A0A087WZ38_HUMAN Loading...

Programmed cell death 6

AlphaFold DB , UniProt , Accession A0A087WZ38, Species HUMAN (Homo sapiens, Human), Gene PDCD6, Length 123 aa.

						>A0A087WZ38_HUMAN|A0A087WZ38|PDCD6
MAAYSYRPGPGAGPGPAAGAALPDQSFLWNVFQRVDKDRSGVISDTELQQALSNGYRLSDQFHDILIRKFDRQGRGQIAFDDFIQGCIVLQRLTDIFRRYDTDQDGWIQVSYEQYLSMVFSIV
					

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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	38.1	Very low	38.6	Very low	249 Å²	249	138.7 Å²	138.7	100%	1.227	79%	0.792	S	S	*	*				0	107.7	0	-80.3	165.1	162.7	0	0	107.1	A3	M1-A3 PolarHBondContact O-N 3.44Å
2	A	36.7	Very low	39.4	Very low	91 Å²	91	135.9 Å²	135.9	75%	0.752	80%	0.798	S	S	*	*			trans	-78.9	115.9	-172.2	0	0	0	0	0	110.2	Y4	A2-Y4 PolarHBondContact O-N 3.42Å
3	A	34.6	Very low	39.8	Very low	90 Å²	90	129.7 Å²	129.7	74%	0.744	78%	0.78	S	S	*	*			trans	-76.8	111.4	168.8	0	0	0	0	0	108.2	M1 S5	M1-A3 PolarHBondContact O-N 3.44Å; A3-S5 PolarHBondContact O-N 3.25Å
4	Y	30.6	Very low	40	Very low	227 Å²	227	130.1 Å²	130.1	89%	0.89	79%	0.787	S	S	*	*			trans	-78.6	96.7	168.2	-86.6	-86.8	0	0	0	108.4	A2 Y6	A2-Y4 PolarHBondContact O-N 3.42Å; Y4-Y6 PolarHBondContact O-N 3.21Å
5	S	35.7	Very low	40.6	Very low	112 Å²	112	125.3 Å²	125.3	78%	0.783	77%	0.774	S	S	*	*			trans	-81.3	91.6	171.8	-53.2	0	0	0	0	109.3	A3	A3-S5 PolarHBondContact O-N 3.25Å
6	Y	33.3	Very low	40.8	Very low	179 Å²	179	125 Å²	125	70%	0.702	78%	0.775	S	S	*	*			trans	-78.2	120.4	165.5	-173.9	-96.9	0	0	0	108.5	Y4 P8 W107	Y4-Y6 PolarHBondContact O-N 3.21Å; Y6-P8 HydrophobicContact CE1-CB 4.35Å; Y6-W107 HydrophobicContact CD1-CH2 4.38Å; Y6-W107 AromaticContact CD1-CZ2 3.77Å; Y6-W107 HydrophobicContact CD1-CZ2 3.77Å; Y6-W107 HydrophobicContact CE1-CZ2 4.29Å
7	R	38.7	Very low	40.9	Very low	234 Å²	234	123.2 Å²	123.2	88%	0.883	78%	0.775	S	S	*	*			trans	-107.3	107.5	-179	-172.3	176.9	170.8	-172.7	-3.6	108.1
8	P	42.6	Very low	41.3	Very low	69 Å²	69	121.2 Å²	121.2	45%	0.448	77%	0.772	S	S	.	*			trans	-73.7	138.4	177.1	26.5	-25.1	0	0	0	110	Y6	Y6-P8 HydrophobicContact CE1-CB 4.35Å
9	G	43.8	Very low	41	Very low	59 Å²	59	118.8 Å²	118.8	61%	0.608	77%	0.773	S	S	*	*			trans	-78.9	164.3	179.3	0	0	0	0	0	113.2	G11	G9-G11 PolarHBondContact O-N 2.97Å
10	P	41.9	Very low	41.1	Very low	146 Å²	146	117.1 Å²	117.1	95%	0.948	77%	0.769	S	S	*	*	S	Bend	trans	-78.9	89.6	-175.1	33.1	-31	0	0	0	109.2
11	G	48.7	Very low	41.5	Very low	70 Å²	70	114.9 Å²	114.9	72%	0.722	76%	0.76	S	S	*	*			trans	-173.8	7.6	-177.6	0	0	0	0	0	117.5	G9 G13	G9-G11 PolarHBondContact O-N 2.97Å; G11-G13 PolarHBondContact O-N 3.18Å
12	A	48.6	Very low	42.1	Very low	105 Å²	105	108.5 Å²	108.5	87%	0.868	73%	0.73	S	S	*	*			trans	-72.1	96.6	170.3	0	0	0	0	0	108.3
13	G	44.3	Very low	43.2	Very low	55 Å²	55	105.8 Å²	105.8	57%	0.567	71%	0.705	S	S	*	*			trans	-56.8	169.5	173.2	0	0	0	0	0	112	G11 G15	G11-G13 PolarHBondContact O-N 3.18Å; G13-G15 PolarHBondContact O-N 3.16Å
14	P	42.1	Very low	44.8	Very low	136 Å²	136	106.8 Å²	106.8	88%	0.883	70%	0.698	S	S	*	*			trans	-61.4	108.1	-174.8	26.9	-31.9	0	0	0	108.9
15	G	49.1	Very low	46.5	Very low	57 Å²	57	102.6 Å²	102.6	59%	0.588	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-56.6	151.4	165.9	0	0	0	0	0	109.6	G13 A17	G13-G15 PolarHBondContact O-N 3.16Å; G15-A17 PolarHBondContact O-N 3.25Å
16	P	43.8	Very low	48.3	Very low	121 Å²	121	100.9 Å²	100.9	79%	0.786	68%	0.675	S	S	*	*	S	Bend	trans	-54.2	126.2	-170.6	22.1	-31.9	0	0	0	110.8
17	A	42.4	Very low	50.5	Low	95 Å²	95	98.1 Å²	98.1	79%	0.785	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-51.8	135.7	-171.6	0	0	0	0	0	113	G15	G15-A17 PolarHBondContact O-N 3.25Å
18	A	47.6	Very low	52.2	Low	87 Å²	87	87.6 Å²	87.6	72%	0.719	63%	0.628	S	S	*	*	S	Bend	trans	-59.4	132.2	174	0	0	0	0	0	111.7
19	G	36.8	Very low	53.9	Low	76 Å²	76	89 Å²	89	78%	0.784	62%	0.624	S	S	*	*			trans	151.3	-6.6	172.7	0	0	0	0	0	116.1	A21	G19-A21 PolarHBondContact O-N 3.1Å
20	A	42.4	Very low	55.6	Low	83 Å²	83	90.4 Å²	90.4	69%	0.686	62%	0.617	S	S	*	*			trans	-71.8	117.3	-177.4	0	0	0	0	0	110.7
21	A	49	Very low	57.4	Low	71 Å²	71	85.7 Å²	85.7	59%	0.587	59%	0.586	S	S	*	*			trans	-40.4	158.5	152	0	0	0	0	0	110.1	G19	G19-A21 PolarHBondContact O-N 3.1Å
22	L	52.3	Low	58.9	Low	115 Å²	115	82.4 Å²	82.4	60%	0.602	55%	0.552	S	S	*	*	S	Bend	trans	-34.7	120.1	167.5	-79.7	162.5	0	0	0	107.7	D24	L22-D24 PolarHBondContact O-N 3.02Å
23	P	59.8	Low	60.5	Low	35 Å²	35	81.7 Å²	81.7	23%	0.227	53%	0.531	C	S	.	.			trans	-51.8	118.4	-174.8	18	-27.6	0	0	0	106	Q25 F27 L28	P23-Q25 PolarHBondContact O-N 2.74Å; P23-F27 HydrophobicContact CB-CD1 3.65Å; P23-F27 HydrophobicContact CB-CE1 4.27Å; P23-F27 HydrophobicContact CB-CG 4.42Å; P23-L28 HydrophobicContact CB-CD2 4.02Å; P23-L28 HydrophobicContact CB-CG 4.07Å; P23-L28 HydrophobicContact CG-CD1 4.21Å; P23-L28 HydrophobicContact CG-CD2 3.82Å; P23-L28 HydrophobicContact CG-CG 4.04Å
24	D	66.3	Low	62.2	Low	111 Å²	111	89 Å²	89	59%	0.594	54%	0.541	S	S	*	.			trans	-51.8	144	-171.3	-73.4	-65.7	0	0	0	108.3	L22 S26 F27 L28	L22-D24 PolarHBondContact O-N 3.02Å; D24-S26 WeakPolarHBondContact CB-OG 3.17Å; D24-S26 CarbonylContact O-C 3.59Å; D24-S26 PolarHBondContact O-N 3.49Å; D24-F27 WeakPolarHBondContact O-CA 3.32Å; D24-F27 WeakPolarHBondContact O-CB 3.49Å; D24-F27 PolarHBondContact O-N 2.85Å; D24-L28 PolarHBondContact O-N 3.09Å
25	Q	67.7	Low	64	Low	139 Å²	139	83.6 Å²	83.6	65%	0.65	51%	0.506	S	S	*	.	H	α-helix	trans	-52	-29.3	-179	-171.6	176.9	-16	0	0	111.3	P23 W29 F80	P23-Q25 PolarHBondContact O-N 2.74Å; Q25-W29 WeakPolarHBondContact O-CB 3.42Å; Q25-W29 PolarHBondContact O-N 2.75Å; Q25-F80 HydrophobicContact CG-CE1 4.34Å; Q25-F80 HydrophobicContact CG-CZ 4.18Å
26	S	73.7	Confident	65.7	Low	76 Å²	76	81.2 Å²	81.2	53%	0.531	48%	0.479	S	S	.	.	H	α-helix	trans	-66.3	-38.9	170.9	41.7	0	0	0	0	114.4	D24 N30	D24-S26 WeakPolarHBondContact CB-OG 3.17Å; D24-S26 CarbonylContact O-C 3.59Å; D24-S26 PolarHBondContact O-N 3.49Å; S26-N30 WeakPolarHBondContact O-CB 3.43Å; S26-N30 PolarHBondContact O-N 3.44Å; S26-N30 PolarHBondContact O-ND2 2.69Å
27	F	77.9	Confident	67.4	Low	121 Å²	121	82 Å²	82	53%	0.531	47%	0.47	S	S	.	.	H	α-helix	trans	-65.5	-48.8	171	174.9	-92.2	0	0	0	111.1	P23 D24 W29 N30 V31	P23-F27 HydrophobicContact CB-CD1 3.65Å; P23-F27 HydrophobicContact CB-CE1 4.27Å; P23-F27 HydrophobicContact CB-CG 4.42Å; D24-F27 WeakPolarHBondContact O-CA 3.32Å; D24-F27 WeakPolarHBondContact O-CB 3.49Å; D24-F27 PolarHBondContact O-N 2.85Å; F27-W29 VanDerWaalsContact C-N 3.26Å; F27-W29 PolarHBondContact O-N 3.01Å; F27-N30 WeakPolarHBondContact O-CB 3.37Å; F27-N30 PolarHBondContact O-N 3.37Å; F27-N30 VanDerWaalsContact O-N 3.09Å; F27-V31 HydrophobicContact CD1-CG2 4.21Å; F27-V31 HydrophobicContact CE1-CG2 3.75Å; F27-V31 HydrophobicContact CE2-CG2 4.34Å; F27-V31 HydrophobicContact CZ-CG2 3.82Å; F27-V31 WeakPolarHBondContact O-CG2 2.84Å; F27-V31 PolarHBondContact O-N 2.96Å
28	L	75.4	Confident	69.4	Low	13 Å²	13	82.5 Å²	82.5	7%	0.068	46%	0.46	C	S	.	.	H	α-helix	trans	-60.4	-39.6	177.7	-67.9	-179.4	0	0	0	111.4	P23 D24 V31 F32 F83 I84 C87	P23-L28 HydrophobicContact CB-CD2 4.02Å; P23-L28 HydrophobicContact CB-CG 4.07Å; P23-L28 HydrophobicContact CG-CD1 4.21Å; P23-L28 HydrophobicContact CG-CD2 3.82Å; P23-L28 HydrophobicContact CG-CG 4.04Å; D24-L28 PolarHBondContact O-N 3.09Å; L28-V31 PolarHBondContact O-N 3.01Å; L28-F32 VanDerWaalsContact O-CB 3.32Å; L28-F32 WeakPolarHBondContact O-CB 3.33Å; L28-F32 PolarHBondContact O-N 3.11Å; L28-F83 HydrophobicContact CB-CE1 4.21Å; L28-F83 HydrophobicContact CD2-CE1 4.16Å; L28-F83 WeakPolarHBondContact O-CE1 3.4Å; L28-I84 HydrophobicContact CD1-CG1 4.24Å; L28-I84 HydrophobicContact CD1-CG2 4.45Å; L28-C87 HydrophobicContact CD1-CB 4.18Å; L28-C87 HydrophobicContact CD2-CB 3.79Å
