A0A087YPK0_POEFO Loading...

Mitochondrial fission process protein 1

AlphaFold DB , UniProt , Accession A0A087YPK0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 165 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	E	37.1	Very low	41.6	Very low	248 Å²	248	143.9 Å²	143.9	100%	1.159	82%	0.824	S	S	*	*				0	115.5	0	-73.3	139.6	119.8	0	0	109.7
2	G	42.2	Very low	42	Very low	78 Å²	78	140.2 Å²	140.2	80%	0.804	81%	0.806	S	S	*	*			trans	-117.7	92.2	170.2	0	0	0	0	0	107.5	M4	G2-M4 PolarHBondContact O-N 3.5Å
3	S	37.4	Very low	42.8	Very low	120 Å²	120	133.6 Å²	133.6	84%	0.839	77%	0.766	S	S	*	*			trans	-65.2	101.6	-179.2	174.6	0	0	0	0	109.8	G5	S3-G5 PolarHBondContact O-N 3.06Å; S3-G5 VanDerWaalsContact O-N 3.14Å
4	M	43.7	Very low	43.3	Very low	187 Å²	187	131.4 Å²	131.4	92%	0.921	75%	0.749	S	S	*	*			trans	-68.3	101.3	170.1	-151.9	152.8	164.3	0	0	107.2	G2	G2-M4 PolarHBondContact O-N 3.5Å
5	G	39.3	Very low	43.5	Very low	53 Å²	53	126.3 Å²	126.3	55%	0.546	71%	0.714	S	S	.	*			trans	-60.6	147	176.3	0	0	0	0	0	110.7	S3 S7	S3-G5 PolarHBondContact O-N 3.06Å; S3-G5 VanDerWaalsContact O-N 3.14Å; G5-S7 PolarHBondContact O-N 3.39Å; G5-S7 VanDerWaalsContact O-N 3.15Å
6	P	41.5	Very low	43.6	Very low	128 Å²	128	129.8 Å²	129.8	83%	0.831	71%	0.712	S	S	*	*			trans	-62.3	122.1	-178.1	26.6	-31.3	0	0	0	108.5	E8	P6-E8 PolarHBondContact O-N 3.1Å
7	S	41.3	Very low	43.4	Very low	109 Å²	109	128.3 Å²	128.3	76%	0.762	70%	0.703	S	S	*	*			trans	-58.8	107.4	168	43.8	0	0	0	0	107.9	G5 E9	G5-S7 PolarHBondContact O-N 3.39Å; G5-S7 VanDerWaalsContact O-N 3.15Å; S7-E9 PolarHBondContact O-N 3.04Å
8	E	42.3	Very low	43.8	Very low	175 Å²	175	124.1 Å²	124.1	82%	0.818	68%	0.682	S	S	*	*			trans	-52.3	106.7	166.7	-76.1	-173	159.1	0	0	107.9	P6 K10	P6-E8 PolarHBondContact O-N 3.1Å; E8-K10 VanDerWaalsContact C-N 3.29Å; E8-K10 PolarHBondContact O-N 3.3Å
9	E	44.2	Very low	43.7	Very low	175 Å²	175	128.8 Å²	128.8	82%	0.818	69%	0.688	S	S	*	*			trans	-59.2	98.8	165.4	-74.3	-173.3	162.1	0	0	106.8	S7 T11	S7-E9 PolarHBondContact O-N 3.04Å; E9-T11 VanDerWaalsContact C-N 3.25Å; E9-T11 PolarHBondContact O-N 3.49Å
10	K	46.3	Very low	43.9	Very low	187 Å²	187	124.6 Å²	124.6	81%	0.813	67%	0.668	S	S	*	*			trans	-60.9	95	167.6	-79.9	-176.9	178.2	177.8	0	106.9	E8 V12	E8-K10 VanDerWaalsContact C-N 3.29Å; E8-K10 PolarHBondContact O-N 3.3Å; K10-V12 PolarHBondContact O-N 3.43Å
11	T	42.7	Very low	44.6	Very low	123 Å²	123	124.4 Å²	124.4	76%	0.755	66%	0.658	S	S	*	*			trans	-58.5	103.7	172.5	53.6	0	0	0	0	107.1	E9 D13	E9-T11 VanDerWaalsContact C-N 3.25Å; E9-T11 PolarHBondContact O-N 3.49Å; T11-D13 PolarHBondContact O-N 3.41Å
12	V	45.5	Very low	45.5	Very low	99 Å²	99	118.2 Å²	118.2	60%	0.6	63%	0.627	S	S	*	*			trans	-59.7	109.8	178	177.4	0	0	0	0	107	K10 I14 D17	K10-V12 PolarHBondContact O-N 3.43Å; V12-I14 PolarHBondContact O-N 3.49Å; V12-I14 VanDerWaalsContact O-N 3.09Å; V12-D17 HydrophobicContact CG1-CB 3.88Å
13	D	52.2	Low	46.3	Very low	55 Å²	55	117.9 Å²	117.9	29%	0.294	61%	0.606	S	S	.	*			trans	-77.8	100.2	177.5	-176.3	-18.2	0	0	0	106.2	T11 Y15 R16 D17	T11-D13 PolarHBondContact O-N 3.41Å; D13-Y15 PolarHBondContact O-N 2.97Å; D13-Y15 PolarHBondContact OD1-N 2.93Å; D13-R16 HydrophobicContact CB-CB 3.95Å; D13-R16 PolarHBondContact O-N 3.1Å; D13-D17 PolarHBondContact N-OD2 3.36Å; D13-D17 WeakPolarHBondContact O-CB 3.41Å; D13-D17 PolarHBondContact O-N 3.43Å
