaticContact CZ-CE2 3.53Å; F69-Y73 HydrophobicContact CZ-CE2 3.53Å; F69-Y73 VanDerWaalsContact O-CD2 3.28Å; F69-Y73 WeakPolarHBondContact O-CD2 3.48Å
70	V	97.3	Very high	95.6	Very high	82 Å²	82	64.1 Å²	64.1	50%	0.497	31%	0.311	S	S	.	.	H	α-helix	trans	-64.2	-44.4	178.3	174.7	0	0	0	0	110.6	A66 Y72 Y73 L74	A66-V70 WeakPolarHBondContact O-CG2 3.43Å; A66-V70 PolarHBondContact O-N 2.92Å; V70-Y72 VanDerWaalsContact C-N 3.29Å; V70-Y72 PolarHBondContact O-N 3.45Å; V70-Y73 PolarHBondContact O-N 2.97Å; V70-L74 HydrophobicContact CG1-CD1 3.88Å; V70-L74 HydrophobicContact CG1-CG 4.22Å; V70-L74 WeakPolarHBondContact O-CG 3.45Å; V70-L74 PolarHBondContact O-N 2.94Å
71	G	96.3	Very high	95.4	Very high	1 Å²	1	66.9 Å²	66.9	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-56.4	-40.7	177.9	0	0	0	0	0	113	F67 Y68 Y73 L74 V75	F67-G71 WeakPolarHBondContact O-CA 3.18Å; F67-G71 PolarHBondContact O-N 3.19Å; Y68-G71 PolarHBondContact O-N 2.83Å; G71-Y73 PolarHBondContact O-N 3.06Å; G71-L74 PolarHBondContact O-N 3.4Å; G71-V75 WeakPolarHBondContact O-CG2 3.47Å; G71-V75 PolarHBondContact O-N 3.13Å
72	Y	96.7	Very high	95.3	Very high	55 Å²	55	66.8 Å²	66.8	22%	0.216	32%	0.322	C	S	.	.	H	α-helix	trans	-57.4	-47.2	177.6	-178.2	-94.3	0	0	0	112.4	P23 L30 Y68 F69 V70 K76	P23-Y72 HydrophobicContact CG-CD2 4.06Å; P23-Y72 HydrophobicContact CG-CE2 3.74Å; P23-Y72 WeakPolarHBondContact O-CE2 3.34Å; L30-Y72 HydrophobicContact CD2-CD2 3.95Å; Y68-Y72 WeakPolarHBondContact O-CB 3.44Å; Y68-Y72 PolarHBondContact O-N 3.29Å; F69-Y72 PolarHBondContact O-N 3.17Å; V70-Y72 VanDerWaalsContact C-N 3.29Å; V70-Y72 PolarHBondContact O-N 3.45Å; Y72-K76 WeakPolarHBondContact O-CB 3.06Å; Y72-K76 PolarHBondContact O-N 3.21Å
73	Y	95.5	Very high	95.2	Very high	98 Å²	98	63.4 Å²	63.4	38%	0.384	31%	0.309	S	S	.	.	H	α-helix	trans	-71.5	-33.1	178.4	-72.1	-77.4	0	0	0	112.7	F12 L13 F69 V70 G71 R77	F12-Y73 WeakPolarHBondContact CE1-O 3.46Å; L13-Y73 HydrophobicContact CD1-CD1 4.1Å; F69-Y73 HydrophobicContact CD1-CE2 4.43Å; F69-Y73 HydrophobicContact CD2-CE2 4.15Å; F69-Y73 HydrophobicContact CE1-CD2 4.32Å; F69-Y73 AromaticContact CE1-CE2 3.95Å; F69-Y73 HydrophobicContact CE1-CE2 3.95Å; F69-Y73 AromaticContact CE2-CE2 3.64Å; F69-Y73 HydrophobicContact CE2-CE2 3.64Å; F69-Y73 HydrophobicContact CZ-CD2 4.34Å; F69-Y73 AromaticContact CZ-CE2 3.53Å; F69-Y73 HydrophobicContact CZ-CE2 3.53Å; F69-Y73 VanDerWaalsContact O-CD2 3.28Å; F69-Y73 WeakPolarHBondContact O-CD2 3.48Å; V70-Y73 PolarHBondContact O-N 2.97Å; G71-Y73 PolarHBondContact O-N 3.06Å; Y73-R77 WeakPolarHBondContact O-CB 3.29Å; Y73-R77 PolarHBondContact O-N 3.04Å
74	L	95.7	Very high	94.9	Very high	94 Å²	94	61.7 Å²	61.7	49%	0.492	31%	0.305	S	S	.	.	H	α-helix	trans	-65.5	-48.3	175.1	-70.6	176.8	0	0	0	111.6	F12 V70 G71 K76 R77 E78	F12-L74 HydrophobicContact CZ-CD2 4.32Å; V70-L74 HydrophobicContact CG1-CD1 3.88Å; V70-L74 HydrophobicContact CG1-CG 4.22Å; V70-L74 WeakPolarHBondContact O-CG 3.45Å; V70-L74 PolarHBondContact O-N 2.94Å; G71-L74 PolarHBondContact O-N 3.4Å; L74-K76 VanDerWaalsContact C-N 3.33Å; L74-K76 PolarHBondContact O-N 2.88Å; L74-R77 WeakPolarHBondContact O-CB 3.3Å; L74-R77 PolarHBondContact O-N 3.28Å; L74-R77 VanDerWaalsContact O-N 3.13Å; L74-E78 WeakPolarHBondContact O-CB 3.39Å; L74-E78 PolarHBondContact O-N 3.24Å