29	W	78	Confident	71	Confident	97 Å²	97	88.2 Å²	88.2	37%	0.367	46%	0.463	S	S	.	.	H	α-helix	trans	-62.6	-42.8	173.2	-176.8	-108.6	0	0	0	112.4	Q25 F27 V31 F32 Q33 F80	Q25-W29 WeakPolarHBondContact O-CB 3.42Å; Q25-W29 PolarHBondContact O-N 2.75Å; F27-W29 VanDerWaalsContact C-N 3.26Å; F27-W29 PolarHBondContact O-N 3.01Å; W29-V31 VanDerWaalsContact C-N 3.33Å; W29-V31 PolarHBondContact O-N 3.36Å; W29-F32 HydrophobicContact CE3-CD1 4.27Å; W29-F32 AromaticContact CZ3-CD1 3.97Å; W29-F32 HydrophobicContact CZ3-CD1 3.97Å; W29-F32 HydrophobicContact CZ3-CE1 4.33Å; W29-F32 WeakPolarHBondContact O-CB 3.42Å; W29-F32 PolarHBondContact O-N 2.91Å; W29-Q33 HydrophobicContact CD2-CG 4.23Å; W29-Q33 HydrophobicContact CG-CG 4.49Å; W29-Q33 HydrophobicContact CZ2-CG 4.07Å; W29-Q33 WeakPolarHBondContact O-CB 3.4Å; W29-Q33 WeakPolarHBondContact O-CG 3.48Å; W29-Q33 PolarHBondContact O-N 3.14Å; W29-F80 HydrophobicContact CB-CE2 4.29Å; W29-F80 HydrophobicContact CB-CZ 4.08Å; W29-F80 HydrophobicContact CD2-CZ 4.44Å; W29-F80 HydrophobicContact CE3-CD1 4.07Å; W29-F80 AromaticContact CE3-CD2 3.74Å; W29-F80 HydrophobicContact CE3-CD2 3.74Å; W29-F80 AromaticContact CE3-CE1 3.86Å; W29-F80 HydrophobicContact CE3-CE1 3.86Å; W29-F80 AromaticContact CE3-CE2 3.56Å; W29-F80 HydrophobicContact CE3-CE2 3.56Å; W29-F80 AromaticContact CE3-CG 4Å; W29-F80 HydrophobicContact CE3-CG 4Å; W29-F80 AromaticContact CE3-CZ 3.61Å; W29-F80 HydrophobicContact CE3-CZ 3.61Å; W29-F80 HydrophobicContact CZ3-CB 4.47Å; W29-F80 HydrophobicContact CZ3-CD1 4.12Å; W29-F80 HydrophobicContact CZ3-CD2 4.03Å; W29-F80 HydrophobicContact CZ3-CE1 4.35Å; W29-F80 HydrophobicContact CZ3-CE2 4.31Å; W29-F80 AromaticContact CZ3-CG 3.94Å; W29-F80 HydrophobicContact CZ3-CG 3.94Å; W29-F80 HydrophobicContact CZ3-CZ 4.45Å
30	N	79.6	Confident	73.2	Confident	89 Å²	89	87.5 Å²	87.5	48%	0.476	45%	0.446	S	S	.	.	H	α-helix	trans	-63.4	-37.9	175.6	-86.6	-72.5	0	0	0	112.6	S26 F27 R34	S26-N30 WeakPolarHBondContact O-CB 3.43Å; S26-N30 PolarHBondContact O-N 3.44Å; S26-N30 PolarHBondContact O-ND2 2.69Å; F27-N30 WeakPolarHBondContact O-CB 3.37Å; F27-N30 PolarHBondContact O-N 3.37Å; F27-N30 VanDerWaalsContact O-N 3.09Å; N30-R34 WeakPolarHBondContact O-CG 3.31Å; N30-R34 PolarHBondContact O-N 3.24Å
31	V	79.3	Confident	75.1	Confident	48 Å²	48	85.1 Å²	85.1	29%	0.291	43%	0.43	S	S	.	.	H	α-helix	trans	-67.4	-45.6	174.3	177.4	0	0	0	0	110	F27 L28 W29 Q33 R34 V35 F83	F27-V31 HydrophobicContact CD1-CG2 4.21Å; F27-V31 HydrophobicContact CE1-CG2 3.75Å; F27-V31 HydrophobicContact CE2-CG2 4.34Å; F27-V31 HydrophobicContact CZ-CG2 3.82Å; F27-V31 WeakPolarHBondContact O-CG2 2.84Å; F27-V31 PolarHBondContact O-N 2.96Å; L28-V31 PolarHBondContact O-N 3.01Å; W29-V31 VanDerWaalsContact C-N 3.33Å; W29-V31 PolarHBondContact O-N 3.36Å; V31-Q33 PolarHBondContact O-N 3.24Å; V31-R34 WeakPolarHBondContact O-CB 3.37Å; V31-R34 PolarHBondContact O-N 3.49Å; V31-V35 PolarHBondContact O-N 3.25Å; V31-F83 HydrophobicContact CB-CZ 4.26Å; V31-F83 HydrophobicContact CG1-CZ 3.81Å
32	F	79.9	Confident	76.8	Confident	0 Å²	0	83.7 Å²	83.7	0%	0	41%	0.413	C	S	.	.	H	α-helix	trans	-56.4	-48.8	176.7	-172	-90.4	0	0	0	111.3	L28 W29 R34 V35 D36 G41 I43 F80 F83	L28-F32 VanDerWaalsContact O-CB 3.32Å; L28-F32 WeakPolarHBondContact O-CB 3.33Å; L28-F32 PolarHBondContact O-N 3.11Å; W29-F32 HydrophobicContact CE3-CD1 4.27Å; W29-F32 AromaticContact CZ3-CD1 3.97Å; W29-F32 HydrophobicContact CZ3-CD1 3.97Å; W29-F32 HydrophobicContact CZ3-CE1 4.33Å; W29-F32 WeakPolarHBondContact O-CB 3.42Å; W29-F32 PolarHBondContact O-N 2.91Å; F32-R34 PolarHBondContact O-N 3.35Å; F32-V35 PolarHBondContact O-N 3.36Å; F32-D36 HydrophobicContact CD1-CB 4.1Å; F32-D36 HydrophobicContact CE1-CB 3.85Å; F32-D36 HydrophobicContact CZ-CB 4.46Å; F32-D36 WeakPolarHBondContact O-CB 3.31Å; F32-D36 PolarHBondContact O-N 3.43Å; F32-G41 WeakPolarHBondContact CZ-O 3.45Å; F32-I43 HydrophobicContact CD2-CD1 3.45Å; F32-I43 VanDerWaalsContact CD2-CD1 3.45Å; F32-I43 HydrophobicContact CD2-CG1 3.98Å; F32-I43 HydrophobicContact CE2-CD1 3.48Å; F32-I43 VanDerWaalsContact CE2-CD1 3.48Å; F32-I43 HydrophobicContact CE2-CG1 3.57Å; F32-I43 HydrophobicContact CG-CD1 4.3Å; F32-I43 HydrophobicContact CZ-CD1 4.32Å; F32-I43 HydrophobicContact CZ-CG1 3.94Å; F32-F80 HydrophobicContact CB-CD2 3.98Å; F32-F80 HydrophobicContact CB-CE2 4.11Å; F32-F80 HydrophobicContact CD1-CD2 4.16Å; F32-F80 HydrophobicContact CD2-CB 4.45Å; F32-F80 AromaticContact CD2-CD2 3.73Å; F32-F80 HydrophobicContact CD2-CD2 3.73Å; F32-F80 HydrophobicContact CE1-CB 4.46Å; F32-F80 HydrophobicContact CE2-CB 4.1Å; F32-F80 HydrophobicContact CE2-CD2 4.23Å; F32-F80 AromaticContact CG-CD2 3.68Å; F32-F80 HydrophobicContact CG-CD2 3.68Å; F32-F80 HydrophobicContact CG-CE2 4.31Å; F32-F80 HydrophobicContact CZ-CB 4.11Å; F32-F83 HydrophobicContact CB-CD1 4.32Å; F32-F83 HydrophobicContact CB-CE1 4.31Å; F32-F83 HydrophobicContact CD2-CB 4.04Å; F32-F83 HydrophobicContact CD2-CD1 4.03Å; F32-F83 AromaticContact CD2-CG 3.95Å; F32-F83 HydrophobicContact CD2-CG 3.95Å; F32-F83 HydrophobicContact CE2-CB 4.3Å
33	Q	82.8	Confident	78.3	Confident	90 Å²	90	78.3 Å²	78.3	42%	0.421	39%	0.385	S	S	.	.	H	α-helix	trans	-64.8	-19.1	177.3	-72.7	-161.4	-50.5	0	0	114.8	W29 V31	W29-Q33 HydrophobicContact CD2-CG 4.23Å; W29-Q33 HydrophobicContact CG-CG 4.49Å; W29-Q33 HydrophobicContact CZ2-CG 4.07Å; W29-Q33 WeakPolarHBondContact O-CB 3.4Å; W29-Q33 WeakPolarHBondContact O-CG 3.48Å; W29-Q33 PolarHBondContact O-N 3.14Å; V31-Q33 PolarHBondContact O-N 3.24Å
34	R	81.2	Confident	79.4	Confident	210 Å²	210	77.8 Å²	77.8	79%	0.792	38%	0.382	S	S	*	.	H	α-helix	trans	-79.4	-27.7	172.5	-77.2	177.2	179.4	-163.2	1	112.2	N30 V31 F32	N30-R34 WeakPolarHBondContact O-CG 3.31Å; N30-R34 PolarHBondContact O-N 3.24Å; V31-R34 WeakPolarHBondContact O-CB 3.37Å; V31-R34 PolarHBondContact O-N 3.49Å; F32-R34 PolarHBondContact O-N 3.35Å
35	V	79.6	Confident	80	Confident	22 Å²	22	76 Å²	76	13%	0.133	37%	0.372	C	S	.	.	H	α-helix	trans	-88.8	-48.7	-179.7	-179.1	0	0	0	0	110.3	V31 F32 K37 I43 A51	V31-V35 PolarHBondContact O-N 3.25Å; F32-V35 PolarHBondContact O-N 3.36Å; V35-K37 PolarHBondContact O-N 2.9Å; V35-I43 HydrophobicContact CB-CD1 3.88Å; V35-I43 HydrophobicContact CB-CG1 4.21Å; V35-I43 HydrophobicContact CG1-CB 4.35Å; V35-I43 HydrophobicContact CG1-CD1 3.68Å; V35-I43 HydrophobicContact CG1-CG1 3.82Å; V35-I43 HydrophobicContact CG1-CG2 3.6Å; V35-A51 HydrophobicContact CB-CB 4.28Å; V35-A51 HydrophobicContact CG1-CB 3.75Å; V35-A51 HydrophobicContact CG2-CB 3.91Å
36	D	83.9	Confident	80.7	Confident	6 Å²	6	73.3 Å²	73.3	3%	0.032	37%	0.366	C	S	.	.			trans	-69.2	91.4	173.1	178.8	7.6	0	0	0	109.7	F32 R39 S40 G41 I43	F32-D36 HydrophobicContact CD1-CB 4.1Å; F32-D36 HydrophobicContact CE1-CB 3.85Å; F32-D36 HydrophobicContact CZ-CB 4.46Å; F32-D36 WeakPolarHBondContact O-CB 3.31Å; F32-D36 PolarHBondContact O-N 3.43Å; D36-R39 WeakPolarHBondContact OD1-CA 3.33Å; D36-R39 PolarHBondContact OD1-N 3.47Å; D36-R39 WeakPolarHBondContact OD2-CA 3.31Å; D36-S40 PolarHBondContact OD1-N 2.98Å; D36-G41 WeakPolarHBondContact OD2-CA 3.04Å; D36-G41 PolarHBondContact OD2-N 2.85Å; D36-I43 HydrophobicContact CB-CG1 4.34Å
37	K	80.4	Confident	81.1	Confident	137 Å²	137	70.2 Å²	70.2	60%	0.596	34%	0.343	S	S	*	.	S	Bend	trans	-82.7	-34.1	-173.9	-72.7	-129.6	178.5	178.3	0	111.4	V35 R39 E47	V35-K37 PolarHBondContact O-N 2.9Å; K37-R39 VanDerWaalsContact C-N 3.29Å; K37-E47 PolarHBondContact N-OE1 2.98Å
38	D	84.3	Confident	81.1	Confident	106 Å²	106	65.5 Å²	65.5	57%	0.567	32%	0.323	S	S	*	.	S	Bend	trans	-84.2	-7.6	179.4	72	2.8	0	0	0	112.9	S40 E47	D38-S40 PolarHBondContact O-N 3.2Å; D38-S40 WeakPolarHBondContact OD1-CB 3.47Å; D38-S40 PolarHBondContact OD1-N 2.92Å; D38-S40 PolarHBondContact OD1-OG 3.28Å; D38-E47 PolarHBondContact N-OE1 3.07Å
39	R	81.5	Confident	81.2	Confident	207 Å²	207	68.2 Å²	68.2	78%	0.781	34%	0.336	S	S	*	.			trans	58.6	33.1	-177.5	-56.9	-179.3	-179.3	172.6	0.6	111.7	D36 K37 G41	D36-R39 WeakPolarHBondContact OD1-CA 3.33Å; D36-R39 PolarHBondContact OD1-N 3.47Å; D36-R39 WeakPolarHBondContact OD2-CA 3.31Å; K37-R39 VanDerWaalsContact C-N 3.29Å; R39-G41 PolarHBondContact O-N 3.44Å
40	S	83.4	Confident	81.2	Confident	62 Å²	62	68.6 Å²	68.6	43%	0.434	34%	0.342	S	S	.	.			trans	-69.1	-16.3	176.7	59.7	0	0	0	0	112.3	D36 D38 V42	D36-S40 PolarHBondContact OD1-N 2.98Å; D38-S40 PolarHBondContact O-N 3.2Å; D38-S40 WeakPolarHBondContact OD1-CB 3.47Å; D38-S40 PolarHBondContact OD1-N 2.92Å; D38-S40 PolarHBondContact OD1-OG 3.28Å; S40-V42 VanDerWaalsContact C-N 3.28Å; S40-V42 WeakPolarHBondContact OG-CG2 3.41Å; S40-V42 PolarHBondContact OG-N 3.36Å; S40-V42 PolarHBondContact OG-O 3Å