14	I	50.2	Low	47.2	Very low	103 Å²	103	112.7 Å²	112.7	53%	0.528	57%	0.572	S	S	.	*	H	α-helix	trans	-50.4	-32.3	-175.6	-62.5	173.1	0	0	0	111.3	V12 T18	V12-I14 PolarHBondContact O-N 3.49Å; V12-I14 VanDerWaalsContact O-N 3.09Å; I14-T18 WeakPolarHBondContact O-CB 3.4Å; I14-T18 PolarHBondContact O-N 2.71Å; I14-T18 PolarHBondContact O-OG1 3.42Å
15	Y	47	Very low	47.8	Very low	55 Å²	55	107 Å²	107	22%	0.216	54%	0.541	C	S	.	.	H	α-helix	trans	-82.3	-21.5	-177.5	-63.8	-90.3	0	0	0	113.5	D13 Y52 D56	D13-Y15 PolarHBondContact O-N 2.97Å; D13-Y15 PolarHBondContact OD1-N 2.93Å; Y15-Y52 WeakPolarHBondContact CA-OH 3.35Å; Y15-Y52 HydrophobicContact CD1-CD2 4.45Å; Y15-Y52 HydrophobicContact CD1-CE1 4.47Å; Y15-Y52 AromaticContact CD1-CE2 3.39Å; Y15-Y52 HydrophobicContact CD1-CE2 3.39Å; Y15-Y52 AromaticContact CD1-CZ 3.46Å; Y15-Y52 VanDerWaalsContact CD1-CZ 3.46Å; Y15-Y52 VanDerWaalsContact CD1-OH 3.23Å; Y15-Y52 WeakPolarHBondContact CD1-OH 3.43Å; Y15-Y52 HydrophobicContact CE1-CD2 4.31Å; Y15-Y52 AromaticContact CE1-CE2 3.55Å; Y15-Y52 HydrophobicContact CE1-CE2 3.55Å; Y15-Y52 PolarHBondContact O-OH 3.43Å; Y15-D56 HydrophobicContact CD1-CB 3.41Å; Y15-D56 VanDerWaalsContact CD1-CB 3.41Å; Y15-D56 VanDerWaalsContact CD1-OD1 3.28Å; Y15-D56 WeakPolarHBondContact CD1-OD1 3.4Å; Y15-D56 WeakPolarHBondContact CD2-OD1 3.35Å; Y15-D56 HydrophobicContact CE1-CB 3.32Å; Y15-D56 WeakPolarHBondContact CE1-OD1 3.35Å; Y15-D56 WeakPolarHBondContact CE2-OD1 3.44Å; Y15-D56 HydrophobicContact CG-CB 4.1Å
16	R	44.8	Very low	48.9	Very low	181 Å²	181	105.6 Å²	105.6	68%	0.683	52%	0.524	S	S	*	.	H	α-helix	trans	-105.3	-39.8	-178.2	-167.7	-176	-91.9	-155.3	-4.7	112.9	D13	D13-R16 HydrophobicContact CB-CB 3.95Å; D13-R16 PolarHBondContact O-N 3.1Å
17	D	40	Very low	50	Low	105 Å²	105	99.5 Å²	99.5	56%	0.561	49%	0.485	S	S	*	.	H	α-helix	trans	-97.9	-8.6	-171.6	-65	-41.5	0	0	0	113.6	V12 D13	V12-D17 HydrophobicContact CG1-CB 3.88Å; D13-D17 PolarHBondContact N-OD2 3.36Å; D13-D17 WeakPolarHBondContact O-CB 3.41Å; D13-D17 PolarHBondContact O-N 3.43Å
18	T	50.5	Low	50.9	Low	52 Å²	52	94.5 Å²	94.5	32%	0.319	45%	0.449	S	S	.	.	S	Bend	trans	-109.7	161.8	179.9	-43.4	0	0	0	0	112.1	I14 V20 R21	I14-T18 WeakPolarHBondContact O-CB 3.4Å; I14-T18 PolarHBondContact O-N 2.71Å; I14-T18 PolarHBondContact O-OG1 3.42Å; T18-V20 HydrophobicContact CG2-CG2 3.95Å; T18-V20 PolarHBondContact O-N 2.99Å; T18-R21 PolarHBondContact O-N 3.5Å; T18-R21 VanDerWaalsContact O-N 3.14Å
19	W	41.7	Very low	51.9	Low	214 Å²	214	89.3 Å²	89.3	81%	0.811	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-51.7	-15.6	174.1	-59.4	81.6	0	0	0	114.8	R21 F22	W19-R21 PolarHBondContact O-N 3.45Å; W19-F22 HydrophobicContact CB-CD2 4.35Å; W19-F22 HydrophobicContact CE3-CD2 4.11Å; W19-F22 AromaticContact CE3-CE2 3.94Å; W19-F22 HydrophobicContact CE3-CE2 3.94Å; W19-F22 HydrophobicContact CZ3-CE2 4.47Å; W19-F22 WeakPolarHBondContact O-CB 3.32Å; W19-F22 WeakPolarHBondContact O-CD2 3.34Å; W19-F22 PolarHBondContact O-N 3Å; W19-F22 VanDerWaalsContact O-N 3.07Å
20	V	47.5	Very low	52.9	Low	45 Å²	45	81.5 Å²	81.5	27%	0.273	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-64.7	-25.1	178.4	-152.9	0	0	0	0	112.1	T18 F22 L23 Y52	T18-V20 HydrophobicContact CG2-CG2 3.95Å; T18-V20 PolarHBondContact O-N 2.99Å; V20-F22 PolarHBondContact O-N 3.39Å; V20-L23 HydrophobicContact CG1-CD1 3.65Å; V20-L23 HydrophobicContact CG1-CG 4.39Å; V20-L23 VanDerWaalsContact O-CB 3.31Å; V20-L23 WeakPolarHBondContact O-CB 3.21Å; V20-L23 PolarHBondContact O-N 3.25Å; V20-Y52 HydrophobicContact CB-CE2 3.92Å; V20-Y52 HydrophobicContact CG1-CD2 3.66Å; V20-Y52 HydrophobicContact CG1-CE2 3.05Å; V20-Y52 WeakPolarHBondContact O-CE1 3.45Å; V20-Y52 PolarHBondContact O-OH 2.92Å