75	V	95.9	Very high	94.7	Very high	5 Å²	5	63.3 Å²	63.3	3%	0.03	31%	0.307	C	S	.	.	H	α-helix	trans	-61	-43.8	176.8	172.3	0	0	0	0	110.5	P23 R29 I33 G71 R77 E78 D79	P23-V75 HydrophobicContact CB-CG1 3.89Å; P23-V75 HydrophobicContact CG-CG1 4.14Å; R29-V75 HydrophobicContact CB-CG2 4.38Å; R29-V75 VanDerWaalsContact CZ-CG1 3.47Å; R29-V75 VanDerWaalsContact NH2-CG1 3.34Å; I33-V75 HydrophobicContact CD1-CG2 4Å; G71-V75 WeakPolarHBondContact O-CG2 3.47Å; G71-V75 PolarHBondContact O-N 3.13Å; V75-R77 VanDerWaalsContact C-N 3.27Å; V75-R77 PolarHBondContact O-N 3.16Å; V75-E78 WeakPolarHBondContact O-CB 3.4Å; V75-E78 PolarHBondContact O-N 3.05Å; V75-E78 VanDerWaalsContact O-N 3.17Å; V75-D79 PolarHBondContact O-N 3.45Å
76	K	94.7	Very high	94.6	Very high	50 Å²	50	62.2 Å²	62.2	22%	0.217	30%	0.298	C	S	.	.	H	α-helix	trans	-59.6	-37.9	175.8	-173.7	172.5	179	175.1	0	112.7	L13 P23 Y72 L74 Y80	L13-K76 HydrophobicContact CD1-CB 4.47Å; L13-K76 HydrophobicContact CD1-CD 3.77Å; L13-K76 HydrophobicContact CD1-CG 4.04Å; L13-K76 HydrophobicContact CD2-CD 4.48Å; L13-K76 HydrophobicContact CD2-CG 3.99Å; P23-K76 HydrophobicContact CG-CB 4.36Å; Y72-K76 WeakPolarHBondContact O-CB 3.06Å; Y72-K76 PolarHBondContact O-N 3.21Å; L74-K76 VanDerWaalsContact C-N 3.33Å; L74-K76 PolarHBondContact O-N 2.88Å; K76-Y80 PolarHBondContact O-N 3.46Å
77	R	92.3	Very high	94.3	Very high	82 Å²	82	65.9 Å²	65.9	31%	0.309	30%	0.303	S	S	.	.	H	α-helix	trans	-71.8	-39.7	176.3	179.9	175.8	178	164.3	6.7	111.9	F12 L13 Y73 L74 V75 Y80 T81	F12-R77 HydrophobicContact CE1-CB 3.95Å; F12-R77 HydrophobicContact CZ-CB 3.93Å; F12-R77 HydrophobicContact CZ-CG 4.35Å; L13-R77 HydrophobicContact CD2-CB 4.27Å; Y73-R77 WeakPolarHBondContact O-CB 3.29Å; Y73-R77 PolarHBondContact O-N 3.04Å; L74-R77 WeakPolarHBondContact O-CB 3.3Å; L74-R77 PolarHBondContact O-N 3.28Å; L74-R77 VanDerWaalsContact O-N 3.13Å; V75-R77 VanDerWaalsContact C-N 3.27Å; V75-R77 PolarHBondContact O-N 3.16Å; R77-Y80 PolarHBondContact O-N 3.47Å; R77-T81 WeakPolarHBondContact O-CG2 3.46Å; R77-T81 PolarHBondContact O-N 2.91Å; R77-T81 PolarHBondContact O-OG1 3.38Å
78	E	93.7	Very high	94.1	Very high	77 Å²	77	64.9 Å²	64.9	36%	0.36	30%	0.3	S	S	.	.	H	α-helix	trans	-58.5	-52.6	175.6	179.6	-178.4	-152.2	0	0	110.6	R29 L74 V75 Y80 T81 Y82	R29-E78 IonicContact NH1-OE2 3.04Å; L74-E78 WeakPolarHBondContact O-CB 3.39Å; L74-E78 PolarHBondContact O-N 3.24Å; V75-E78 WeakPolarHBondContact O-CB 3.4Å; V75-E78 PolarHBondContact O-N 3.05Å; V75-E78 VanDerWaalsContact O-N 3.17Å; E78-Y80 VanDerWaalsContact C-N 3.25Å; E78-Y80 PolarHBondContact O-N 3.04Å; E78-T81 WeakPolarHBondContact CA-OG1 3.38Å; E78-T81 PolarHBondContact O-N 3.34Å; E78-T81 PolarHBondContact O-OG1 2.85Å; E78-Y82 HydrophobicContact CG-CD2 3.72Å; E78-Y82 HydrophobicContact CG-CE2 3.39Å; E78-Y82 VanDerWaalsContact O-CD2 3.28Å; E78-Y82 WeakPolarHBondContact O-CD2 3.48Å; E78-Y82 PolarHBondContact O-N 3.32Å