41	G	81.6	Confident	80.9	Confident	33 Å²	33	66.1 Å²	66.1	34%	0.34	33%	0.333	S	S	.	.	S	Bend	trans	83	6.4	-175.3	0	0	0	0	0	113.2	F32 D36 R39	F32-G41 WeakPolarHBondContact CZ-O 3.45Å; D36-G41 WeakPolarHBondContact OD2-CA 3.04Å; D36-G41 PolarHBondContact OD2-N 2.85Å; R39-G41 PolarHBondContact O-N 3.44Å
42	V	84.4	Confident	80.4	Confident	40 Å²	40	65.4 Å²	65.4	24%	0.242	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	144.5	174.8	-66.2	0	0	0	0	108.5	S40 A79	S40-V42 VanDerWaalsContact C-N 3.28Å; S40-V42 WeakPolarHBondContact OG-CG2 3.41Å; S40-V42 PolarHBondContact OG-N 3.36Å; S40-V42 PolarHBondContact OG-O 3Å; V42-A79 HydrophobicContact CG1-CB 4.45Å
43	I	84.1	Confident	79.8	Confident	2 Å²	2	68.8 Å²	68.8	1%	0.01	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	115.8	173.2	-66.2	164.9	0	0	0	107.8	F32 V35 D36 E47 L48 Q77 I78 F83	F32-I43 HydrophobicContact CD2-CD1 3.45Å; F32-I43 VanDerWaalsContact CD2-CD1 3.45Å; F32-I43 HydrophobicContact CD2-CG1 3.98Å; F32-I43 HydrophobicContact CE2-CD1 3.48Å; F32-I43 VanDerWaalsContact CE2-CD1 3.48Å; F32-I43 HydrophobicContact CE2-CG1 3.57Å; F32-I43 HydrophobicContact CG-CD1 4.3Å; F32-I43 HydrophobicContact CZ-CD1 4.32Å; F32-I43 HydrophobicContact CZ-CG1 3.94Å; V35-I43 HydrophobicContact CB-CD1 3.88Å; V35-I43 HydrophobicContact CB-CG1 4.21Å; V35-I43 HydrophobicContact CG1-CB 4.35Å; V35-I43 HydrophobicContact CG1-CD1 3.68Å; V35-I43 HydrophobicContact CG1-CG1 3.82Å; V35-I43 HydrophobicContact CG1-CG2 3.6Å; D36-I43 HydrophobicContact CB-CG1 4.34Å; I43-E47 HydrophobicContact CG2-CB 4.23Å; I43-L48 HydrophobicContact CG2-CB 3.87Å; I43-L48 HydrophobicContact CG2-CD1 4.37Å; I43-Q77 CarbonylContact O-C 3.58Å; I43-Q77 WeakPolarHBondContact O-CA 3.38Å; I43-I78 HydrophobicContact CB-CB 4.23Å; I43-I78 PolarHBondContact N-O 2.96Å; I43-I78 PolarHBondContact O-N 3.07Å; I43-F83 HydrophobicContact CD1-CD2 4.34Å
44	S	82.9	Confident	78.8	Confident	25 Å²	25	71 Å²	71	18%	0.175	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	158.5	172.7	62	0	0	0	0	112.1	T46 E47 L48	S44-T46 PolarHBondContact O-N 2.99Å; S44-T46 PolarHBondContact OG-OG1 3.5Å; S44-T46 VanDerWaalsContact OG-OG1 3.07Å; S44-E47 WeakPolarHBondContact CB-OE2 3.41Å; S44-E47 PolarHBondContact N-OE2 2.76Å; S44-E47 PolarHBondContact O-N 2.97Å; S44-E47 VanDerWaalsContact O-N 3.07Å; S44-E47 VanDerWaalsContact OG-CD 3.3Å; S44-E47 VanDerWaalsContact OG-CG 3.22Å; S44-E47 WeakPolarHBondContact OG-CG 3.48Å; S44-E47 PolarHBondContact OG-N 3.47Å; S44-E47 PolarHBondContact OG-OE2 3.35Å; S44-L48 PolarHBondContact O-N 2.85Å
45	D	79.2	Confident	77.5	Confident	72 Å²	72	63.4 Å²	63.4	39%	0.385	35%	0.353	S	S	.	.	H	α-helix	trans	-46.8	-47.1	171.8	175.2	-89.6	0	0	0	112.2	E47 L48 Q49 I67	D45-E47 PolarHBondContact O-N 3.36Å; D45-L48 PolarHBondContact O-N 3.07Å; D45-Q49 WeakPolarHBondContact O-CB 3.47Å; D45-Q49 PolarHBondContact O-N 2.89Å; D45-I67 HydrophobicContact CB-CD1 4.34Å; D45-I67 WeakPolarHBondContact OD2-CD1 3.44Å
46	T	81.3	Confident	76.2	Confident	83 Å²	83	70.1 Å²	70.1	51%	0.509	38%	0.377	S	S	.	.	H	α-helix	trans	-64.2	-38.3	179.6	41.3	0	0	0	0	113.3	S44 Q50	S44-T46 PolarHBondContact O-N 2.99Å; S44-T46 PolarHBondContact OG-OG1 3.5Å; S44-T46 VanDerWaalsContact OG-OG1 3.07Å; T46-Q50 WeakPolarHBondContact O-CB 3.22Å; T46-Q50 WeakPolarHBondContact O-CG 3.14Å; T46-Q50 PolarHBondContact O-N 2.95Å
47	E	83.1	Confident	74.8	Confident	12 Å²	12	81.9 Å²	81.9	6%	0.056	42%	0.421	C	S	.	.	H	α-helix	trans	-73	-39.4	178.6	-74.4	170.4	127.9	0	0	111.7	K37 D38 I43 S44 D45 Q50 A51	K37-E47 PolarHBondContact N-OE1 2.98Å; D38-E47 PolarHBondContact N-OE1 3.07Å; I43-E47 HydrophobicContact CG2-CB 4.23Å; S44-E47 WeakPolarHBondContact CB-OE2 3.41Å; S44-E47 PolarHBondContact N-OE2 2.76Å; S44-E47 PolarHBondContact O-N 2.97Å; S44-E47 VanDerWaalsContact O-N 3.07Å; S44-E47 VanDerWaalsContact OG-CD 3.3Å; S44-E47 VanDerWaalsContact OG-CG 3.22Å; S44-E47 WeakPolarHBondContact OG-CG 3.48Å; S44-E47 PolarHBondContact OG-N 3.47Å; S44-E47 PolarHBondContact OG-OE2 3.35Å; D45-E47 PolarHBondContact O-N 3.36Å; E47-Q50 PolarHBondContact O-N 2.72Å; E47-A51 VanDerWaalsContact O-CB 3.31Å; E47-A51 WeakPolarHBondContact O-CB 3.4Å; E47-A51 PolarHBondContact O-N 2.91Å
48	L	78.3	Confident	73.9	Confident	21 Å²	21	78.1 Å²	78.1	11%	0.11	41%	0.407	C	S	.	.	H	α-helix	trans	-62.7	-45.5	174	-172.4	72	0	0	0	110.8	I43 S44 D45 Q50 A51 L52 I67 I78	I43-L48 HydrophobicContact CG2-CB 3.87Å; I43-L48 HydrophobicContact CG2-CD1 4.37Å; S44-L48 PolarHBondContact O-N 2.85Å; D45-L48 PolarHBondContact O-N 3.07Å; L48-Q50 VanDerWaalsContact C-N 3.32Å; L48-Q50 PolarHBondContact O-N 3.27Å; L48-A51 PolarHBondContact O-N 3.19Å; L48-L52 HydrophobicContact CD1-CD1 4.31Å; L48-L52 HydrophobicContact CD2-CD1 4.47Å; L48-L52 HydrophobicContact CG-CD1 3.94Å; L48-L52 WeakPolarHBondContact O-CB 3.38Å; L48-L52 WeakPolarHBondContact O-CG 3.19Å; L48-L52 PolarHBondContact O-N 2.82Å; L48-I67 HydrophobicContact CD2-CD1 4.22Å; L48-I67 HydrophobicContact CD2-CG1 3.38Å; L48-I78 HydrophobicContact CD1-CD1 4.31Å; L48-I78 HydrophobicContact CD2-CD1 3.9Å
49	Q	76.1	Confident	73.3	Confident	71 Å²	71	76.6 Å²	76.6	33%	0.332	41%	0.405	S	S	.	.	H	α-helix	trans	-62.1	-40.5	178	-161.2	-177.4	26.5	0	0	111.2	D45 S53	D45-Q49 WeakPolarHBondContact O-CB 3.47Å; D45-Q49 PolarHBondContact O-N 2.89Å; Q49-S53 WeakPolarHBondContact O-CB 3.49Å; Q49-S53 PolarHBondContact O-N 3.23Å; Q49-S53 PolarHBondContact O-OG 2.9Å
50	Q	78.4	Confident	72.7	Confident	105 Å²	105	72.3 Å²	72.3	49%	0.491	40%	0.398	S	S	.	.	H	α-helix	trans	-66.8	-43.5	174.6	-78.1	-176.5	10.8	0	0	112.8	T46 E47 L48 L52 S53 N54	T46-Q50 WeakPolarHBondContact O-CB 3.22Å; T46-Q50 WeakPolarHBondContact O-CG 3.14Å; T46-Q50 PolarHBondContact O-N 2.95Å; E47-Q50 PolarHBondContact O-N 2.72Å; L48-Q50 VanDerWaalsContact C-N 3.32Å; L48-Q50 PolarHBondContact O-N 3.27Å; Q50-L52 VanDerWaalsContact C-N 3.32Å; Q50-L52 PolarHBondContact O-N 3.02Å; Q50-S53 PolarHBondContact O-N 2.86Å; Q50-N54 PolarHBondContact O-N 3.06Å; Q50-N54 VanDerWaalsContact O-N 3.09Å
51	A	74.4	Confident	72.3	Confident	36 Å²	36	77 Å²	77	30%	0.298	41%	0.413	S	S	.	.	H	α-helix	trans	-62.8	-41.2	179.1	0	0	0	0	0	111.7	V35 E47 L48	V35-A51 HydrophobicContact CB-CB 4.28Å; V35-A51 HydrophobicContact CG1-CB 3.75Å; V35-A51 HydrophobicContact CG2-CB 3.91Å; E47-A51 VanDerWaalsContact O-CB 3.31Å; E47-A51 WeakPolarHBondContact O-CB 3.4Å; E47-A51 PolarHBondContact O-N 2.91Å; L48-A51 PolarHBondContact O-N 3.19Å
52	L	68.1	Low	71.6	Confident	34 Å²	34	80.5 Å²	80.5	18%	0.178	42%	0.419	C	S	.	.	H	α-helix	trans	-71.8	-41.8	175.9	-68.6	170.3	0	0	0	111.6	L48 Q50 N54 G55 Y56 L58 L66	L48-L52 HydrophobicContact CD1-CD1 4.31Å; L48-L52 HydrophobicContact CD2-CD1 4.47Å; L48-L52 HydrophobicContact CG-CD1 3.94Å; L48-L52 WeakPolarHBondContact O-CB 3.38Å; L48-L52 WeakPolarHBondContact O-CG 3.19Å; L48-L52 PolarHBondContact O-N 2.82Å; Q50-L52 VanDerWaalsContact C-N 3.32Å; Q50-L52 PolarHBondContact O-N 3.02Å; L52-N54 PolarHBondContact O-N 2.99Å; L52-G55 PolarHBondContact O-N 3.29Å; L52-Y56 CarbonylContact O-C 3.56Å; L52-Y56 PolarHBondContact O-N 3.39Å; L52-L58 HydrophobicContact CB-CD1 4.38Å; L52-L58 HydrophobicContact CD1-CD1 4.29Å; L52-L58 HydrophobicContact CD2-CD1 4.2Å; L52-L66 HydrophobicContact CD1-CD1 3.72Å
53	S	67.5	Low	70.9	Confident	71 Å²	71	79.1 Å²	79.1	50%	0.497	41%	0.41	S	S	.	.	H	α-helix	trans	-60.2	-29.4	177.6	-65.5	0	0	0	0	113.3	Q49 Q50 G55	Q49-S53 WeakPolarHBondContact O-CB 3.49Å; Q49-S53 PolarHBondContact O-N 3.23Å; Q49-S53 PolarHBondContact O-OG 2.9Å; Q50-S53 PolarHBondContact O-N 2.86Å; S53-G55 VanDerWaalsContact C-N 3.31Å; S53-G55 PolarHBondContact O-N 2.8Å
54	N	61.7	Low	70.4	Confident	136 Å²	136	82.7 Å²	82.7	73%	0.727	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-14.9	176.5	-78.2	-7.9	0	0	0	114	Q50 L52	Q50-N54 PolarHBondContact O-N 3.06Å; Q50-N54 VanDerWaalsContact O-N 3.09Å; L52-N54 PolarHBondContact O-N 2.99Å