21	R	58.4	Low	53.8	Low	121 Å²	121	73 Å²	73	46%	0.457	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-54.7	-33.1	170	-172.7	171.4	66.8	130	-1.4	113.1	T18 W19 L23 G24 Y25	T18-R21 PolarHBondContact O-N 3.5Å; T18-R21 VanDerWaalsContact O-N 3.14Å; W19-R21 PolarHBondContact O-N 3.45Å; R21-L23 PolarHBondContact O-N 2.96Å; R21-G24 PolarHBondContact O-N 2.92Å; R21-Y25 HydrophobicContact CG-CE2 4.28Å; R21-Y25 WeakPolarHBondContact O-CD2 3.3Å
22	F	57	Low	54.9	Low	118 Å²	118	67.2 Å²	67.2	52%	0.518	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-68.5	-19	179.3	-65.4	-66.4	0	0	0	113.3	W19 V20 G24 Y25 A26	W19-F22 HydrophobicContact CB-CD2 4.35Å; W19-F22 HydrophobicContact CE3-CD2 4.11Å; W19-F22 AromaticContact CE3-CE2 3.94Å; W19-F22 HydrophobicContact CE3-CE2 3.94Å; W19-F22 HydrophobicContact CZ3-CE2 4.47Å; W19-F22 WeakPolarHBondContact O-CB 3.32Å; W19-F22 WeakPolarHBondContact O-CD2 3.34Å; W19-F22 PolarHBondContact O-N 3Å; W19-F22 VanDerWaalsContact O-N 3.07Å; V20-F22 PolarHBondContact O-N 3.39Å; F22-G24 VanDerWaalsContact C-N 3.25Å; F22-G24 PolarHBondContact O-N 2.84Å; F22-Y25 PolarHBondContact O-N 3.31Å; F22-Y25 VanDerWaalsContact O-N 3.1Å; F22-A26 PolarHBondContact O-N 2.89Å
23	L	57.9	Low	56	Low	70 Å²	70	65.7 Å²	65.7	37%	0.366	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-67.1	-28.7	174.4	-62.2	179.6	0	0	0	112.2	V20 R21 Y25 A26 V48 Y52	V20-L23 HydrophobicContact CG1-CD1 3.65Å; V20-L23 HydrophobicContact CG1-CG 4.39Å; V20-L23 VanDerWaalsContact O-CB 3.31Å; V20-L23 WeakPolarHBondContact O-CB 3.21Å; V20-L23 PolarHBondContact O-N 3.25Å; R21-L23 PolarHBondContact O-N 2.96Å; L23-Y25 PolarHBondContact O-N 3.05Å; L23-A26 VanDerWaalsContact O-CB 3.27Å; L23-A26 WeakPolarHBondContact O-CB 3.22Å; L23-A26 PolarHBondContact O-N 3.45Å; L23-V48 HydrophobicContact CD2-CG1 4.38Å; L23-Y52 HydrophobicContact CB-CD1 4.33Å; L23-Y52 HydrophobicContact CB-CG 4.28Å; L23-Y52 HydrophobicContact CD1-CD2 4.43Å
24	G	56.8	Low	56.8	Low	12 Å²	12	66.9 Å²	66.9	12%	0.124	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-69.7	-12.7	172.9	0	0	0	0	0	114.2	R21 F22 N27	R21-G24 PolarHBondContact O-N 2.92Å; F22-G24 VanDerWaalsContact C-N 3.25Å; F22-G24 PolarHBondContact O-N 2.84Å; G24-N27 PolarHBondContact O-OD1 2.81Å
25	Y	57.2	Low	57.4	Low	66 Å²	66	63 Å²	63	26%	0.259	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-106.3	2	175.3	-61.7	-86.8	0	0	0	113	R21 F22 L23 N27 E28 V29 I139	R21-Y25 HydrophobicContact CG-CE2 4.28Å; R21-Y25 WeakPolarHBondContact O-CD2 3.3Å; F22-Y25 PolarHBondContact O-N 3.31Å; F22-Y25 VanDerWaalsContact O-N 3.1Å; L23-Y25 PolarHBondContact O-N 3.05Å; Y25-N27 PolarHBondContact O-N 2.8Å; Y25-E28 WeakPolarHBondContact CA-OE2 3.42Å; Y25-E28 WeakPolarHBondContact CB-OE2 3.35Å; Y25-E28 WeakPolarHBondContact CD1-OE2 3.2Å; Y25-E28 PolarHBondContact O-N 3.23Å; Y25-V29 PolarHBondContact O-N 3.41Å; Y25-I139 HydrophobicContact CD1-CD1 4.1Å; Y25-I139 HydrophobicContact CE1-CD1 3.85Å; Y25-I139 HydrophobicContact CE1-CG1 4.11Å; Y25-I139 HydrophobicContact CE1-CG2 4.11Å
26	A	61.7	Low	58.4	Low	25 Å²	25	63.3 Å²	63.3	21%	0.207	30%	0.298	C	S	.	.	H	α-helix	trans	-63.4	-32.4	-176.3	0	0	0	0	0	112.3	F22 L23 V29 G30 S45	F22-A26 PolarHBondContact O-N 2.89Å; L23-A26 VanDerWaalsContact O-CB 3.27Å; L23-A26 WeakPolarHBondContact O-CB 3.22Å; L23-A26 PolarHBondContact O-N 3.45Å; A26-V29 PolarHBondContact O-N 2.9Å; A26-G30 PolarHBondContact O-N 2.93Å; A26-S45 WeakPolarHBondContact O-CB 3.4Å