79	D	94.5	Very high	93.9	Very high	45 Å²	45	66.2 Å²	66.2	24%	0.241	31%	0.309	C	S	.	.	H	α-helix	trans	-57.8	-40.5	178.3	-67.9	-19.4	0	0	0	111.1	R29 V75 Y82 A83	R29-D79 IonicContact CZ-OD1 3.18Å; R29-D79 IonicContact CZ-OD2 3.36Å; R29-D79 IonicContact NH1-OD1 2.91Å; R29-D79 PolarHBondContact NH1-OD1 2.95Å; R29-D79 IonicContact NH1-OD2 2.8Å; R29-D79 IonicContact NH2-OD1 3.4Å; R29-D79 PolarHBondContact NH2-OD1 2.9Å; R29-D79 IonicContact NH2-OD2 3.87Å; R29-D79 PolarHBondContact NH2-OD2 3.28Å; R29-D79 VanDerWaalsContact NH2-OD2 3.11Å; V75-D79 PolarHBondContact O-N 3.45Å; D79-Y82 PolarHBondContact O-N 3.18Å; D79-A83 WeakPolarHBondContact O-CB 3.49Å; D79-A83 PolarHBondContact O-N 3.36Å
80	Y	92.6	Very high	93.8	Very high	20 Å²	20	66.2 Å²	66.2	8%	0.078	31%	0.309	C	S	.	.	H	α-helix	trans	-62.2	-45.1	173.7	175.7	-104.1	0	0	0	112.9	P14 S17 L20 K76 R77 E78 Y82 A83 V84	P14-Y80 HydrophobicContact CG-CD1 4.24Å; P14-Y80 HydrophobicContact CG-CE1 3.44Å; P14-Y80 VanDerWaalsContact CG-CE1 3.44Å; P14-Y80 HydrophobicContact CG-CE2 3.77Å; P14-Y80 WeakPolarHBondContact CG-OH 3.32Å; S17-Y80 VanDerWaalsContact CB-CD2 3.5Å; L20-Y80 HydrophobicContact CD1-CD2 3.89Å; L20-Y80 HydrophobicContact CD1-CG 4.48Å; K76-Y80 PolarHBondContact O-N 3.46Å; R77-Y80 PolarHBondContact O-N 3.47Å; E78-Y80 VanDerWaalsContact C-N 3.25Å; E78-Y80 PolarHBondContact O-N 3.04Å; Y80-Y82 VanDerWaalsContact C-N 3.33Å; Y80-Y82 PolarHBondContact O-N 3.31Å; Y80-A83 PolarHBondContact O-N 3.45Å; Y80-V84 HydrophobicContact CD1-CG2 4.38Å; Y80-V84 HydrophobicContact CD2-CG2 4.22Å; Y80-V84 HydrophobicContact CE1-CG2 3.81Å; Y80-V84 HydrophobicContact CE2-CG2 3.64Å; Y80-V84 WeakPolarHBondContact O-CG2 3.42Å; Y80-V84 PolarHBondContact O-N 2.78Å
81	T	90.3	Very high	93.6	Very high	69 Å²	69	63.8 Å²	63.8	42%	0.423	30%	0.301	S	S	.	.	H	α-helix	trans	-63.7	-38.6	-179.6	51.3	0	0	0	0	112.7	R77 E78 R85	R77-T81 WeakPolarHBondContact O-CG2 3.46Å; R77-T81 PolarHBondContact O-N 2.91Å; R77-T81 PolarHBondContact O-OG1 3.38Å; E78-T81 WeakPolarHBondContact CA-OG1 3.38Å; E78-T81 PolarHBondContact O-N 3.34Å; E78-T81 PolarHBondContact O-OG1 2.85Å; T81-R85 PolarHBondContact O-N 3.11Å
82	Y	92.9	Very high	93.5	Very high	107 Å²	107	69.1 Å²	69.1	42%	0.42	32%	0.322	S	S	.	.	H	α-helix	trans	-70.6	-39.1	175.5	-71.9	-59	0	0	0	112.2	E78 D79 Y80 V84 R85 D86	E78-Y82 HydrophobicContact CG-CD2 3.72Å; E78-Y82 HydrophobicContact CG-CE2 3.39Å; E78-Y82 VanDerWaalsContact O-CD2 3.28Å; E78-Y82 WeakPolarHBondContact O-CD2 3.48Å; E78-Y82 PolarHBondContact O-N 3.32Å; D79-Y82 PolarHBondContact O-N 3.18Å; Y80-Y82 VanDerWaalsContact C-N 3.33Å; Y80-Y82 PolarHBondContact O-N 3.31Å; Y82-V84 VanDerWaalsContact C-N 3.33Å; Y82-V84 PolarHBondContact O-N 3.27Å; Y82-R85 VanDerWaalsContact CD1-CZ 3.48Å; Y82-R85 WeakPolarHBondContact O-CB 3.28Å; Y82-R85 PolarHBondContact O-N 3.35Å; Y82-D86 PolarHBondContact O-N 3.36Å