55	G	53.8	Low	70.1	Confident	51 Å²	51	86 Å²	86	53%	0.526	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.4	-26.1	-178.7	0	0	0	0	0	115.1	L52 S53	L52-G55 PolarHBondContact O-N 3.29Å; S53-G55 VanDerWaalsContact C-N 3.31Å; S53-G55 PolarHBondContact O-N 2.8Å
56	Y	51.9	Low	69.6	Low	162 Å²	162	84.3 Å²	84.3	64%	0.635	43%	0.434	S	S	*	.			trans	-149.9	131.7	-169.9	-59	-80.6	0	0	0	111	L52 L58	L52-Y56 CarbonylContact O-C 3.56Å; L52-Y56 PolarHBondContact O-N 3.39Å; Y56-L58 VanDerWaalsContact C-N 3.35Å; Y56-L58 PolarHBondContact O-N 3.25Å; Y56-L58 VanDerWaalsContact O-N 3.1Å
57	R	54.1	Low	69.2	Low	254 Å²	254	81.2 Å²	81.2	96%	0.958	41%	0.414	S	S	*	.			trans	-84.8	79.3	171.8	-62.3	-172	81	-176.4	5.4	109.6
58	L	62.3	Low	68.9	Low	57 Å²	57	89.7 Å²	89.7	30%	0.298	45%	0.446	S	S	.	.			trans	-88.9	148.6	178.1	-59	176.5	0	0	0	110.8	L52 Y56 F62 L66	L52-L58 HydrophobicContact CB-CD1 4.38Å; L52-L58 HydrophobicContact CD1-CD1 4.29Å; L52-L58 HydrophobicContact CD2-CD1 4.2Å; Y56-L58 VanDerWaalsContact C-N 3.35Å; Y56-L58 PolarHBondContact O-N 3.25Å; Y56-L58 VanDerWaalsContact O-N 3.1Å; L58-F62 HydrophobicContact CB-CB 4.47Å; L58-F62 HydrophobicContact CD1-CD1 4.35Å; L58-F62 HydrophobicContact CD2-CD1 4.34Å; L58-L66 HydrophobicContact CD1-CD1 3.88Å
59	S	71.1	Confident	68.6	Low	74 Å²	74	96.5 Å²	96.5	52%	0.517	47%	0.474	S	S	.	.			trans	-73.3	156	172.9	64.1	0	0	0	0	111.1	Q61 F62 H63	S59-Q61 PolarHBondContact O-N 2.72Å; S59-F62 PolarHBondContact O-N 3.09Å; S59-H63 PolarHBondContact O-N 3.13Å; S59-H63 PolarHBondContact O-ND1 3.49Å; S59-H63 VanDerWaalsContact O-ND1 3.16Å
60	D	70.3	Confident	68.4	Low	118 Å²	118	95.3 Å²	95.3	63%	0.631	47%	0.468	S	S	*	.	H	α-helix	trans	-59.1	-33.7	178.5	-60.1	-45.8	0	0	0	112.5	F62 H63 D64	D60-F62 VanDerWaalsContact C-N 3.28Å; D60-F62 PolarHBondContact O-N 2.9Å; D60-H63 WeakPolarHBondContact O-CB 3.25Å; D60-H63 PolarHBondContact O-N 3.48Å; D60-D64 PolarHBondContact O-N 2.83Å; D60-D64 VanDerWaalsContact O-N 3.11Å
61	Q	73.3	Confident	68.3	Low	160 Å²	160	91 Å²	91	75%	0.748	45%	0.449	S	S	*	.	H	α-helix	trans	-61.4	-36.9	173.6	-80.2	-174.4	7.2	0	0	112.7	S59 D64 I65	S59-Q61 PolarHBondContact O-N 2.72Å; Q61-D64 PolarHBondContact O-N 2.8Å; Q61-I65 WeakPolarHBondContact O-CD1 3.46Å; Q61-I65 VanDerWaalsContact O-CG1 3.31Å; Q61-I65 WeakPolarHBondContact O-CG1 3.47Å; Q61-I65 PolarHBondContact O-N 2.73Å
62	F	67.6	Low	68.1	Low	106 Å²	106	97.2 Å²	97.2	47%	0.465	46%	0.464	S	S	.	.	H	α-helix	trans	-74.8	-31.1	-179.9	-143.6	-95.2	0	0	0	111.4	L58 S59 D60 I65 L66	L58-F62 HydrophobicContact CB-CB 4.47Å; L58-F62 HydrophobicContact CD1-CD1 4.35Å; L58-F62 HydrophobicContact CD2-CD1 4.34Å; S59-F62 PolarHBondContact O-N 3.09Å; D60-F62 VanDerWaalsContact C-N 3.28Å; D60-F62 PolarHBondContact O-N 2.9Å; F62-I65 PolarHBondContact O-N 3.23Å; F62-L66 HydrophobicContact CD1-CD1 3.88Å; F62-L66 HydrophobicContact CD1-CG 4.34Å; F62-L66 HydrophobicContact CE1-CD1 4.4Å; F62-L66 WeakPolarHBondContact O-CD1 3.37Å; F62-L66 WeakPolarHBondContact O-CG 3.15Å; F62-L66 PolarHBondContact O-N 3.15Å
63	H	70.6	Confident	68.3	Low	12 Å²	12	100.9 Å²	100.9	6%	0.056	48%	0.481	C	S	.	.	H	α-helix	trans	-60.9	-47.2	170.5	-75	102.8	0	0	0	111.8	S59 D60 I65 L66 I67	S59-H63 PolarHBondContact O-N 3.13Å; S59-H63 PolarHBondContact O-ND1 3.49Å; S59-H63 VanDerWaalsContact O-ND1 3.16Å; D60-H63 WeakPolarHBondContact O-CB 3.25Å; D60-H63 PolarHBondContact O-N 3.48Å; H63-I65 VanDerWaalsContact C-N 3.29Å; H63-I65 PolarHBondContact O-N 3.4Å; H63-L66 WeakPolarHBondContact O-CB 3.46Å; H63-L66 PolarHBondContact O-N 3.38Å; H63-L66 VanDerWaalsContact O-N 3.14Å; H63-I67 WeakPolarHBondContact O-CG1 3.29Å; H63-I67 PolarHBondContact O-N 3.11Å
64	D	73.1	Confident	68.6	Low	77 Å²	77	100.6 Å²	100.6	41%	0.412	49%	0.489	S	S	.	.	H	α-helix	trans	-61.3	-39	179.1	-152.3	-88.1	0	0	0	111.6	D60 Q61 I67 R68	D60-D64 PolarHBondContact O-N 2.83Å; D60-D64 VanDerWaalsContact O-N 3.11Å; Q61-D64 PolarHBondContact O-N 2.8Å; D64-I67 PolarHBondContact O-N 2.82Å; D64-R68 WeakPolarHBondContact O-CB 3.48Å; D64-R68 WeakPolarHBondContact O-CG 3.32Å; D64-R68 PolarHBondContact O-N 2.92Å; D64-R68 IonicContact OD1-CZ 3.24Å; D64-R68 VanDerWaalsContact OD1-CZ 3.24Å; D64-R68 IonicContact OD1-NE 2.75Å; D64-R68 PolarHBondContact OD1-NE 3.2Å; D64-R68 IonicContact OD1-NH2 3.01Å; D64-R68 PolarHBondContact OD1-NH2 2.8Å
65	I	75.4	Confident	69.2	Low	94 Å²	94	102.4 Å²	102.4	48%	0.482	49%	0.486	S	S	.	.	H	α-helix	trans	-64.6	-43.5	175.7	-67.2	165.7	0	0	0	111.2	Q61 F62 H63 K69	Q61-I65 WeakPolarHBondContact O-CD1 3.46Å; Q61-I65 VanDerWaalsContact O-CG1 3.31Å; Q61-I65 WeakPolarHBondContact O-CG1 3.47Å; Q61-I65 PolarHBondContact O-N 2.73Å; F62-I65 PolarHBondContact O-N 3.23Å; H63-I65 VanDerWaalsContact C-N 3.29Å; H63-I65 PolarHBondContact O-N 3.4Å; I65-K69 VanDerWaalsContact O-CB 3.31Å; I65-K69 WeakPolarHBondContact O-CB 3.29Å; I65-K69 PolarHBondContact O-N 3.25Å
66	L	69.1	Low	70.2	Confident	37 Å²	37	101.7 Å²	101.7	19%	0.194	48%	0.478	C	S	.	.	H	α-helix	trans	-62.3	-47.7	177.6	-78.1	157.7	0	0	0	110.6	L52 L58 F62 H63 R68 K69 F70	L52-L66 HydrophobicContact CD1-CD1 3.72Å; L58-L66 HydrophobicContact CD1-CD1 3.88Å; F62-L66 HydrophobicContact CD1-CD1 3.88Å; F62-L66 HydrophobicContact CD1-CG 4.34Å; F62-L66 HydrophobicContact CE1-CD1 4.4Å; F62-L66 WeakPolarHBondContact O-CD1 3.37Å; F62-L66 WeakPolarHBondContact O-CG 3.15Å; F62-L66 PolarHBondContact O-N 3.15Å; H63-L66 WeakPolarHBondContact O-CB 3.46Å; H63-L66 PolarHBondContact O-N 3.38Å; H63-L66 VanDerWaalsContact O-N 3.14Å; L66-R68 PolarHBondContact O-N 3.46Å; L66-K69 WeakPolarHBondContact O-CB 3.45Å; L66-K69 PolarHBondContact O-N 3Å; L66-F70 HydrophobicContact CB-CD2 4.45Å; L66-F70 HydrophobicContact CB-CE2 4.43Å; L66-F70 HydrophobicContact CD2-CD2 4.45Å; L66-F70 HydrophobicContact CD2-CE2 3.64Å; L66-F70 WeakPolarHBondContact O-CD2 3.42Å; L66-F70 PolarHBondContact O-N 3.48Å
67	I	73.6	Confident	71.5	Confident	18 Å²	18	98.2 Å²	98.2	9%	0.092	47%	0.468	C	S	.	.	H	α-helix	trans	-60	-51.6	179.3	-68.6	159.7	0	0	0	110.2	D45 L48 H63 D64 K69 F70 D71	D45-I67 HydrophobicContact CB-CD1 4.34Å; D45-I67 WeakPolarHBondContact OD2-CD1 3.44Å; L48-I67 HydrophobicContact CD2-CD1 4.22Å; L48-I67 HydrophobicContact CD2-CG1 3.38Å; H63-I67 WeakPolarHBondContact O-CG1 3.29Å; H63-I67 PolarHBondContact O-N 3.11Å; D64-I67 PolarHBondContact O-N 2.82Å; I67-K69 PolarHBondContact O-N 2.73Å; I67-K69 VanDerWaalsContact O-N 3.13Å; I67-F70 PolarHBondContact O-N 2.84Å; I67-F70 VanDerWaalsContact O-N 3.09Å; I67-D71 HydrophobicContact CG2-CB 4.26Å; I67-D71 WeakPolarHBondContact O-CA 3.02Å; I67-D71 WeakPolarHBondContact O-CB 3.48Å; I67-D71 PolarHBondContact O-N 3.27Å
68	R	76.1	Confident	72.8	Confident	190 Å²	190	86.4 Å²	86.4	72%	0.717	42%	0.423	S	S	*	.	H	α-helix	trans	-59.8	-27.7	176.8	-71.4	-179.6	-165.6	-152.4	1.5	113.6	D64 L66	D64-R68 WeakPolarHBondContact O-CB 3.48Å; D64-R68 WeakPolarHBondContact O-CG 3.32Å; D64-R68 PolarHBondContact O-N 2.92Å; D64-R68 IonicContact OD1-CZ 3.24Å; D64-R68 VanDerWaalsContact OD1-CZ 3.24Å; D64-R68 IonicContact OD1-NE 2.75Å; D64-R68 PolarHBondContact OD1-NE 3.2Å; D64-R68 IonicContact OD1-NH2 3.01Å; D64-R68 PolarHBondContact OD1-NH2 2.8Å; L66-R68 PolarHBondContact O-N 3.46Å
69	K	73.3	Confident	73.8	Confident	163 Å²	163	85.1 Å²	85.1	71%	0.709	42%	0.421	S	S	*	.	H	α-helix	trans	-75.6	-35.1	177.5	-95	-70.8	-174.7	-177.4	0	112.9	I65 L66 I67	I65-K69 VanDerWaalsContact O-CB 3.31Å; I65-K69 WeakPolarHBondContact O-CB 3.29Å; I65-K69 PolarHBondContact O-N 3.25Å; L66-K69 WeakPolarHBondContact O-CB 3.45Å; L66-K69 PolarHBondContact O-N 3Å; I67-K69 PolarHBondContact O-N 2.73Å; I67-K69 VanDerWaalsContact O-N 3.13Å
70	F	70.9	Confident	74.2	Confident	46 Å²	46	83 Å²	83	20%	0.202	40%	0.402	C	S	.	.	H	α-helix	trans	-94.9	-32.7	-178.4	-67.5	-66.5	0	0	0	113	L66 I67 R72 I78 D82	L66-F70 HydrophobicContact CB-CD2 4.45Å; L66-F70 HydrophobicContact CB-CE2 4.43Å; L66-F70 HydrophobicContact CD2-CD2 4.45Å; L66-F70 HydrophobicContact CD2-CE2 3.64Å; L66-F70 WeakPolarHBondContact O-CD2 3.42Å; L66-F70 PolarHBondContact O-N 3.48Å; I67-F70 PolarHBondContact O-N 2.84Å; I67-F70 VanDerWaalsContact O-N 3.09Å; F70-R72 PolarHBondContact O-N 3.34Å; F70-R72 VanDerWaalsContact O-N 3.12Å; F70-I78 HydrophobicContact CB-CD1 3.47Å; F70-I78 VanDerWaalsContact CB-CD1 3.47Å; F70-I78 HydrophobicContact CB-CG1 3.8Å; F70-I78 HydrophobicContact CB-CG2 4.16Å; F70-I78 HydrophobicContact CD2-CD1 4.48Å; F70-I78 HydrophobicContact CG-CD1 4.28Å; F70-D82 WeakPolarHBondContact O-CB 3.48Å