27	N	64	Low	59.5	Low	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62.1	-36.4	175.1	47.2	-63.5	0	0	0	113	G24 Y25 G30 E31 Y46 A49 S93	G24-N27 PolarHBondContact O-OD1 2.81Å; Y25-N27 PolarHBondContact O-N 2.8Å; N27-G30 PolarHBondContact O-N 3.15Å; N27-E31 PolarHBondContact O-N 3.4Å; N27-Y46 HydrophobicContact CB-CD1 3.79Å; N27-Y46 HydrophobicContact CB-CE1 3.77Å; N27-Y46 HydrophobicContact CB-CG 4.22Å; N27-A49 HydrophobicContact CB-CB 4.45Å; N27-A49 WeakPolarHBondContact OD1-CB 3.27Å; N27-S93 PolarHBondContact ND2-O 3.15Å
28	E	61.8	Low	60.8	Low	4 Å²	4	56 Å²	56	2%	0.019	28%	0.278	C	S	.	.	H	α-helix	trans	-75.6	-34.7	178.9	-62.8	135.7	146.9	0	0	111.7	Y25 E31 A32 P97 I101 I135	Y25-E28 WeakPolarHBondContact CA-OE2 3.42Å; Y25-E28 WeakPolarHBondContact CB-OE2 3.35Å; Y25-E28 WeakPolarHBondContact CD1-OE2 3.2Å; Y25-E28 PolarHBondContact O-N 3.23Å; E28-E31 PolarHBondContact O-N 2.89Å; E28-A32 WeakPolarHBondContact O-CB 3.16Å; E28-A32 PolarHBondContact O-N 2.95Å; E28-P97 HydrophobicContact CG-CB 4.03Å; E28-P97 WeakPolarHBondContact OE1-CB 3.25Å; E28-I101 HydrophobicContact CB-CD1 3.61Å; E28-I101 HydrophobicContact CG-CD1 3.81Å; E28-I135 HydrophobicContact CB-CD1 4.42Å
29	V	63	Low	61.5	Low	66 Å²	66	56.5 Å²	56.5	40%	0.4	28%	0.281	S	S	.	.	H	α-helix	trans	-63.2	-46.4	170.2	-178.9	0	0	0	0	109.6	Y25 A26 E31 A32 F33	Y25-V29 PolarHBondContact O-N 3.41Å; A26-V29 PolarHBondContact O-N 2.9Å; V29-E31 VanDerWaalsContact C-N 3.34Å; V29-E31 PolarHBondContact O-N 2.81Å; V29-A32 PolarHBondContact O-N 3.41Å; V29-F33 HydrophobicContact CG1-CD2 3.84Å; V29-F33 HydrophobicContact CG1-CE2 3.91Å; V29-F33 VanDerWaalsContact O-CD2 3.29Å; V29-F33 WeakPolarHBondContact O-CD2 3.02Å; V29-F33 PolarHBondContact O-N 3.19Å; V29-F33 VanDerWaalsContact O-N 3.08Å
30	G	63.9	Low	62.3	Low	11 Å²	11	50.9 Å²	50.9	11%	0.113	27%	0.274	C	S	.	.	H	α-helix	trans	-54.8	-46.3	175	0	0	0	0	0	113	A26 N27 F33 R34 V42	A26-G30 PolarHBondContact O-N 2.93Å; N27-G30 PolarHBondContact O-N 3.15Å; G30-F33 PolarHBondContact O-N 2.83Å; G30-R34 PolarHBondContact O-N 3.04Å; G30-V42 WeakPolarHBondContact O-CG2 3.46Å
31	E	65.4	Low	63.3	Low	8 Å²	8	55.9 Å²	55.9	4%	0.037	29%	0.293	C	S	.	.	H	α-helix	trans	-65.9	-37.9	177.3	-78.4	-67.1	164.2	0	0	113	N27 E28 V29 F33 R34 V42 Y46 I101 N102	N27-E31 PolarHBondContact O-N 3.4Å; E28-E31 PolarHBondContact O-N 2.89Å; V29-E31 VanDerWaalsContact C-N 3.34Å; V29-E31 PolarHBondContact O-N 2.81Å; E31-F33 VanDerWaalsContact C-N 3.29Å; E31-F33 PolarHBondContact O-N 3.03Å; E31-R34 WeakPolarHBondContact O-CB 3.17Å; E31-R34 PolarHBondContact O-N 3.43Å; E31-R34 IonicContact OE1-NH1 2.88Å; E31-R34 PolarHBondContact OE1-NH1 3.09Å; E31-R34 VanDerWaalsContact OE2-CD 3.29Å; E31-R34 WeakPolarHBondContact OE2-CD 3.48Å; E31-R34 IonicContact OE2-NH1 3.43Å; E31-R34 PolarHBondContact OE2-NH1 3.01Å; E31-V42 HydrophobicContact CG-CG1 3.93Å; E31-V42 VanDerWaalsContact OE1-CG1 3.27Å; E31-V42 WeakPolarHBondContact OE1-CG1 3.45Å; E31-Y46 HydrophobicContact CG-CE2 4.13Å; E31-I101 HydrophobicContact CB-CB 4.5Å; E31-I101 HydrophobicContact CB-CG2 4Å; E31-N102 VanDerWaalsContact OE2-CB 3.27Å; E31-N102 WeakPolarHBondContact OE2-CB 3.21Å; E31-N102 PolarHBondContact OE2-OD1 3.19Å
32	A	67.3	Low	63.5	Low	1 Å²	1	50.1 Å²	50.1	1%	0.008	27%	0.271	C	S	.	.	H	α-helix	trans	-64.6	-33.2	175.3	0	0	0	0	0	112.8	E28 V29 T128 L132	E28-A32 WeakPolarHBondContact O-CB 3.16Å; E28-A32 PolarHBondContact O-N 2.95Å; V29-A32 PolarHBondContact O-N 3.41Å; A32-T128 WeakPolarHBondContact O-CA 3.28Å; A32-T128 WeakPolarHBondContact O-CB 3.39Å; A32-T128 WeakPolarHBondContact O-CG2 3.24Å; A32-T128 PolarHBondContact O-OG1 2.83Å; A32-L132 HydrophobicContact CB-CD2 3.79Å; A32-L132 HydrophobicContact CB-CG 3.97Å