83	A	92.9	Very high	93.4	Very high	35 Å²	35	70.1 Å²	70.1	29%	0.289	33%	0.329	S	S	.	.	H	α-helix	trans	-60.7	-41.7	174.2	0	0	0	0	0	112.3	L20 D79 Y80 D86 R87	L20-A83 HydrophobicContact CD1-CB 3.68Å; L20-A83 HydrophobicContact CD2-CB 3.82Å; L20-A83 HydrophobicContact CG-CB 4.41Å; D79-A83 WeakPolarHBondContact O-CB 3.49Å; D79-A83 PolarHBondContact O-N 3.36Å; Y80-A83 PolarHBondContact O-N 3.45Å; A83-D86 PolarHBondContact O-N 2.88Å; A83-R87 WeakPolarHBondContact O-CB 3.35Å; A83-R87 PolarHBondContact O-N 3.13Å
84	V	91.1	Very high	93.3	Very high	26 Å²	26	74.1 Å²	74.1	16%	0.158	35%	0.349	C	S	.	.	H	α-helix	trans	-64	-44.5	175.5	171.8	0	0	0	0	111.1	Y80 Y82 D86 R87 E88	Y80-V84 HydrophobicContact CD1-CG2 4.38Å; Y80-V84 HydrophobicContact CD2-CG2 4.22Å; Y80-V84 HydrophobicContact CE1-CG2 3.81Å; Y80-V84 HydrophobicContact CE2-CG2 3.64Å; Y80-V84 WeakPolarHBondContact O-CG2 3.42Å; Y80-V84 PolarHBondContact O-N 2.78Å; Y82-V84 VanDerWaalsContact C-N 3.33Å; Y82-V84 PolarHBondContact O-N 3.27Å; V84-D86 VanDerWaalsContact C-N 3.33Å; V84-D86 PolarHBondContact O-N 3.41Å; V84-R87 PolarHBondContact O-N 3.09Å; V84-E88 HydrophobicContact CG1-CG 4.43Å; V84-E88 WeakPolarHBondContact O-CG 3.44Å; V84-E88 PolarHBondContact O-N 3.08Å
85	R	91.6	Very high	93.3	Very high	95 Å²	95	75.8 Å²	75.8	36%	0.358	36%	0.358	S	S	.	.	H	α-helix	trans	-55.3	-50.3	176.2	175	-171.1	75.9	-179	1.6	111.1	M1 T81 Y82 E88 M89	M1-R85 HydrophobicContact CE-CB 4.27Å; M1-R85 VanDerWaalsContact CE-CD 3.48Å; M1-R85 HydrophobicContact CE-CG 3.4Å; M1-R85 VanDerWaalsContact CE-CG 3.4Å; M1-R85 HydrophobicContact SD-CB 4.17Å; M1-R85 HydrophobicContact SD-CG 3.94Å; T81-R85 PolarHBondContact O-N 3.11Å; Y82-R85 VanDerWaalsContact CD1-CZ 3.48Å; Y82-R85 WeakPolarHBondContact O-CB 3.28Å; Y82-R85 PolarHBondContact O-N 3.35Å; R85-E88 PolarHBondContact O-N 3.13Å; R85-M89 WeakPolarHBondContact O-CB 3.47Å; R85-M89 PolarHBondContact O-N 3.32Å
86	D	94.1	Very high	93.2	Very high	53 Å²	53	78.6 Å²	78.6	28%	0.283	37%	0.37	S	S	.	.	H	α-helix	trans	-68.9	-38.2	-175.3	-65.6	-2	0	0	0	110.5	Y82 A83 V84 E88 M89 F90	Y82-D86 PolarHBondContact O-N 3.36Å; A83-D86 PolarHBondContact O-N 2.88Å; V84-D86 VanDerWaalsContact C-N 3.33Å; V84-D86 PolarHBondContact O-N 3.41Å; D86-E88 PolarHBondContact O-N 3.47Å; D86-M89 PolarHBondContact O-N 2.93Å; D86-F90 HydrophobicContact CB-CD2 4.48Å; D86-F90 HydrophobicContact CB-CE2 4.22Å; D86-F90 WeakPolarHBondContact O-CD2 3.49Å; D86-F90 WeakPolarHBondContact O-CG 3.39Å; D86-F90 PolarHBondContact O-N 3.33Å
87	R	92.2	Very high	93.2	Very high	118 Å²	118	80.1 Å²	80.1	45%	0.445	39%	0.385	S	S	.	.	H	α-helix	trans	-57.5	-45.4	171.5	-175.6	-173.5	71.8	174.6	-2.6	112.1	E16 A83 V84 G91	E16-R87 IonicContact OE1-CZ 3.92Å; E16-R87 IonicContact OE1-NH1 2.67Å; E16-R87 PolarHBondContact OE1-NH1 3.04Å; E16-R87 IonicContact OE2-CZ 3.71Å; E16-R87 IonicContact OE2-NH1 3.49Å; E16-R87 PolarHBondContact OE2-NH1 2.95Å; E16-R87 IonicContact OE2-NH2 3.91Å; A83-R87 WeakPolarHBondContact O-CB 3.35Å; A83-R87 PolarHBondContact O-N 3.13Å; V84-R87 PolarHBondContact O-N 3.09Å; R87-G91 PolarHBondContact O-N 3.16Å