71	D	77.3	Confident	74.7	Confident	15 Å²	15	83.1 Å²	83.1	8%	0.08	40%	0.403	C	S	.	.			trans	-82	84.6	176.9	179.3	16.3	0	0	0	110.8	I67 Q73 G74 R75 G76 I78	I67-D71 HydrophobicContact CG2-CB 4.26Å; I67-D71 WeakPolarHBondContact O-CA 3.02Å; I67-D71 WeakPolarHBondContact O-CB 3.48Å; I67-D71 PolarHBondContact O-N 3.27Å; D71-Q73 VanDerWaalsContact C-N 3.26Å; D71-Q73 PolarHBondContact O-N 3.07Å; D71-Q73 PolarHBondContact OD1-N 3.43Å; D71-G74 PolarHBondContact OD1-N 2.93Å; D71-G74 VanDerWaalsContact OD2-CA 3.25Å; D71-G74 WeakPolarHBondContact OD2-CA 3.43Å; D71-G74 PolarHBondContact OD2-N 2.96Å; D71-R75 PolarHBondContact OD1-N 3.33Å; D71-R75 VanDerWaalsContact OD1-N 3.15Å; D71-R75 PolarHBondContact OD2-N 2.83Å; D71-G76 WeakPolarHBondContact OD2-CA 3.39Å; D71-G76 PolarHBondContact OD2-N 3.18Å; D71-I78 HydrophobicContact CB-CG1 4.4Å
72	R	69.6	Low	75	Confident	166 Å²	166	76.3 Å²	76.3	63%	0.626	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-22.9	174.3	-84.3	-178.1	150.9	178.2	-3.4	113.3	F70	F70-R72 PolarHBondContact O-N 3.34Å; F70-R72 VanDerWaalsContact O-N 3.12Å
73	Q	72.1	Confident	75.4	Confident	112 Å²	112	72.6 Å²	72.6	52%	0.523	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-9.7	-178.1	-61.3	-137	7.9	0	0	113.1	D71 R75	D71-Q73 VanDerWaalsContact C-N 3.26Å; D71-Q73 PolarHBondContact O-N 3.07Å; D71-Q73 PolarHBondContact OD1-N 3.43Å; Q73-R75 HydrophobicContact CB-CG 3.91Å; Q73-R75 PolarHBondContact O-N 3.09Å; Q73-R75 VanDerWaalsContact OE1-CZ 3.26Å; Q73-R75 VanDerWaalsContact OE1-NE 3.08Å
74	G	73.4	Confident	75.9	Confident	65 Å²	65	73.4 Å²	73.4	67%	0.67	36%	0.36	S	S	*	.			trans	63.9	29.1	-179.2	0	0	0	0	0	112.9	D71	D71-G74 PolarHBondContact OD1-N 2.93Å; D71-G74 VanDerWaalsContact OD2-CA 3.25Å; D71-G74 WeakPolarHBondContact OD2-CA 3.43Å; D71-G74 PolarHBondContact OD2-N 2.96Å
75	R	74.1	Confident	76.1	Confident	174 Å²	174	73.8 Å²	73.8	66%	0.657	36%	0.359	S	S	*	.	S	Bend	trans	-93.9	0.4	-177.2	-64.1	-172.4	-169.2	-157.8	7.2	113.4	D71 Q73 Q77	D71-R75 PolarHBondContact OD1-N 3.33Å; D71-R75 VanDerWaalsContact OD1-N 3.15Å; D71-R75 PolarHBondContact OD2-N 2.83Å; Q73-R75 HydrophobicContact CB-CG 3.91Å; Q73-R75 PolarHBondContact O-N 3.09Å; Q73-R75 VanDerWaalsContact OE1-CZ 3.26Å; Q73-R75 VanDerWaalsContact OE1-NE 3.08Å; R75-Q77 PolarHBondContact O-N 3.44Å
76	G	74.4	Confident	76	Confident	35 Å²	35	70 Å²	70	36%	0.361	34%	0.343	S	S	.	.	S	Bend	trans	68.3	17.9	-171.4	0	0	0	0	0	113	D71	D71-G76 WeakPolarHBondContact OD2-CA 3.39Å; D71-G76 PolarHBondContact OD2-N 3.18Å
77	Q	79.3	Confident	76.3	Confident	90 Å²	90	69.5 Å²	69.5	42%	0.421	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	138.9	-175.2	-64.6	176.3	87.9	0	0	109	I43 R75	I43-Q77 CarbonylContact O-C 3.58Å; I43-Q77 WeakPolarHBondContact O-CA 3.38Å; R75-Q77 PolarHBondContact O-N 3.44Å
78	I	81.9	Confident	76.5	Confident	6 Å²	6	70.9 Å²	70.9	3%	0.031	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	108.8	-179.5	-57.8	162.1	0	0	0	108	I43 L48 F70 D71 D82 F83	I43-I78 HydrophobicContact CB-CB 4.23Å; I43-I78 PolarHBondContact N-O 2.96Å; I43-I78 PolarHBondContact O-N 3.07Å; L48-I78 HydrophobicContact CD1-CD1 4.31Å; L48-I78 HydrophobicContact CD2-CD1 3.9Å; F70-I78 HydrophobicContact CB-CD1 3.47Å; F70-I78 VanDerWaalsContact CB-CD1 3.47Å; F70-I78 HydrophobicContact CB-CG1 3.8Å; F70-I78 HydrophobicContact CB-CG2 4.16Å; F70-I78 HydrophobicContact CD2-CD1 4.48Å; F70-I78 HydrophobicContact CG-CD1 4.28Å; D71-I78 HydrophobicContact CB-CG1 4.4Å; I78-D82 HydrophobicContact CG2-CB 4.16Å; I78-F83 HydrophobicContact CG2-CB 4.05Å
79	A	83	Confident	76.6	Confident	29 Å²	29	64.5 Å²	64.5	24%	0.24	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	161.1	173.2	0	0	0	0	0	111.1	V42 D81 D82 F83	V42-A79 HydrophobicContact CG1-CB 4.45Å; A79-D81 VanDerWaalsContact C-N 3.25Å; A79-D81 PolarHBondContact O-N 3.32Å; A79-D82 PolarHBondContact O-N 3.31Å; A79-D82 VanDerWaalsContact O-N 3.08Å; A79-F83 PolarHBondContact O-N 2.87Å
80	F	79.7	Confident	76.6	Confident	31 Å²	31	61.3 Å²	61.3	14%	0.136	32%	0.322	C	S	.	.	H	α-helix	trans	-57.7	-38.4	177.6	-176.7	-121.8	0	0	0	112.8	Q25 W29 F32 D82 F83 I84	Q25-F80 HydrophobicContact CG-CE1 4.34Å; Q25-F80 HydrophobicContact CG-CZ 4.18Å; W29-F80 HydrophobicContact CB-CE2 4.29Å; W29-F80 HydrophobicContact CB-CZ 4.08Å; W29-F80 HydrophobicContact CD2-CZ 4.44Å; W29-F80 HydrophobicContact CE3-CD1 4.07Å; W29-F80 AromaticContact CE3-CD2 3.74Å; W29-F80 HydrophobicContact CE3-CD2 3.74Å; W29-F80 AromaticContact CE3-CE1 3.86Å; W29-F80 HydrophobicContact CE3-CE1 3.86Å; W29-F80 AromaticContact CE3-CE2 3.56Å; W29-F80 HydrophobicContact CE3-CE2 3.56Å; W29-F80 AromaticContact CE3-CG 4Å; W29-F80 HydrophobicContact CE3-CG 4Å; W29-F80 AromaticContact CE3-CZ 3.61Å; W29-F80 HydrophobicContact CE3-CZ 3.61Å; W29-F80 HydrophobicContact CZ3-CB 4.47Å; W29-F80 HydrophobicContact CZ3-CD1 4.12Å; W29-F80 HydrophobicContact CZ3-CD2 4.03Å; W29-F80 HydrophobicContact CZ3-CE1 4.35Å; W29-F80 HydrophobicContact CZ3-CE2 4.31Å; W29-F80 AromaticContact CZ3-CG 3.94Å; W29-F80 HydrophobicContact CZ3-CG 3.94Å; W29-F80 HydrophobicContact CZ3-CZ 4.45Å; F32-F80 HydrophobicContact CB-CD2 3.98Å; F32-F80 HydrophobicContact CB-CE2 4.11Å; F32-F80 HydrophobicContact CD1-CD2 4.16Å; F32-F80 HydrophobicContact CD2-CB 4.45Å; F32-F80 AromaticContact CD2-CD2 3.73Å; F32-F80 HydrophobicContact CD2-CD2 3.73Å; F32-F80 HydrophobicContact CE1-CB 4.46Å; F32-F80 HydrophobicContact CE2-CB 4.1Å; F32-F80 HydrophobicContact CE2-CD2 4.23Å; F32-F80 AromaticContact CG-CD2 3.68Å; F32-F80 HydrophobicContact CG-CD2 3.68Å; F32-F80 HydrophobicContact CG-CE2 4.31Å; F32-F80 HydrophobicContact CZ-CB 4.11Å; F80-D82 VanDerWaalsContact C-N 3.34Å; F80-D82 PolarHBondContact O-N 3.01Å; F80-F83 HydrophobicContact CD2-CD1 4.45Å; F80-F83 HydrophobicContact CE2-CD1 4.46Å; F80-F83 WeakPolarHBondContact O-CB 3.41Å; F80-F83 PolarHBondContact O-N 3.16Å; F80-I84 HydrophobicContact CD1-CD1 3.63Å; F80-I84 HydrophobicContact CD1-CG1 4.47Å; F80-I84 HydrophobicContact CD2-CD1 4.39Å; F80-I84 HydrophobicContact CD2-CG1 4.39Å; F80-I84 HydrophobicContact CE1-CD1 3.27Å; F80-I84 HydrophobicContact CE1-CG1 4.13Å; F80-I84 HydrophobicContact CE2-CD1 4.06Å; F80-I84 HydrophobicContact CE2-CG1 4Å; F80-I84 HydrophobicContact CG-CD1 4.2Å; F80-I84 HydrophobicContact CZ-CD1 3.5Å; F80-I84 VanDerWaalsContact CZ-CD1 3.5Å; F80-I84 HydrophobicContact CZ-CG1 3.87Å; F80-I84 WeakPolarHBondContact O-CG1 3.48Å; F80-I84 PolarHBondContact O-N 3.4Å
81	D	80.7	Confident	76.7	Confident	119 Å²	119	60.9 Å²	60.9	64%	0.636	32%	0.321	S	S	*	.	H	α-helix	trans	-62.2	-41.2	175.5	-69.2	-55.6	0	0	0	112.4	A79 I84 Q85	A79-D81 VanDerWaalsContact C-N 3.25Å; A79-D81 PolarHBondContact O-N 3.32Å; D81-I84 PolarHBondContact O-N 3.24Å; D81-Q85 WeakPolarHBondContact O-CB 3.34Å; D81-Q85 VanDerWaalsContact O-CG 3.23Å; D81-Q85 WeakPolarHBondContact O-CG 3.44Å; D81-Q85 PolarHBondContact O-N 3.43Å
82	D	80.6	Confident	76.8	Confident	18 Å²	18	67 Å²	67	10%	0.096	34%	0.342	C	S	.	.	H	α-helix	trans	-68.9	-37.6	177.7	-68.8	-42.2	0	0	0	111.4	F70 I78 A79 F80 Q85 G86	F70-D82 WeakPolarHBondContact O-CB 3.48Å; I78-D82 HydrophobicContact CG2-CB 4.16Å; A79-D82 PolarHBondContact O-N 3.31Å; A79-D82 VanDerWaalsContact O-N 3.08Å; F80-D82 VanDerWaalsContact C-N 3.34Å; F80-D82 PolarHBondContact O-N 3.01Å; D82-Q85 PolarHBondContact O-N 3.45Å; D82-G86 PolarHBondContact O-N 3.35Å