33	F	68.1	Low	63.6	Low	67 Å²	67	53.3 Å²	53.3	29%	0.294	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-2.2	177.5	-79.7	-85.7	0	0	0	114	V29 G30 E31 A35 L36 V37 T128 L132	V29-F33 HydrophobicContact CG1-CD2 3.84Å; V29-F33 HydrophobicContact CG1-CE2 3.91Å; V29-F33 VanDerWaalsContact O-CD2 3.29Å; V29-F33 WeakPolarHBondContact O-CD2 3.02Å; V29-F33 PolarHBondContact O-N 3.19Å; V29-F33 VanDerWaalsContact O-N 3.08Å; G30-F33 PolarHBondContact O-N 2.83Å; E31-F33 VanDerWaalsContact C-N 3.29Å; E31-F33 PolarHBondContact O-N 3.03Å; F33-A35 PolarHBondContact O-N 3.33Å; F33-L36 HydrophobicContact CD1-CD1 4.05Å; F33-L36 HydrophobicContact CE1-CD1 4.39Å; F33-L36 CarbonylContact O-C 3.57Å; F33-L36 WeakPolarHBondContact O-CA 3.23Å; F33-L36 WeakPolarHBondContact O-CB 3.28Å; F33-L36 PolarHBondContact O-N 3.42Å; F33-V37 HydrophobicContact CB-CG1 4.25Å; F33-V37 HydrophobicContact CB-CG2 4.07Å; F33-V37 WeakPolarHBondContact O-CG2 3.13Å; F33-V37 PolarHBondContact O-N 2.89Å; F33-T128 HydrophobicContact CD1-CG2 3.92Å; F33-T128 HydrophobicContact CD2-CG2 4.44Å; F33-T128 HydrophobicContact CE1-CG2 3.9Å; F33-T128 HydrophobicContact CE2-CG2 4.42Å; F33-T128 HydrophobicContact CG-CG2 4.2Å; F33-T128 HydrophobicContact CZ-CG2 4.16Å; F33-L132 HydrophobicContact CE2-CD1 4.14Å; F33-L132 HydrophobicContact CE2-CD2 4.19Å; F33-L132 HydrophobicContact CZ-CD1 4.21Å
34	R	68.1	Low	64	Low	80 Å²	80	51.5 Å²	51.5	30%	0.302	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-27.6	-175.9	-173.1	177.2	-172.5	114	6	114.9	G30 E31 L36 V42	G30-R34 PolarHBondContact O-N 3.04Å; E31-R34 WeakPolarHBondContact O-CB 3.17Å; E31-R34 PolarHBondContact O-N 3.43Å; E31-R34 IonicContact OE1-NH1 2.88Å; E31-R34 PolarHBondContact OE1-NH1 3.09Å; E31-R34 VanDerWaalsContact OE2-CD 3.29Å; E31-R34 WeakPolarHBondContact OE2-CD 3.48Å; E31-R34 IonicContact OE2-NH1 3.43Å; E31-R34 PolarHBondContact OE2-NH1 3.01Å; R34-L36 VanDerWaalsContact C-N 3.27Å; R34-L36 PolarHBondContact O-N 2.96Å; R34-V42 HydrophobicContact CB-CG2 4.14Å; R34-V42 HydrophobicContact CG-CG2 4.18Å
35	A	64.2	Low	64.6	Low	21 Å²	21	51.8 Å²	51.8	17%	0.174	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-21.8	175.8	0	0	0	0	0	113.3	F33 K124	F33-A35 PolarHBondContact O-N 3.33Å; A35-K124 HydrophobicContact CB-CB 4.15Å; A35-K124 HydrophobicContact CB-CG 4.16Å; A35-K124 VanDerWaalsContact O-CD 3.24Å; A35-K124 WeakPolarHBondContact O-CD 3.35Å; A35-K124 WeakPolarHBondContact O-CE 3.46Å; A35-K124 PolarHBondContact O-NZ 3.47Å; A35-K124 VanDerWaalsContact O-NZ 3.15Å
36	L	67.2	Low	64.8	Low	62 Å²	62	51.2 Å²	51.2	33%	0.325	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	-31.6	-174.3	-63.8	174.2	0	0	0	113.1	F33 R34 K124 W125 T128	F33-L36 HydrophobicContact CD1-CD1 4.05Å; F33-L36 HydrophobicContact CE1-CD1 4.39Å; F33-L36 CarbonylContact O-C 3.57Å; F33-L36 WeakPolarHBondContact O-CA 3.23Å; F33-L36 WeakPolarHBondContact O-CB 3.28Å; F33-L36 PolarHBondContact O-N 3.42Å; R34-L36 VanDerWaalsContact C-N 3.27Å; R34-L36 PolarHBondContact O-N 2.96Å; L36-K124 HydrophobicContact CD2-CB 3.74Å; L36-K124 HydrophobicContact CD2-CD 4.44Å; L36-K124 HydrophobicContact CG-CB 4.47Å; L36-W125 HydrophobicContact CD1-CD2 4.22Å; L36-W125 HydrophobicContact CD1-CE3 4.42Å; L36-T128 HydrophobicContact CD1-CG2 4.22Å