88	E	91.5	Very high	93.2	Very high	58 Å²	58	82.3 Å²	82.3	27%	0.271	40%	0.399	S	S	.	.	H	α-helix	trans	-67.6	-42.8	179.1	-73.2	-174.5	162.3	0	0	111.9	R4 V84 R85 D86 G91 Y92	R4-E88 VanDerWaalsContact CD-OE1 3.28Å; R4-E88 WeakPolarHBondContact CD-OE1 3.47Å; R4-E88 IonicContact NH1-OE1 3.9Å; V84-E88 HydrophobicContact CG1-CG 4.43Å; V84-E88 WeakPolarHBondContact O-CG 3.44Å; V84-E88 PolarHBondContact O-N 3.08Å; R85-E88 PolarHBondContact O-N 3.13Å; D86-E88 PolarHBondContact O-N 3.47Å; E88-G91 PolarHBondContact O-N 3.39Å; E88-Y92 WeakPolarHBondContact O-CB 3.46Å; E88-Y92 PolarHBondContact O-N 3.17Å
89	M	92.6	Very high	93.2	Very high	92 Å²	92	83.2 Å²	83.2	45%	0.453	41%	0.407	S	S	.	.	H	α-helix	trans	-59.4	-51.4	176.8	-177	178.6	67	0	0	111.2	R85 D86 G91 Y92 M93	R85-M89 WeakPolarHBondContact O-CB 3.47Å; R85-M89 PolarHBondContact O-N 3.32Å; D86-M89 PolarHBondContact O-N 2.93Å; M89-G91 VanDerWaalsContact C-N 3.33Å; M89-G91 PolarHBondContact O-N 3.17Å; M89-Y92 PolarHBondContact O-N 3.44Å; M89-M93 HydrophobicContact CG-SD 4.38Å; M89-M93 WeakPolarHBondContact O-CG 3.5Å; M89-M93 PolarHBondContact O-N 3.46Å
90	F	94.9	Very high	93	Very high	128 Å²	128	85.6 Å²	85.6	56%	0.561	42%	0.415	S	S	*	.	H	α-helix	trans	-66.7	-35.8	178	-66.9	-49.3	0	0	0	112.6	D86 Y92 M93 K94	D86-F90 HydrophobicContact CB-CD2 4.48Å; D86-F90 HydrophobicContact CB-CE2 4.22Å; D86-F90 WeakPolarHBondContact O-CD2 3.49Å; D86-F90 WeakPolarHBondContact O-CG 3.39Å; D86-F90 PolarHBondContact O-N 3.33Å; F90-Y92 VanDerWaalsContact C-N 3.35Å; F90-M93 HydrophobicContact CD1-SD 4.35Å; F90-K94 WeakPolarHBondContact O-CB 3.31Å; F90-K94 PolarHBondContact O-N 3.36Å
91	G	93.9	Very high	92.8	Very high	32 Å²	32	88.8 Å²	88.8	33%	0.33	44%	0.44	S	S	.	.	H	α-helix	trans	-60	-44.9	173.1	0	0	0	0	0	112	R87 E88 M89 K94 L95	R87-G91 PolarHBondContact O-N 3.16Å; E88-G91 PolarHBondContact O-N 3.39Å; M89-G91 VanDerWaalsContact C-N 3.33Å; M89-G91 PolarHBondContact O-N 3.17Å; G91-K94 PolarHBondContact O-N 3.21Å; G91-L95 VanDerWaalsContact O-CG 3.27Å; G91-L95 WeakPolarHBondContact O-CG 3.49Å; G91-L95 PolarHBondContact O-N 2.95Å; G91-L95 VanDerWaalsContact O-N 3.13Å
92	Y	93.5	Very high	92.6	Very high	113 Å²	113	94.8 Å²	94.8	44%	0.443	46%	0.463	S	S	.	.	H	α-helix	trans	-64.4	-48.8	177.5	-175	-97.4	0	0	0	111.9	E88 M89 F90 K94 L95 H96 F100	E88-Y92 WeakPolarHBondContact O-CB 3.46Å; E88-Y92 PolarHBondContact O-N 3.17Å; M89-Y92 PolarHBondContact O-N 3.44Å; F90-Y92 VanDerWaalsContact C-N 3.35Å; Y92-K94 PolarHBondContact O-N 3.46Å; Y92-L95 PolarHBondContact O-N 2.93Å; Y92-H96 AromaticContact CE2-CD2 3.56Å; Y92-H96 AromaticContact CE2-NE2 3.72Å; Y92-H96 AromaticContact CZ-CD2 3.47Å; Y92-H96 VanDerWaalsContact CZ-CD2 3.47Å; Y92-H96 PolarHBondContact O-N 2.91Å; Y92-H96 PolarHBondContact OH-CD2 3.01Å; Y92-F100 AromaticContact CD1-CE2 3.71Å; Y92-F100 HydrophobicContact CD1-CE2 3.71Å; Y92-F100 HydrophobicContact CD1-CZ 4.06Å; Y92-F100 AromaticContact CE1-CE2 3.67Å; Y92-F100 HydrophobicContact CE1-CE2 3.67Å; Y92-F100 HydrophobicContact CE1-CZ 4Å