83	F	76.4	Confident	77.1	Confident	28 Å²	28	62.5 Å²	62.5	12%	0.123	33%	0.33	C	S	.	.	H	α-helix	trans	-61.9	-47.1	172.8	-178.3	-101.5	0	0	0	111.7	L28 V31 F32 I43 I78 A79 F80 Q85 G86 C87	L28-F83 HydrophobicContact CB-CE1 4.21Å; L28-F83 HydrophobicContact CD2-CE1 4.16Å; L28-F83 WeakPolarHBondContact O-CE1 3.4Å; V31-F83 HydrophobicContact CB-CZ 4.26Å; V31-F83 HydrophobicContact CG1-CZ 3.81Å; F32-F83 HydrophobicContact CB-CD1 4.32Å; F32-F83 HydrophobicContact CB-CE1 4.31Å; F32-F83 HydrophobicContact CD2-CB 4.04Å; F32-F83 HydrophobicContact CD2-CD1 4.03Å; F32-F83 AromaticContact CD2-CG 3.95Å; F32-F83 HydrophobicContact CD2-CG 3.95Å; F32-F83 HydrophobicContact CE2-CB 4.3Å; I43-F83 HydrophobicContact CD1-CD2 4.34Å; I78-F83 HydrophobicContact CG2-CB 4.05Å; A79-F83 PolarHBondContact O-N 2.87Å; F80-F83 HydrophobicContact CD2-CD1 4.45Å; F80-F83 HydrophobicContact CE2-CD1 4.46Å; F80-F83 WeakPolarHBondContact O-CB 3.41Å; F80-F83 PolarHBondContact O-N 3.16Å; F83-Q85 PolarHBondContact O-N 2.93Å; F83-G86 PolarHBondContact O-N 3.12Å; F83-C87 PolarHBondContact O-N 3.38Å; F83-C87 PolarHBondContact O-SG 3.16Å; F83-C87 VanDerWaalsContact O-SG 3.34Å
84	I	79.2	Confident	77.4	Confident	29 Å²	29	59.5 Å²	59.5	15%	0.149	32%	0.32	C	S	.	.	H	α-helix	trans	-59.1	-48.7	175.5	-69.2	163.1	0	0	0	110.4	L28 F80 D81 G86 C87 I88	L28-I84 HydrophobicContact CD1-CG1 4.24Å; L28-I84 HydrophobicContact CD1-CG2 4.45Å; F80-I84 HydrophobicContact CD1-CD1 3.63Å; F80-I84 HydrophobicContact CD1-CG1 4.47Å; F80-I84 HydrophobicContact CD2-CD1 4.39Å; F80-I84 HydrophobicContact CD2-CG1 4.39Å; F80-I84 HydrophobicContact CE1-CD1 3.27Å; F80-I84 HydrophobicContact CE1-CG1 4.13Å; F80-I84 HydrophobicContact CE2-CD1 4.06Å; F80-I84 HydrophobicContact CE2-CG1 4Å; F80-I84 HydrophobicContact CG-CD1 4.2Å; F80-I84 HydrophobicContact CZ-CD1 3.5Å; F80-I84 VanDerWaalsContact CZ-CD1 3.5Å; F80-I84 HydrophobicContact CZ-CG1 3.87Å; F80-I84 WeakPolarHBondContact O-CG1 3.48Å; F80-I84 PolarHBondContact O-N 3.4Å; D81-I84 PolarHBondContact O-N 3.24Å; I84-G86 VanDerWaalsContact C-N 3.32Å; I84-G86 PolarHBondContact O-N 3.48Å; I84-C87 PolarHBondContact O-N 3.08Å; I84-I88 HydrophobicContact CG2-CD1 3.67Å; I84-I88 HydrophobicContact CG2-CG1 4.3Å; I84-I88 VanDerWaalsContact O-CG1 3.29Å; I84-I88 WeakPolarHBondContact O-CG1 3.46Å; I84-I88 PolarHBondContact O-N 3.37Å
85	Q	77.4	Confident	77.7	Confident	84 Å²	84	59.4 Å²	59.4	39%	0.393	30%	0.304	S	S	.	.	H	α-helix	trans	-59.5	-43.5	178.8	-73.6	-73.6	-37.3	0	0	111.6	D81 D82 F83 I88 V89	D81-Q85 WeakPolarHBondContact O-CB 3.34Å; D81-Q85 VanDerWaalsContact O-CG 3.23Å; D81-Q85 WeakPolarHBondContact O-CG 3.44Å; D81-Q85 PolarHBondContact O-N 3.43Å; D82-Q85 PolarHBondContact O-N 3.45Å; F83-Q85 PolarHBondContact O-N 2.93Å; Q85-I88 PolarHBondContact O-N 2.83Å; Q85-V89 WeakPolarHBondContact O-CG2 3.46Å; Q85-V89 PolarHBondContact O-N 3.32Å
86	G	74.9	Confident	78.1	Confident	15 Å²	15	51.9 Å²	51.9	16%	0.155	28%	0.277	C	S	.	.	H	α-helix	trans	-59.5	-46.1	174.8	0	0	0	0	0	112.5	D82 F83 I84 V89 L90	D82-G86 PolarHBondContact O-N 3.35Å; F83-G86 PolarHBondContact O-N 3.12Å; I84-G86 VanDerWaalsContact C-N 3.32Å; I84-G86 PolarHBondContact O-N 3.48Å; G86-V89 PolarHBondContact O-N 2.84Å; G86-L90 VanDerWaalsContact O-CB 3.29Å; G86-L90 WeakPolarHBondContact O-CB 3.39Å; G86-L90 PolarHBondContact O-N 3Å
87	C	73.6	Confident	78.4	Confident	26 Å²	26	53.5 Å²	53.5	18%	0.176	27%	0.274	C	S	.	.	H	α-helix	trans	-63.3	-40.9	176.6	-71.1	0	0	0	0	112.6	L28 F83 I84 L90 Q91	L28-C87 HydrophobicContact CD1-CB 4.18Å; L28-C87 HydrophobicContact CD2-CB 3.79Å; F83-C87 PolarHBondContact O-N 3.38Å; F83-C87 PolarHBondContact O-SG 3.16Å; F83-C87 VanDerWaalsContact O-SG 3.34Å; I84-C87 PolarHBondContact O-N 3.08Å; C87-L90 PolarHBondContact O-N 3.49Å; C87-Q91 VanDerWaalsContact O-CB 3.31Å; C87-Q91 WeakPolarHBondContact O-CB 3.35Å; C87-Q91 PolarHBondContact O-N 2.86Å
88	I	78.7	Confident	78.5	Confident	48 Å²	48	54.7 Å²	54.7	25%	0.246	28%	0.275	C	S	.	.	H	α-helix	trans	-62.8	-46.3	176.5	-68.6	166.7	0	0	0	110.6	I84 Q85 Q91 R92	I84-I88 HydrophobicContact CG2-CD1 3.67Å; I84-I88 HydrophobicContact CG2-CG1 4.3Å; I84-I88 VanDerWaalsContact O-CG1 3.29Å; I84-I88 WeakPolarHBondContact O-CG1 3.46Å; I84-I88 PolarHBondContact O-N 3.37Å; Q85-I88 PolarHBondContact O-N 2.83Å; I88-Q91 PolarHBondContact O-N 2.85Å; I88-R92 WeakPolarHBondContact O-CG 3.48Å; I88-R92 PolarHBondContact O-N 3.38Å
89	V	78.1	Confident	78.5	Confident	56 Å²	56	64 Å²	64	34%	0.339	31%	0.309	S	S	.	.	H	α-helix	trans	-64.1	-45.7	178.2	172.9	0	0	0	0	110.5	Q85 G86 Q91 R92 L93	Q85-V89 WeakPolarHBondContact O-CG2 3.46Å; Q85-V89 PolarHBondContact O-N 3.32Å; G86-V89 PolarHBondContact O-N 2.84Å; V89-Q91 VanDerWaalsContact C-N 3.31Å; V89-Q91 PolarHBondContact O-N 3.5Å; V89-R92 PolarHBondContact O-N 3.44Å; V89-L93 HydrophobicContact CG1-CD1 3.94Å; V89-L93 HydrophobicContact CG1-CG 4.36Å; V89-L93 WeakPolarHBondContact O-CB 3.27Å; V89-L93 VanDerWaalsContact O-CG 3.27Å; V89-L93 WeakPolarHBondContact O-CG 3.44Å; V89-L93 PolarHBondContact O-N 3.43Å
90	L	73.3	Confident	78.4	Confident	96 Å²	96	66.6 Å²	66.6	50%	0.503	31%	0.314	S	S	.	.	H	α-helix	trans	-61.8	-40.1	178.8	-173.3	64.5	0	0	0	111.7	G86 C87 L93 T94	G86-L90 VanDerWaalsContact O-CB 3.29Å; G86-L90 WeakPolarHBondContact O-CB 3.39Å; G86-L90 PolarHBondContact O-N 3Å; C87-L90 PolarHBondContact O-N 3.49Å; L90-L93 PolarHBondContact O-N 3.27Å; L90-T94 WeakPolarHBondContact O-CB 3.38Å; L90-T94 PolarHBondContact O-N 2.71Å; L90-T94 PolarHBondContact O-OG1 3.1Å
91	Q	73.9	Confident	78.7	Confident	37 Å²	37	65.9 Å²	65.9	17%	0.173	31%	0.311	C	S	.	.	H	α-helix	trans	-64.6	-46.9	175.5	-177.1	172.6	8.7	0	0	111.6	C87 I88 V89 L93 T94 D95	C87-Q91 VanDerWaalsContact O-CB 3.31Å; C87-Q91 WeakPolarHBondContact O-CB 3.35Å; C87-Q91 PolarHBondContact O-N 2.86Å; I88-Q91 PolarHBondContact O-N 2.85Å; V89-Q91 VanDerWaalsContact C-N 3.31Å; V89-Q91 PolarHBondContact O-N 3.5Å; Q91-L93 VanDerWaalsContact C-N 3.31Å; Q91-L93 PolarHBondContact O-N 2.98Å; Q91-T94 PolarHBondContact O-N 3.42Å; Q91-T94 VanDerWaalsContact O-N 3.1Å; Q91-D95 WeakPolarHBondContact O-CB 3.42Å; Q91-D95 PolarHBondContact O-N 3.41Å
92	R	79.4	Confident	78.8	Confident	142 Å²	142	66.2 Å²	66.2	54%	0.536	32%	0.318	S	S	.	.	H	α-helix	trans	-57.6	-45	175.6	-73.6	180	-178.1	-144.5	0.7	111.8	I88 V89 T94 D95 I96	I88-R92 WeakPolarHBondContact O-CG 3.48Å; I88-R92 PolarHBondContact O-N 3.38Å; V89-R92 PolarHBondContact O-N 3.44Å; R92-T94 VanDerWaalsContact C-N 3.33Å; R92-T94 PolarHBondContact O-N 2.86Å; R92-D95 PolarHBondContact O-N 2.92Å; R92-I96 WeakPolarHBondContact O-CB 3.47Å; R92-I96 WeakPolarHBondContact O-CD1 3.39Å; R92-I96 VanDerWaalsContact O-CG1 3.25Å; R92-I96 WeakPolarHBondContact O-CG1 3.25Å; R92-I96 PolarHBondContact O-N 3.37Å
93	L	76.1	Confident	79	Confident	72 Å²	72	70.4 Å²	70.4	38%	0.377	34%	0.34	S	S	.	.	H	α-helix	trans	-60.5	-43.3	175.5	-72.2	172.6	0	0	0	111.6	V89 L90 Q91 I96 F97 I122	V89-L93 HydrophobicContact CG1-CD1 3.94Å; V89-L93 HydrophobicContact CG1-CG 4.36Å; V89-L93 WeakPolarHBondContact O-CB 3.27Å; V89-L93 VanDerWaalsContact O-CG 3.27Å; V89-L93 WeakPolarHBondContact O-CG 3.44Å; V89-L93 PolarHBondContact O-N 3.43Å; L90-L93 PolarHBondContact O-N 3.27Å; Q91-L93 VanDerWaalsContact C-N 3.31Å; Q91-L93 PolarHBondContact O-N 2.98Å; L93-I96 PolarHBondContact O-N 2.99Å; L93-F97 VanDerWaalsContact O-CB 3.29Å; L93-F97 WeakPolarHBondContact O-CB 3.49Å; L93-F97 PolarHBondContact O-N 3.42Å; L93-I122 HydrophobicContact CD2-CD1 3.33Å; L93-I122 HydrophobicContact CD2-CG1 4Å; L93-I122 HydrophobicContact CD2-CG2 4.24Å
94	T	77.3	Confident	79.2	Confident	50 Å²	50	77 Å²	77	31%	0.307	37%	0.371	S	S	.	.	H	α-helix	trans	-67.4	-42.1	179.6	-57.3	0	0	0	0	111.8	L90 Q91 R92 I96 F97 R98	L90-T94 WeakPolarHBondContact O-CB 3.38Å; L90-T94 PolarHBondContact O-N 2.71Å; L90-T94 PolarHBondContact O-OG1 3.1Å; Q91-T94 PolarHBondContact O-N 3.42Å; Q91-T94 VanDerWaalsContact O-N 3.1Å; R92-T94 VanDerWaalsContact C-N 3.33Å; R92-T94 PolarHBondContact O-N 2.86Å; T94-I96 VanDerWaalsContact C-N 3.33Å; T94-F97 PolarHBondContact O-N 3.29Å; T94-R98 WeakPolarHBondContact O-CB 3.27Å; T94-R98 WeakPolarHBondContact O-CG 3.34Å; T94-R98 PolarHBondContact O-N 3.41Å