37	V	67.9	Low	65	Low	47 Å²	47	52.8 Å²	52.8	29%	0.285	29%	0.29	S	S	.	.	S	Bend	trans	-110.9	151.9	-177.8	-55.5	0	0	0	0	112	F33 F41 V42	F33-V37 HydrophobicContact CB-CG1 4.25Å; F33-V37 HydrophobicContact CB-CG2 4.07Å; F33-V37 WeakPolarHBondContact O-CG2 3.13Å; F33-V37 PolarHBondContact O-N 2.89Å; V37-F41 HydrophobicContact CB-CB 4.31Å; V37-F41 HydrophobicContact CG2-CB 4.01Å; V37-V42 HydrophobicContact CG2-CG2 4.37Å
38	P	67.9	Low	65.3	Low	85 Å²	85	56.3 Å²	56.3	55%	0.552	31%	0.311	S	S	*	.			trans	-61.8	147.1	175.4	24.8	-33.6	0	0	0	111.4	S40 F41	P38-S40 PolarHBondContact O-N 3.34Å; P38-F41 WeakPolarHBondContact O-CB 3.2Å; P38-F41 PolarHBondContact O-N 3.39Å
39	V	64.2	Low	65.4	Low	63 Å²	63	56.1 Å²	56.1	38%	0.382	31%	0.31	S	S	.	.	H	α-helix	trans	-56.2	-28	-177.1	179.3	0	0	0	0	112.2	F41 V42 W43	V39-F41 VanDerWaalsContact C-N 3.25Å; V39-F41 PolarHBondContact O-N 2.98Å; V39-V42 VanDerWaalsContact O-CB 3.32Å; V39-V42 WeakPolarHBondContact O-CB 3.44Å; V39-V42 PolarHBondContact O-N 3.02Å; V39-V42 VanDerWaalsContact O-N 3.07Å; V39-W43 VanDerWaalsContact O-CD1 3.23Å; V39-W43 PolarHBondContact O-N 2.86Å
40	S	59.3	Low	65.4	Low	96 Å²	96	55.7 Å²	55.7	67%	0.671	31%	0.307	S	S	*	.	H	α-helix	trans	-57.5	-34.3	174.4	-44.9	0	0	0	0	113.5	P38 W43 G44	P38-S40 PolarHBondContact O-N 3.34Å; S40-W43 PolarHBondContact O-N 3.14Å; S40-G44 PolarHBondContact O-N 3.4Å
41	F	67.4	Low	65.7	Low	151 Å²	151	58 Å²	58	66%	0.662	33%	0.326	S	S	*	.	H	α-helix	trans	-69.9	-36.3	176.5	-116.8	-95.7	0	0	0	111.8	V37 P38 V39 G44 S45	V37-F41 HydrophobicContact CB-CB 4.31Å; V37-F41 HydrophobicContact CG2-CB 4.01Å; P38-F41 WeakPolarHBondContact O-CB 3.2Å; P38-F41 PolarHBondContact O-N 3.39Å; V39-F41 VanDerWaalsContact C-N 3.25Å; V39-F41 PolarHBondContact O-N 2.98Å; F41-G44 PolarHBondContact O-N 2.93Å; F41-S45 PolarHBondContact O-N 2.86Å
42	V	64.1	Low	65.8	Low	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-63.8	-47.3	174.5	-171.7	0	0	0	0	109.7	G30 E31 R34 V37 V39 G44 S45 Y46	G30-V42 WeakPolarHBondContact O-CG2 3.46Å; E31-V42 HydrophobicContact CG-CG1 3.93Å; E31-V42 VanDerWaalsContact OE1-CG1 3.27Å; E31-V42 WeakPolarHBondContact OE1-CG1 3.45Å; R34-V42 HydrophobicContact CB-CG2 4.14Å; R34-V42 HydrophobicContact CG-CG2 4.18Å; V37-V42 HydrophobicContact CG2-CG2 4.37Å; V39-V42 VanDerWaalsContact O-CB 3.32Å; V39-V42 WeakPolarHBondContact O-CB 3.44Å; V39-V42 PolarHBondContact O-N 3.02Å; V39-V42 VanDerWaalsContact O-N 3.07Å; V42-G44 VanDerWaalsContact C-N 3.28Å; V42-G44 PolarHBondContact O-N 3.45Å; V42-S45 PolarHBondContact O-N 3.44Å; V42-S45 VanDerWaalsContact O-N 3.1Å; V42-S45 PolarHBondContact O-OG 2.84Å; V42-Y46 HydrophobicContact CG1-CD2 4.07Å; V42-Y46 HydrophobicContact CG1-CE2 3.78Å; V42-Y46 WeakPolarHBondContact O-CD2 3.38Å; V42-Y46 PolarHBondContact O-N 2.83Å
43	W	58.6	Low	65.4	Low	184 Å²	184	59.6 Å²	59.6	70%	0.697	33%	0.332	S	S	*	.	H	α-helix	trans	-60.9	-36.7	174.1	-77.8	58.6	0	0	0	112.6	V39 S40 Y46 A47	V39-W43 VanDerWaalsContact O-CD1 3.23Å; V39-W43 PolarHBondContact O-N 2.86Å; S40-W43 PolarHBondContact O-N 3.14Å; W43-Y46 WeakPolarHBondContact O-CB 3.39Å; W43-Y46 PolarHBondContact O-N 3.33Å; W43-A47 PolarHBondContact O-N 3.45Å
44	G	66.8	Low	65.2	Low	33 Å²	33	59.2 Å²	59.2	34%	0.34	34%	0.336	S	S	.	.	H	α-helix	trans	-61.2	-43.2	172.1	0	0	0	0	0	112.7	S40 F41 V42 Y46 A47 V48	S40-G44 PolarHBondContact O-N 3.4Å; F41-G44 PolarHBondContact O-N 2.93Å; V42-G44 VanDerWaalsContact C-N 3.28Å; V42-G44 PolarHBondContact O-N 3.45Å; G44-Y46 VanDerWaalsContact C-N 3.33Å; G44-Y46 PolarHBondContact O-N 3.32Å; G44-A47 PolarHBondContact O-N 2.64Å; G44-V48 WeakPolarHBondContact O-CG2 3.35Å; G44-V48 PolarHBondContact O-N 3.14Å