93	M	94.1	Very high	92.4	Very high	75 Å²	75	98.3 Å²	98.3	37%	0.369	48%	0.481	S	S	.	.	H	α-helix	trans	-57.6	-37.8	177.5	-69.7	176	68.5	0	0	112.6	M89 F90 H96 F100	M89-M93 HydrophobicContact CG-SD 4.38Å; M89-M93 WeakPolarHBondContact O-CG 3.5Å; M89-M93 PolarHBondContact O-N 3.46Å; F90-M93 HydrophobicContact CD1-SD 4.35Å; M93-H96 CarbonylContact O-C 3.41Å; M93-F100 HydrophobicContact CB-CD2 4.16Å; M93-F100 HydrophobicContact CB-CE2 4.39Å; M93-F100 HydrophobicContact CE-CD1 4.38Å; M93-F100 HydrophobicContact CE-CG 4.44Å; M93-F100 HydrophobicContact CG-CD1 4.31Å; M93-F100 HydrophobicContact CG-CD2 3.94Å; M93-F100 HydrophobicContact CG-CE1 4.24Å; M93-F100 HydrophobicContact CG-CE2 3.87Å; M93-F100 HydrophobicContact CG-CG 4.17Å; M93-F100 HydrophobicContact CG-CZ 4.03Å
94	K	94.1	Very high	92.2	Very high	182 Å²	182	105.3 Å²	105.3	79%	0.791	51%	0.507	S	S	*	.	H	α-helix	trans	-70.7	-32.2	177.7	-174.9	175.1	-179.7	179.5	0	112.8	F90 G91 Y92	F90-K94 WeakPolarHBondContact O-CB 3.31Å; F90-K94 PolarHBondContact O-N 3.36Å; G91-K94 PolarHBondContact O-N 3.21Å; Y92-K94 PolarHBondContact O-N 3.46Å
95	L	95.5	Very high	92.1	Very high	130 Å²	130	113.8 Å²	113.8	68%	0.681	54%	0.542	S	S	*	.	H	α-helix	trans	-77.1	-28	178.7	-71.5	168.5	0	0	0	112.4	G91 Y92 P97	G91-L95 VanDerWaalsContact O-CG 3.27Å; G91-L95 WeakPolarHBondContact O-CG 3.49Å; G91-L95 PolarHBondContact O-N 2.95Å; G91-L95 VanDerWaalsContact O-N 3.13Å; Y92-L95 PolarHBondContact O-N 2.93Å; L95-P97 VanDerWaalsContact C-CD 3.42Å; L95-P97 WeakPolarHBondContact O-CD 3.31Å
96	H	94.6	Very high	92	Very high	63 Å²	63	115.8 Å²	115.8	29%	0.292	55%	0.553	S	S	.	*			trans	-125.8	65.1	-174.9	-59.9	3.7	0	0	0	111	Y92 M93 E98 D99 F100	Y92-H96 AromaticContact CE2-CD2 3.56Å; Y92-H96 AromaticContact CE2-NE2 3.72Å; Y92-H96 AromaticContact CZ-CD2 3.47Å; Y92-H96 VanDerWaalsContact CZ-CD2 3.47Å; Y92-H96 PolarHBondContact O-N 2.91Å; Y92-H96 PolarHBondContact OH-CD2 3.01Å; M93-H96 CarbonylContact O-C 3.41Å; H96-E98 IonicContact CG-OE1 2.73Å; H96-E98 PolarHBondContact O-N 3.39Å; H96-D99 HydrophobicContact CB-CB 4.39Å; H96-D99 IonicContact CD2-OD2 3.66Å; H96-D99 PolarHBondContact O-N 3.08Å; H96-F100 WeakPolarHBondContact O-CD2 3.49Å
97	P	93.4	Very high	92	Very high	82 Å²	82	117 Å²	117	53%	0.532	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.4	-24.1	178.8	26.9	-35.6	0	0	0	113.4	L95 D99 F100	L95-P97 VanDerWaalsContact C-CD 3.42Å; L95-P97 WeakPolarHBondContact O-CD 3.31Å; P97-D99 VanDerWaalsContact C-N 3.35Å; P97-F100 CarbonylContact O-C 3.59Å; P97-F100 VanDerWaalsContact O-C 3.31Å; P97-F100 PolarHBondContact O-N 3.46Å
98	E	92.4	Very high	91.9	Very high	128 Å²	128	120.2 Å²	120.2	60%	0.598	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-36.4	176.3	61.1	-79.5	-174.7	0	0	113.5	H96 F100	H96-E98 IonicContact CG-OE1 2.73Å; H96-E98 PolarHBondContact O-N 3.39Å; E98-F100 VanDerWaalsContact C-N 3.31Å
99	D	94.2	Very high	91.7	Very high	97 Å²	97	122.2 Å²	122.2	52%	0.519	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.8	-25.9	178.1	-71.3	-18.2	0	0	0	111.4	H96 P97	H96-D99 HydrophobicContact CB-CB 4.39Å; H96-D99 IonicContact CD2-OD2 3.66Å; H96-D99 PolarHBondContact O-N 3.08Å; P97-D99 VanDerWaalsContact C-N 3.35Å