95	D	80.3	Confident	79.4	Confident	62 Å²	62	79.4 Å²	79.4	33%	0.332	38%	0.384	S	S	.	.	H	α-helix	trans	-66	-39.7	179	-73.4	-21	0	0	0	111.2	Q91 R92 R98 R99	Q91-D95 WeakPolarHBondContact O-CB 3.42Å; Q91-D95 PolarHBondContact O-N 3.41Å; R92-D95 PolarHBondContact O-N 2.92Å; D95-R98 IonicContact OD1-NH1 3.43Å; D95-R98 PolarHBondContact OD1-NH1 3.42Å; D95-R99 VanDerWaalsContact O-CG 3.28Å; D95-R99 WeakPolarHBondContact O-CG 3.34Å; D95-R99 PolarHBondContact O-N 3.47Å; D95-R99 VanDerWaalsContact O-N 3.16Å
96	I	82.8	Confident	79.5	Confident	16 Å²	16	77.5 Å²	77.5	8%	0.082	39%	0.387	C	S	.	.	H	α-helix	trans	-66.4	-48.3	173.3	-69.1	168.8	0	0	0	109.8	R92 L93 T94 R98 R99 Y100 M118 I122	R92-I96 WeakPolarHBondContact O-CB 3.47Å; R92-I96 WeakPolarHBondContact O-CD1 3.39Å; R92-I96 VanDerWaalsContact O-CG1 3.25Å; R92-I96 WeakPolarHBondContact O-CG1 3.25Å; R92-I96 PolarHBondContact O-N 3.37Å; L93-I96 PolarHBondContact O-N 2.99Å; T94-I96 VanDerWaalsContact C-N 3.33Å; I96-R98 PolarHBondContact O-N 3.08Å; I96-R99 WeakPolarHBondContact O-CB 3.38Å; I96-R99 PolarHBondContact O-N 3.43Å; I96-R99 VanDerWaalsContact O-N 3.08Å; I96-Y100 HydrophobicContact CG2-CD2 4.31Å; I96-Y100 HydrophobicContact CG2-CE2 4.18Å; I96-Y100 VanDerWaalsContact O-CD2 3.27Å; I96-Y100 WeakPolarHBondContact O-CD2 3.47Å; I96-Y100 PolarHBondContact O-N 2.79Å; I96-M118 HydrophobicContact CG2-CB 4.49Å; I96-M118 HydrophobicContact CG2-CE 4.13Å; I96-M118 HydrophobicContact CG2-CG 3.36Å; I96-M118 HydrophobicContact CG2-SD 4.19Å; I96-I122 HydrophobicContact CD1-CD1 4.16Å; I96-I122 HydrophobicContact CD1-CG1 3.34Å
97	F	80.9	Confident	79.7	Confident	69 Å²	69	83.5 Å²	83.5	30%	0.303	41%	0.405	S	S	.	.	H	α-helix	trans	-55.3	-49.3	177.6	-173.5	-87.6	0	0	0	111.8	L93 T94 R99 Y100 D101 G106 I108	L93-F97 VanDerWaalsContact O-CB 3.29Å; L93-F97 WeakPolarHBondContact O-CB 3.49Å; L93-F97 PolarHBondContact O-N 3.42Å; T94-F97 PolarHBondContact O-N 3.29Å; F97-R99 VanDerWaalsContact C-N 3.26Å; F97-R99 PolarHBondContact O-N 2.85Å; F97-Y100 CarbonylContact O-C 3.54Å; F97-Y100 PolarHBondContact O-N 3.34Å; F97-D101 HydrophobicContact CD1-CB 4.01Å; F97-D101 HydrophobicContact CE1-CB 3.83Å; F97-D101 WeakPolarHBondContact CE1-OD2 3.25Å; F97-D101 WeakPolarHBondContact O-CB 3.46Å; F97-D101 PolarHBondContact O-N 2.91Å; F97-G106 WeakPolarHBondContact CZ-O 3.29Å; F97-I108 HydrophobicContact CD1-CG2 4.46Å; F97-I108 HydrophobicContact CD2-CD1 3.77Å; F97-I108 HydrophobicContact CD2-CG1 4.13Å; F97-I108 HydrophobicContact CD2-CG2 4.02Å; F97-I108 HydrophobicContact CE1-CG2 4.15Å; F97-I108 HydrophobicContact CE2-CB 4.26Å; F97-I108 HydrophobicContact CE2-CD1 3.82Å; F97-I108 HydrophobicContact CE2-CG1 3.66Å; F97-I108 HydrophobicContact CE2-CG2 3.7Å; F97-I108 HydrophobicContact CG-CG2 4.4Å; F97-I108 HydrophobicContact CZ-CG1 4.38Å; F97-I108 HydrophobicContact CZ-CG2 3.77Å
98	R	79.6	Confident	80.2	Confident	116 Å²	116	84.7 Å²	84.7	44%	0.438	41%	0.409	S	S	.	.	H	α-helix	trans	-61.3	-29.2	177.4	-76.9	-159.1	-147.4	114.5	-1.8	114.3	T94 D95 I96 Y100	T94-R98 WeakPolarHBondContact O-CB 3.27Å; T94-R98 WeakPolarHBondContact O-CG 3.34Å; T94-R98 PolarHBondContact O-N 3.41Å; D95-R98 IonicContact OD1-NH1 3.43Å; D95-R98 PolarHBondContact OD1-NH1 3.42Å; I96-R98 PolarHBondContact O-N 3.08Å; R98-Y100 PolarHBondContact O-N 2.87Å
99	R	82.3	Confident	80.5	Confident	200 Å²	200	91.8 Å²	91.8	76%	0.755	44%	0.442	S	S	*	.	H	α-helix	trans	-68.4	-28.2	175.5	-77	174	-177.9	-160.7	2	112.1	D95 I96 F97	D95-R99 VanDerWaalsContact O-CG 3.28Å; D95-R99 WeakPolarHBondContact O-CG 3.34Å; D95-R99 PolarHBondContact O-N 3.47Å; D95-R99 VanDerWaalsContact O-N 3.16Å; I96-R99 WeakPolarHBondContact O-CB 3.38Å; I96-R99 PolarHBondContact O-N 3.43Å; I96-R99 VanDerWaalsContact O-N 3.08Å; F97-R99 VanDerWaalsContact C-N 3.26Å; F97-R99 PolarHBondContact O-N 2.85Å
100	Y	82.3	Confident	80.9	Confident	85 Å²	85	91.3 Å²	91.3	33%	0.333	44%	0.439	S	S	.	.	H	α-helix	trans	-97	-25.4	179.4	-74	-102.1	0	0	0	112.5	I96 F97 R98 T102 V110 Q114 M118	I96-Y100 HydrophobicContact CG2-CD2 4.31Å; I96-Y100 HydrophobicContact CG2-CE2 4.18Å; I96-Y100 VanDerWaalsContact O-CD2 3.27Å; I96-Y100 WeakPolarHBondContact O-CD2 3.47Å; I96-Y100 PolarHBondContact O-N 2.79Å; F97-Y100 CarbonylContact O-C 3.54Å; F97-Y100 PolarHBondContact O-N 3.34Å; R98-Y100 PolarHBondContact O-N 2.87Å; Y100-T102 VanDerWaalsContact C-N 3.33Å; Y100-T102 PolarHBondContact O-N 2.91Å; Y100-T102 VanDerWaalsContact O-N 3.11Å; Y100-V110 HydrophobicContact CD1-CG1 3.78Å; Y100-V110 HydrophobicContact CE1-CG1 4.38Å; Y100-Q114 HydrophobicContact CE1-CB 4.4Å; Y100-M118 HydrophobicContact CD1-CE 3.67Å; Y100-M118 HydrophobicContact CD2-CE 3.22Å; Y100-M118 HydrophobicContact CE1-CE 4.05Å; Y100-M118 HydrophobicContact CE2-CE 3.63Å; Y100-M118 HydrophobicContact CG-CE 3.21Å
101	D	84.3	Confident	81.8	Confident	15 Å²	15	89.6 Å²	89.6	8%	0.08	44%	0.435	C	S	.	.			trans	-80.6	76.8	172.2	-176.8	6.2	0	0	0	110.1	F97 D103 Q104 D105 G106 I108	F97-D101 HydrophobicContact CD1-CB 4.01Å; F97-D101 HydrophobicContact CE1-CB 3.83Å; F97-D101 WeakPolarHBondContact CE1-OD2 3.25Å; F97-D101 WeakPolarHBondContact O-CB 3.46Å; F97-D101 PolarHBondContact O-N 2.91Å; D101-D103 VanDerWaalsContact C-N 3.3Å; D101-D103 PolarHBondContact O-N 3.47Å; D101-Q104 WeakPolarHBondContact OD1-CA 3.31Å; D101-Q104 PolarHBondContact OD1-N 3.34Å; D101-D105 PolarHBondContact OD1-N 3.22Å; D101-G106 PolarHBondContact OD2-N 3.42Å; D101-I108 HydrophobicContact CB-CG2 3.8Å
102	T	83.2	Confident	82.5	Confident	127 Å²	127	96 Å²	96	78%	0.779	46%	0.459	S	S	*	.	S	Bend	trans	-70.7	-25.5	-175.2	50	0	0	0	0	113.8	Y100	Y100-T102 VanDerWaalsContact C-N 3.33Å; Y100-T102 PolarHBondContact O-N 2.91Å; Y100-T102 VanDerWaalsContact O-N 3.11Å
103	D	84.5	Confident	83	Confident	106 Å²	106	96.4 Å²	96.4	57%	0.567	47%	0.466	S	S	*	.	S	Bend	trans	-103.4	-3.3	-176	54.4	-33.1	0	0	0	113.6	D101 D105	D101-D103 VanDerWaalsContact C-N 3.3Å; D101-D103 PolarHBondContact O-N 3.47Å; D103-D105 PolarHBondContact O-N 2.96Å
104	Q	81.5	Confident	83.4	Confident	167 Å²	167	97.1 Å²	97.1	78%	0.78	47%	0.468	S	S	*	.			trans	58.2	31.1	176.1	-56.6	-176.2	-15.6	0	0	112.7	D101 G106	D101-Q104 WeakPolarHBondContact OD1-CA 3.31Å; D101-Q104 PolarHBondContact OD1-N 3.34Å; Q104-G106 VanDerWaalsContact C-N 3.31Å
105	D	82.6	Confident	83.7	Confident	78 Å²	78	100.7 Å²	100.7	42%	0.417	48%	0.476	S	S	.	.	S	Bend	trans	-88	-7.1	-179	83.6	-21.2	0	0	0	112	D101 D103 W107	D101-D105 PolarHBondContact OD1-N 3.22Å; D103-D105 PolarHBondContact O-N 2.96Å; D105-W107 WeakPolarHBondContact OD1-CA 3.34Å; D105-W107 WeakPolarHBondContact OD1-CB 3.47Å; D105-W107 PolarHBondContact OD1-N 2.91Å; D105-W107 VanDerWaalsContact OD1-O 3.06Å
106	G	79.9	Confident	84.1	Confident	44 Å²	44	100.2 Å²	100.2	45%	0.454	47%	0.474	S	S	.	.	S	Bend	trans	82.2	12.3	-178.3	0	0	0	0	0	113.9	F97 D101 Q104	F97-G106 WeakPolarHBondContact CZ-O 3.29Å; D101-G106 PolarHBondContact OD2-N 3.42Å; Q104-G106 VanDerWaalsContact C-N 3.31Å
107	W	80.2	Confident	84.3	Confident	142 Å²	142	102.8 Å²	102.8	54%	0.538	49%	0.493	S	S	.	.			trans	-125.5	139.5	176.3	-62.1	86.2	0	0	0	110.2	Y6 D105	Y6-W107 HydrophobicContact CD1-CH2 4.38Å; Y6-W107 AromaticContact CD1-CZ2 3.77Å; Y6-W107 HydrophobicContact CD1-CZ2 3.77Å; Y6-W107 HydrophobicContact CE1-CZ2 4.29Å; D105-W107 WeakPolarHBondContact OD1-CA 3.34Å; D105-W107 WeakPolarHBondContact OD1-CB 3.47Å; D105-W107 PolarHBondContact OD1-N 2.91Å; D105-W107 VanDerWaalsContact OD1-O 3.06Å
108	I	83.7	Confident	84.4	Confident	50 Å²	50	100.5 Å²	100.5	26%	0.256	48%	0.484	S	S	.	.			trans	-118.3	131.2	172.9	58.5	169.7	0	0	0	109.5	F97 D101 V110 M118	F97-I108 HydrophobicContact CD1-CG2 4.46Å; F97-I108 HydrophobicContact CD2-CD1 3.77Å; F97-I108 HydrophobicContact CD2-CG1 4.13Å; F97-I108 HydrophobicContact CD2-CG2 4.02Å; F97-I108 HydrophobicContact CE1-CG2 4.15Å; F97-I108 HydrophobicContact CE2-CB 4.26Å; F97-I108 HydrophobicContact CE2-CD1 3.82Å; F97-I108 HydrophobicContact CE2-CG1 3.66Å; F97-I108 HydrophobicContact CE2-CG2 3.7Å; F97-I108 HydrophobicContact CG-CG2 4.4Å; F97-I108 HydrophobicContact CZ-CG1 4.38Å; F97-I108 HydrophobicContact CZ-CG2 3.77Å; D101-I108 HydrophobicContact CB-CG2 3.8Å; I108-V110 HydrophobicContact CB-CG1 4.47Å; I108-V110 HydrophobicContact CD1-CG1 4.39Å; I108-M118 HydrophobicContact CD1-CE 3.69Å; I108-M118 HydrophobicContact CD1-SD 3.9Å