45	S	69.3	Low	65.2	Low	18 Å²	18	57.8 Å²	57.8	13%	0.126	34%	0.341	C	S	.	.	H	α-helix	trans	-64.6	-36.6	176.7	69.5	0	0	0	0	112.8	A26 F41 V42 V48 A49	A26-S45 WeakPolarHBondContact O-CB 3.4Å; F41-S45 PolarHBondContact O-N 2.86Å; V42-S45 PolarHBondContact O-N 3.44Å; V42-S45 VanDerWaalsContact O-N 3.1Å; V42-S45 PolarHBondContact O-OG 2.84Å; S45-V48 PolarHBondContact O-N 3.03Å; S45-A49 WeakPolarHBondContact O-CB 3.28Å; S45-A49 PolarHBondContact O-N 3.04Å
46	Y	59.8	Low	65.3	Low	53 Å²	53	58 Å²	58	21%	0.208	34%	0.339	C	S	.	.	H	α-helix	trans	-62.2	-45.8	170.3	-82.1	-72	0	0	0	111.8	N27 E31 V42 W43 G44 V48 A49 T50 V94 G98	N27-Y46 HydrophobicContact CB-CD1 3.79Å; N27-Y46 HydrophobicContact CB-CE1 3.77Å; N27-Y46 HydrophobicContact CB-CG 4.22Å; E31-Y46 HydrophobicContact CG-CE2 4.13Å; V42-Y46 HydrophobicContact CG1-CD2 4.07Å; V42-Y46 HydrophobicContact CG1-CE2 3.78Å; V42-Y46 WeakPolarHBondContact O-CD2 3.38Å; V42-Y46 PolarHBondContact O-N 2.83Å; W43-Y46 WeakPolarHBondContact O-CB 3.39Å; W43-Y46 PolarHBondContact O-N 3.33Å; G44-Y46 VanDerWaalsContact C-N 3.33Å; G44-Y46 PolarHBondContact O-N 3.32Å; Y46-V48 VanDerWaalsContact C-N 3.34Å; Y46-V48 PolarHBondContact O-N 2.85Å; Y46-A49 PolarHBondContact O-N 2.75Å; Y46-T50 WeakPolarHBondContact O-CB 3.29Å; Y46-T50 PolarHBondContact O-N 3.29Å; Y46-T50 PolarHBondContact O-OG1 2.92Å; Y46-V94 HydrophobicContact CD1-CG1 3.29Å; Y46-V94 HydrophobicContact CE1-CG1 3.38Å; Y46-G98 WeakPolarHBondContact OH-CA 3.37Å
47	A	66.4	Low	64.8	Low	59 Å²	59	56.9 Å²	56.9	49%	0.488	34%	0.339	S	S	.	.	H	α-helix	trans	-62.3	-39.8	178.7	0	0	0	0	0	112.5	W43 G44 A51	W43-A47 PolarHBondContact O-N 3.45Å; G44-A47 PolarHBondContact O-N 2.64Å; A47-A51 WeakPolarHBondContact O-CB 3.45Å; A47-A51 PolarHBondContact O-N 3.01Å
48	V	70.6	Confident	64.7	Low	74 Å²	74	58.2 Å²	58.2	45%	0.448	35%	0.347	S	S	.	.	H	α-helix	trans	-65.9	-46	176.6	172.5	0	0	0	0	111.2	L23 G44 S45 Y46 A51 Y52	L23-V48 HydrophobicContact CD2-CG1 4.38Å; G44-V48 WeakPolarHBondContact O-CG2 3.35Å; G44-V48 PolarHBondContact O-N 3.14Å; S45-V48 PolarHBondContact O-N 3.03Å; Y46-V48 VanDerWaalsContact C-N 3.34Å; Y46-V48 PolarHBondContact O-N 2.85Å; V48-A51 PolarHBondContact O-N 3.15Å; V48-Y52 WeakPolarHBondContact O-CB 3.31Å; V48-Y52 PolarHBondContact O-N 3.47Å
49	A	64.8	Low	64.7	Low	0 Å²	0	56.8 Å²	56.8	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-62.6	-46.5	177.5	0	0	0	0	0	111.5	N27 S45 Y46 Y52 V53	N27-A49 HydrophobicContact CB-CB 4.45Å; N27-A49 WeakPolarHBondContact OD1-CB 3.27Å; S45-A49 WeakPolarHBondContact O-CB 3.28Å; S45-A49 PolarHBondContact O-N 3.04Å; Y46-A49 PolarHBondContact O-N 2.75Å; A49-Y52 PolarHBondContact O-N 3.01Å; A49-V53 VanDerWaalsContact O-CG2 3.24Å; A49-V53 WeakPolarHBondContact O-CG2 3.41Å; A49-V53 PolarHBondContact O-N 3.07Å; A49-V53 VanDerWaalsContact O-N 3.14Å
50	T	61.5	Low	64.4	Low	56 Å²	56	58 Å²	58	34%	0.344	34%	0.335	S	S	.	.	H	α-helix	trans	-62.7	-44.6	176.9	-59	0	0	0	0	111.9	Y46 Y52 V53 T54 F86	Y46-T50 WeakPolarHBondContact O-CB 3.29Å; Y46-T50 PolarHBondContact O-N 3.29Å; Y46-T50 PolarHBondContact O-OG1 2.92Å; T50-Y52 VanDerWaalsContact C-N 3.32Å; T50-Y52 PolarHBondContact O-N 3.45Å; T50-V53 PolarHBondContact O-N 3.36Å; T50-T54 WeakPolarHBondContact O-CB 3.1Å; T50-T54 PolarHBondContact O-N 3.14Å; T50-T54 PolarHBondContact O-OG1 3.18Å; T50-F86 HydrophobicContact CG2-CZ 4.45Å