100	F	91.4	Very high	91.6	Very high	95 Å²	95	123.9 Å²	123.9	42%	0.417	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-120.4	57.6	-173.6	-58.8	-79.6	0	0	0	112.1	Y92 M93 H96 P97 E98 E102	Y92-F100 AromaticContact CD1-CE2 3.71Å; Y92-F100 HydrophobicContact CD1-CE2 3.71Å; Y92-F100 HydrophobicContact CD1-CZ 4.06Å; Y92-F100 AromaticContact CE1-CE2 3.67Å; Y92-F100 HydrophobicContact CE1-CE2 3.67Å; Y92-F100 HydrophobicContact CE1-CZ 4Å; M93-F100 HydrophobicContact CB-CD2 4.16Å; M93-F100 HydrophobicContact CB-CE2 4.39Å; M93-F100 HydrophobicContact CE-CD1 4.38Å; M93-F100 HydrophobicContact CE-CG 4.44Å; M93-F100 HydrophobicContact CG-CD1 4.31Å; M93-F100 HydrophobicContact CG-CD2 3.94Å; M93-F100 HydrophobicContact CG-CE1 4.24Å; M93-F100 HydrophobicContact CG-CE2 3.87Å; M93-F100 HydrophobicContact CG-CG 4.17Å; M93-F100 HydrophobicContact CG-CZ 4.03Å; H96-F100 WeakPolarHBondContact O-CD2 3.49Å; P97-F100 CarbonylContact O-C 3.59Å; P97-F100 VanDerWaalsContact O-C 3.31Å; P97-F100 PolarHBondContact O-N 3.46Å; E98-F100 VanDerWaalsContact C-N 3.31Å; F100-E102 PolarHBondContact O-N 2.86Å
101	S	87.5	Confident	91.3	Very high	86 Å²	86	121.2 Å²	121.2	60%	0.601	60%	0.6	S	S	*	*			trans	-63.7	135.1	174.4	54.4	0	0	0	0	112.1	K103	S101-K103 PolarHBondContact O-N 3.02Å; S101-K103 VanDerWaalsContact O-N 3.11Å
102	E	86.6	Confident	91.2	Very high	196 Å²	196	129.3 Å²	129.3	92%	0.916	63%	0.627	S	S	*	*			trans	-67.1	110.4	173	-70.5	-168.7	172.9	0	0	109.4	F100	F100-E102 PolarHBondContact O-N 2.86Å
103	K	87.5	Confident	91.1	Very high	181 Å²	181	130.2 Å²	130.2	79%	0.787	64%	0.635	S	S	*	*			trans	-76.6	133.6	173.9	-64.3	-178.2	-177.9	177.2	0	109.4	S101 K105	S101-K103 PolarHBondContact O-N 3.02Å; S101-K103 VanDerWaalsContact O-N 3.11Å; K103-K105 PolarHBondContact O-N 3.5Å
104	E	88.4	Confident	90.9	Very high	182 Å²	182	134.4 Å²	134.4	85%	0.85	65%	0.651	S	S	*	*			trans	-57	122.5	171.6	-68.4	-177.5	173.7	0	0	110.1	K106	E104-K106 PolarHBondContact O-N 3.33Å
105	K	89.9	Confident	90.9	Very high	204 Å²	204	134 Å²	134	89%	0.887	65%	0.65	S	S	*	*			trans	-80.4	97.9	178.8	-64.9	178.1	-176.5	173.4	0	108.7	K103	K103-K105 PolarHBondContact O-N 3.5Å
106	K	90.6	Very high	90.7	Very high	136 Å²	136	134.3 Å²	134.3	59%	0.591	65%	0.647	S	S	*	*			trans	-66.9	140.5	174.6	-60.5	-169.3	178.4	-172.8	0	110.9	E104 E110 I111	E104-K106 PolarHBondContact O-N 3.33Å; K106-E110 HydrophobicContact CB-CB 4.46Å; K106-I111 HydrophobicContact CB-CD1 4.18Å; K106-I111 HydrophobicContact CB-CG1 4.14Å
107	T	92.1	Very high	90.6	Very high	78 Å²	78	134.4 Å²	134.4	48%	0.479	65%	0.653	S	S	.	*			trans	-77.4	156.2	176.3	62.6	0	0	0	0	110.8	A109 E110 I111	T107-A109 PolarHBondContact O-N 3.2Å; T107-E110 PolarHBondContact O-N 2.98Å; T107-E110 PolarHBondContact OG1-OE1 3.23Å; T107-I111 PolarHBondContact O-N 3.09Å
108	Y	90.3	Very high	90.3	Very high	187 Å²	187	139.1 Å²	139.1	73%	0.733	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-14.1	174.9	-77.4	-77.4	0	0	0	113.6	E110	Y108-E110 VanDerWaalsContact C-N 3.27Å