109	Q	85.4	Confident	84.5	Confident	198 Å²	198	97.3 Å²	97.3	93%	0.925	48%	0.477	S	S	*	.			trans	-107.5	107.6	169.7	-173.7	175.5	-20.2	0	0	108.7
110	V	86.5	Confident	84.6	Confident	46 Å²	46	94.7 Å²	94.7	28%	0.279	47%	0.471	S	S	.	.			trans	-121	145.2	-177.4	-66.1	0	0	0	0	111.2	Y100 I108 Q114 M118	Y100-V110 HydrophobicContact CD1-CG1 3.78Å; Y100-V110 HydrophobicContact CE1-CG1 4.38Å; I108-V110 HydrophobicContact CB-CG1 4.47Å; I108-V110 HydrophobicContact CD1-CG1 4.39Å; V110-Q114 HydrophobicContact CB-CB 4.03Å; V110-Q114 HydrophobicContact CG1-CB 4.49Å; V110-M118 HydrophobicContact CG1-CE 4.23Å
111	S	91.2	Very high	84.3	Confident	60 Å²	60	94.4 Å²	94.4	42%	0.42	48%	0.482	S	S	.	.			trans	-73.9	165.5	169.1	75	0	0	0	0	111	E113 Q114 Y115	S111-E113 VanDerWaalsContact C-N 3.32Å; S111-E113 PolarHBondContact O-N 3.05Å; S111-Q114 PolarHBondContact O-N 3.36Å; S111-Q114 VanDerWaalsContact O-N 3.16Å; S111-Q114 WeakPolarHBondContact OG-CG 3.38Å; S111-Q114 PolarHBondContact OG-N 3.3Å; S111-Y115 PolarHBondContact O-N 2.78Å
112	Y	87.9	Confident	83.7	Confident	172 Å²	172	95.8 Å²	95.8	68%	0.675	49%	0.489	S	S	*	.	H	α-helix	trans	-56.7	-42.9	-180	179.8	-109.2	0	0	0	113.1	Y115 L116	Y112-Y115 WeakPolarHBondContact O-CB 3.38Å; Y112-Y115 PolarHBondContact O-N 2.91Å; Y112-L116 HydrophobicContact CD1-CD1 4.16Å; Y112-L116 HydrophobicContact CE1-CD1 3.56Å; Y112-L116 HydrophobicContact CE1-CG 4.23Å; Y112-L116 HydrophobicContact CE2-CG 4.45Å; Y112-L116 WeakPolarHBondContact O-CG 3.14Å; Y112-L116 PolarHBondContact O-N 3.28Å
113	E	89.9	Confident	82.5	Confident	149 Å²	149	98 Å²	98	70%	0.696	50%	0.502	S	S	*	.	H	α-helix	trans	-68.1	-36.3	178.2	-64.3	-176.1	155.8	0	0	112.6	S111 L116 S117	S111-E113 VanDerWaalsContact C-N 3.32Å; S111-E113 PolarHBondContact O-N 3.05Å; E113-L116 PolarHBondContact O-N 2.89Å; E113-S117 WeakPolarHBondContact O-CB 3.42Å; E113-S117 PolarHBondContact O-N 2.83Å; E113-S117 PolarHBondContact O-OG 3.09Å
114	Q	84.3	Confident	82.4	Confident	88 Å²	88	97.6 Å²	97.6	41%	0.411	50%	0.498	S	S	.	.	H	α-helix	trans	-66.9	-39.1	173.8	-72.5	177	-5.3	0	0	111.4	Y100 V110 S111 S117 M118	Y100-Q114 HydrophobicContact CE1-CB 4.4Å; V110-Q114 HydrophobicContact CB-CB 4.03Å; V110-Q114 HydrophobicContact CG1-CB 4.49Å; S111-Q114 PolarHBondContact O-N 3.36Å; S111-Q114 VanDerWaalsContact O-N 3.16Å; S111-Q114 WeakPolarHBondContact OG-CG 3.38Å; S111-Q114 PolarHBondContact OG-N 3.3Å; Q114-S117 PolarHBondContact O-N 2.72Å; Q114-M118 VanDerWaalsContact O-CB 3.25Å; Q114-M118 WeakPolarHBondContact O-CB 3.37Å; Q114-M118 PolarHBondContact O-N 2.92Å
115	Y	85.6	Confident	82.4	Confident	124 Å²	124	93.9 Å²	93.9	49%	0.486	48%	0.484	S	S	.	.	H	α-helix	trans	-60.6	-46.8	172.7	171.2	-99.7	0	0	0	111.6	S111 Y112 S117 M118 V119	S111-Y115 PolarHBondContact O-N 2.78Å; Y112-Y115 WeakPolarHBondContact O-CB 3.38Å; Y112-Y115 PolarHBondContact O-N 2.91Å; Y115-S117 VanDerWaalsContact C-N 3.33Å; Y115-S117 PolarHBondContact O-N 2.83Å; Y115-M118 WeakPolarHBondContact O-CB 3.33Å; Y115-M118 PolarHBondContact O-N 2.95Å; Y115-V119 HydrophobicContact CD1-CG2 4.47Å; Y115-V119 HydrophobicContact CD2-CG2 4.21Å; Y115-V119 HydrophobicContact CE1-CG2 4.01Å; Y115-V119 HydrophobicContact CE2-CG2 3.73Å; Y115-V119 WeakPolarHBondContact O-CG2 3.45Å; Y115-V119 PolarHBondContact O-N 3.46Å
116	L	87.8	Confident	82.4	Confident	53 Å²	53	94.8 Å²	94.8	28%	0.277	49%	0.487	S	S	.	.	H	α-helix	trans	-60.9	-43.4	176.6	-69.1	-178.9	0	0	0	111.9	Y112 E113 M118 V119 F120	Y112-L116 HydrophobicContact CD1-CD1 4.16Å; Y112-L116 HydrophobicContact CE1-CD1 3.56Å; Y112-L116 HydrophobicContact CE1-CG 4.23Å; Y112-L116 HydrophobicContact CE2-CG 4.45Å; Y112-L116 WeakPolarHBondContact O-CG 3.14Å; Y112-L116 PolarHBondContact O-N 3.28Å; E113-L116 PolarHBondContact O-N 2.89Å; L116-M118 VanDerWaalsContact C-N 3.32Å; L116-M118 PolarHBondContact O-N 3.37Å; L116-V119 PolarHBondContact O-N 3.29Å; L116-F120 HydrophobicContact CB-CE2 4.44Å; L116-F120 WeakPolarHBondContact O-CB 3.47Å; L116-F120 WeakPolarHBondContact O-CD2 3.45Å; L116-F120 WeakPolarHBondContact O-CG 3.28Å; L116-F120 PolarHBondContact O-N 3.14Å
117	S	85.9	Confident	82.6	Confident	70 Å²	70	97.8 Å²	97.8	49%	0.49	49%	0.489	S	S	.	.	H	α-helix	trans	-64	-38.3	177.4	-57.6	0	0	0	0	112	E113 Q114 Y115 S121	E113-S117 WeakPolarHBondContact O-CB 3.42Å; E113-S117 PolarHBondContact O-N 2.83Å; E113-S117 PolarHBondContact O-OG 3.09Å; Q114-S117 PolarHBondContact O-N 2.72Å; Y115-S117 VanDerWaalsContact C-N 3.33Å; Y115-S117 PolarHBondContact O-N 2.83Å; S117-S121 PolarHBondContact O-N 3.35Å; S117-S121 VanDerWaalsContact O-N 3.09Å
118	M	83.4	Confident	82.7	Confident	20 Å²	20	95.1 Å²	95.1	10%	0.099	49%	0.486	C	S	.	.	H	α-helix	trans	-62	-47.7	174.3	-175.7	-179	-83.7	0	0	111.1	I96 Y100 I108 V110 Q114 Y115 L116 S121 I122	I96-M118 HydrophobicContact CG2-CB 4.49Å; I96-M118 HydrophobicContact CG2-CE 4.13Å; I96-M118 HydrophobicContact CG2-CG 3.36Å; I96-M118 HydrophobicContact CG2-SD 4.19Å; Y100-M118 HydrophobicContact CD1-CE 3.67Å; Y100-M118 HydrophobicContact CD2-CE 3.22Å; Y100-M118 HydrophobicContact CE1-CE 4.05Å; Y100-M118 HydrophobicContact CE2-CE 3.63Å; Y100-M118 HydrophobicContact CG-CE 3.21Å; I108-M118 HydrophobicContact CD1-CE 3.69Å; I108-M118 HydrophobicContact CD1-SD 3.9Å; V110-M118 HydrophobicContact CG1-CE 4.23Å; Q114-M118 VanDerWaalsContact O-CB 3.25Å; Q114-M118 WeakPolarHBondContact O-CB 3.37Å; Q114-M118 PolarHBondContact O-N 2.92Å; Y115-M118 WeakPolarHBondContact O-CB 3.33Å; Y115-M118 PolarHBondContact O-N 2.95Å; L116-M118 VanDerWaalsContact C-N 3.32Å; L116-M118 PolarHBondContact O-N 3.37Å; M118-S121 PolarHBondContact O-N 3.39Å; M118-I122 WeakPolarHBondContact O-CD1 3.36Å
119	V	82.9	Confident	82.6	Confident	50 Å²	50	98.1 Å²	98.1	30%	0.303	50%	0.502	S	S	.	.	H	α-helix	trans	-66.4	-43.1	179.8	174.9	0	0	0	0	111.7	Y115 L116 S121 I122	Y115-V119 HydrophobicContact CD1-CG2 4.47Å; Y115-V119 HydrophobicContact CD2-CG2 4.21Å; Y115-V119 HydrophobicContact CE1-CG2 4.01Å; Y115-V119 HydrophobicContact CE2-CG2 3.73Å; Y115-V119 WeakPolarHBondContact O-CG2 3.45Å; Y115-V119 PolarHBondContact O-N 3.46Å; L116-V119 PolarHBondContact O-N 3.29Å; V119-S121 VanDerWaalsContact C-N 3.25Å; V119-S121 PolarHBondContact O-N 3.35Å; V119-I122 WeakPolarHBondContact O-CB 3.23Å; V119-I122 PolarHBondContact O-N 2.89Å; V119-I122 VanDerWaalsContact O-N 3.14Å
120	F	82.7	Confident	82.4	Confident	144 Å²	144	90.9 Å²	90.9	63%	0.632	47%	0.471	S	S	*	.	H	α-helix	trans	-68.8	-20.7	177.4	-68.7	-30.1	0	0	0	113.9	L116 I122 V123	L116-F120 HydrophobicContact CB-CE2 4.44Å; L116-F120 WeakPolarHBondContact O-CB 3.47Å; L116-F120 WeakPolarHBondContact O-CD2 3.45Å; L116-F120 WeakPolarHBondContact O-CG 3.28Å; L116-F120 PolarHBondContact O-N 3.14Å; F120-I122 PolarHBondContact O-N 3.19Å; F120-V123 VanDerWaalsContact O-OXT 3.12Å
121	S	76.9	Confident	82.1	Confident	79 Å²	79	94.4 Å²	94.4	55%	0.552	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-11.5	173.2	-175.3	0	0	0	0	113.2	S117 M118 V119	S117-S121 PolarHBondContact O-N 3.35Å; S117-S121 VanDerWaalsContact O-N 3.09Å; M118-S121 PolarHBondContact O-N 3.39Å; V119-S121 VanDerWaalsContact C-N 3.25Å; V119-S121 PolarHBondContact O-N 3.35Å
122	I	71.5	Confident	81.4	Confident	45 Å²	45	97.3 Å²	97.3	23%	0.231	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-37	-176.6	-63.9	153.6	0	0	0	111.7	L93 I96 M118 V119 F120	L93-I122 HydrophobicContact CD2-CD1 3.33Å; L93-I122 HydrophobicContact CD2-CG1 4Å; L93-I122 HydrophobicContact CD2-CG2 4.24Å; I96-I122 HydrophobicContact CD1-CD1 4.16Å; I96-I122 HydrophobicContact CD1-CG1 3.34Å; M118-I122 WeakPolarHBondContact O-CD1 3.36Å; V119-I122 WeakPolarHBondContact O-CB 3.23Å; V119-I122 PolarHBondContact O-N 2.89Å; V119-I122 VanDerWaalsContact O-N 3.14Å; F120-I122 PolarHBondContact O-N 3.19Å
123	V	57.8	Low	80.8	Confident	173 Å²	173	90.5 Å²	90.5	100%	1.048	48%	0.475	S	S	*	.			trans	-92	0	-178.1	177.2	0	0	0	0	110.1	F120	F120-V123 VanDerWaalsContact O-OXT 3.12Å

Retrieved 123 of 123 residues in 762.5 ms (Link to these results)

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