109	A	88.9	Confident	89.7	Confident	99 Å²	99	146.9 Å²	146.9	82%	0.818	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	-28.2	170.7	0	0	0	0	0	112.5	T107	T107-A109 PolarHBondContact O-N 3.2Å
110	E	89.7	Confident	89.4	Confident	128 Å²	128	149.4 Å²	149.4	60%	0.598	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-17.3	179.7	-64.8	161.8	-135.7	0	0	112.8	K106 T107 Y108	K106-E110 HydrophobicContact CB-CB 4.46Å; T107-E110 PolarHBondContact O-N 2.98Å; T107-E110 PolarHBondContact OG1-OE1 3.23Å; Y108-E110 VanDerWaalsContact C-N 3.27Å
111	I	89.2	Confident	89.3	Confident	72 Å²	72	152.2 Å²	152.2	37%	0.369	72%	0.72	S	S	.	*			trans	-98.7	113.6	-175.8	-57.3	170.3	0	0	0	109	K106 T107 E113	K106-I111 HydrophobicContact CB-CD1 4.18Å; K106-I111 HydrophobicContact CB-CG1 4.14Å; T107-I111 PolarHBondContact O-N 3.09Å; I111-E113 HydrophobicContact CG2-CG 4.09Å
112	F	91.4	Very high	89.4	Confident	202 Å²	202	155.9 Å²	155.9	89%	0.886	73%	0.726	S	S	*	*			trans	-95.6	103	173.8	-168.5	-101.8	0	0	0	110.9
113	E	90.6	Very high	89.6	Confident	131 Å²	131	153.5 Å²	153.5	61%	0.612	72%	0.715	S	S	*	*			trans	-86.2	141.7	174	-65.3	-175.9	-178.1	0	0	111.1	I111 F115	I111-E113 HydrophobicContact CG2-CG 4.09Å; E113-F115 PolarHBondContact O-N 3.06Å
114	K	90.9	Very high	89.7	Confident	163 Å²	163	151.8 Å²	151.8	71%	0.709	71%	0.711	S	S	*	*			trans	-74.8	112.8	177.1	-174.1	175.6	177.9	-180	0	109.8	H116	K114-H116 WeakPolarHBondContact CD-NE2 3.25Å; K114-H116 PolarHBondContact O-CD2 3.3Å; K114-H116 PolarHBondContact O-N 3.44Å
115	F	93.1	Very high	89.8	Confident	175 Å²	175	149.8 Å²	149.8	77%	0.768	70%	0.702	S	S	*	*			trans	-73.8	123.7	175	-178	-111.7	0	0	0	111.5	E113 P117	E113-F115 PolarHBondContact O-N 3.06Å; F115-P117 HydrophobicContact CD1-CB 4.38Å; F115-P117 HydrophobicContact CD1-CG 4.49Å; F115-P117 HydrophobicContact CE1-CB 3.69Å; F115-P117 HydrophobicContact CE1-CG 4.25Å; F115-P117 HydrophobicContact CZ-CB 4.23Å; F115-P117 WeakPolarHBondContact O-CD 3.45Å
116	H	92.1	Very high	89.8	Confident	136 Å²	136	145.9 Å²	145.9	63%	0.63	69%	0.688	S	S	*	*			trans	-109.7	97.2	174.5	-74.8	-82.9	0	0	0	109.6	K114	K114-H116 WeakPolarHBondContact CD-NE2 3.25Å; K114-H116 PolarHBondContact O-CD2 3.3Å; K114-H116 PolarHBondContact O-N 3.44Å
117	P	93.3	Very high	89.7	Confident	65 Å²	65	146.7 Å²	146.7	42%	0.422	70%	0.696	S	S	.	*			trans	-67.6	138.5	179.3	25.5	-31.7	0	0	0	111.1	F115 R119	F115-P117 HydrophobicContact CD1-CB 4.38Å; F115-P117 HydrophobicContact CD1-CG 4.49Å; F115-P117 HydrophobicContact CE1-CB 3.69Å; F115-P117 HydrophobicContact CE1-CG 4.25Å; F115-P117 HydrophobicContact CZ-CB 4.23Å; F115-P117 WeakPolarHBondContact O-CD 3.45Å; P117-R119 PolarHBondContact O-N 3.05Å
118	I	85.9	Confident	89.5	Confident	180 Å²	180	152.4 Å²	152.4	92%	0.923	71%	0.714	S	S	*	*			trans	-77.1	120.4	169.5	-57.3	172.6	0	0	0	107.1
119	R	79.3	Confident	89.5	Confident	291 Å²	291	149.3 Å²	149.3	100%	1.098	71%	0.712	S	S	*	*			trans	-118.2	0	177.7	-61.1	-175.7	-173	178.2	1.5	109.7	P117	P117-R119 PolarHBondContact O-N 3.05Å

Retrieved 119 of 119 residues in 83.6 ms (Link to these results)

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