51	A	70.3	Confident	64.4	Low	60 Å²	60	54.8 Å²	54.8	50%	0.496	32%	0.316	S	S	.	.	H	α-helix	trans	-62	-39.7	178.9	0	0	0	0	0	112.3	A47 V48 A55	A47-A51 WeakPolarHBondContact O-CB 3.45Å; A47-A51 PolarHBondContact O-N 3.01Å; V48-A51 PolarHBondContact O-N 3.15Å; A51-A55 WeakPolarHBondContact O-CB 3.34Å; A51-A55 PolarHBondContact O-N 2.88Å
52	Y	67.4	Low	64.2	Low	34 Å²	34	54.1 Å²	54.1	13%	0.133	31%	0.313	C	S	.	.	H	α-helix	trans	-61.8	-48.4	176.6	172.1	-114.5	0	0	0	112.2	Y15 V20 L23 V48 A49 T50 A55 D56	Y15-Y52 WeakPolarHBondContact CA-OH 3.35Å; Y15-Y52 HydrophobicContact CD1-CD2 4.45Å; Y15-Y52 HydrophobicContact CD1-CE1 4.47Å; Y15-Y52 AromaticContact CD1-CE2 3.39Å; Y15-Y52 HydrophobicContact CD1-CE2 3.39Å; Y15-Y52 AromaticContact CD1-CZ 3.46Å; Y15-Y52 VanDerWaalsContact CD1-CZ 3.46Å; Y15-Y52 VanDerWaalsContact CD1-OH 3.23Å; Y15-Y52 WeakPolarHBondContact CD1-OH 3.43Å; Y15-Y52 HydrophobicContact CE1-CD2 4.31Å; Y15-Y52 AromaticContact CE1-CE2 3.55Å; Y15-Y52 HydrophobicContact CE1-CE2 3.55Å; Y15-Y52 PolarHBondContact O-OH 3.43Å; V20-Y52 HydrophobicContact CB-CE2 3.92Å; V20-Y52 HydrophobicContact CG1-CD2 3.66Å; V20-Y52 HydrophobicContact CG1-CE2 3.05Å; V20-Y52 WeakPolarHBondContact O-CE1 3.45Å; V20-Y52 PolarHBondContact O-OH 2.92Å; L23-Y52 HydrophobicContact CB-CD1 4.33Å; L23-Y52 HydrophobicContact CB-CG 4.28Å; L23-Y52 HydrophobicContact CD1-CD2 4.43Å; V48-Y52 WeakPolarHBondContact O-CB 3.31Å; V48-Y52 PolarHBondContact O-N 3.47Å; A49-Y52 PolarHBondContact O-N 3.01Å; T50-Y52 VanDerWaalsContact C-N 3.32Å; T50-Y52 PolarHBondContact O-N 3.45Å; Y52-A55 PolarHBondContact O-N 2.91Å; Y52-D56 PolarHBondContact O-N 3.24Å
53	V	60.7	Low	64	Low	9 Å²	9	60.5 Å²	60.5	6%	0.055	34%	0.341	C	S	.	.	H	α-helix	trans	-60.9	-45.9	178.8	158.6	0	0	0	0	112	A49 T50 A55 D56 A57 F86 Q89	A49-V53 VanDerWaalsContact O-CG2 3.24Å; A49-V53 WeakPolarHBondContact O-CG2 3.41Å; A49-V53 PolarHBondContact O-N 3.07Å; A49-V53 VanDerWaalsContact O-N 3.14Å; T50-V53 PolarHBondContact O-N 3.36Å; V53-A55 VanDerWaalsContact C-N 3.3Å; V53-A55 PolarHBondContact O-N 3.41Å; V53-D56 PolarHBondContact O-N 3.28Å; V53-A57 WeakPolarHBondContact O-CB 3.48Å; V53-A57 PolarHBondContact O-N 3.1Å; V53-F86 HydrophobicContact CG1-CD2 4.29Å; V53-F86 HydrophobicContact CG1-CE2 4.37Å; V53-Q89 VanDerWaalsContact CG2-CD 3.48Å
54	T	63.7	Low	63.8	Low	59 Å²	59	54.3 Å²	54.3	36%	0.362	33%	0.329	S	S	.	.	H	α-helix	trans	-63.6	-38.9	176.5	-58.1	0	0	0	0	111.1	T50 V58	T50-T54 WeakPolarHBondContact O-CB 3.1Å; T50-T54 PolarHBondContact O-N 3.14Å; T50-T54 PolarHBondContact O-OG1 3.18Å; T54-V58 WeakPolarHBondContact O-CB 3.39Å; T54-V58 WeakPolarHBondContact O-CG2 3.36Å; T54-V58 PolarHBondContact O-N 2.97Å
55	A	68.4	Low	63.4	Low	50 Å²	50	56.1 Å²	56.1	41%	0.413	34%	0.341	S	S	.	.	H	α-helix	trans	-66.8	-42.3	177.5	0	0	0	0	0	112.8	A51 Y52 V53 V58 D59	A51-A55 WeakPolarHBondContact O-CB 3.34Å; A51-A55 PolarHBondContact O-N 2.88Å; Y52-A55 PolarHBondContact O-N 2.91Å; V53-A55 VanDerWaalsContact C-N 3.3Å; V53-A55 PolarHBondContact O-N 3.41Å; A55-V58 PolarHBondContact O-N 3.2Å; A55-D59 PolarHBondContact O-N 3.31Å
56	D	65.2	Low	63	Low	26 Å²	26	61.6 Å²	61.6	14%	0.139	37%	0.373	C	S	.	.	H	α-helix	trans	-61.8	-47.1	175	-172.1	28.9	0	0	0	111.6	Y15 Y52 V53 V58 D59 K60	Y15-D56 HydrophobicContact CD1-CB 3.41Å; Y15-D56 VanDerWaalsContact CD1-CB 3.41Å; Y15-D56 VanDerWaalsContact CD1-OD1 3.28Å; Y15-D56 WeakPolarHBondContact CD1-OD1 3.4Å; Y15-D56 WeakPolarHBondContact CD2-OD1 3.35Å; Y15-D56 HydrophobicContact CE1-CB 3.32Å; Y15-D56 WeakPolarHBondContact CE1-OD1 3.35Å; Y15-D56 WeakPolarHBondContact CE2-OD1 3.44Å; Y15-D56 HydrophobicContact CG-CB 4.1Å; Y52-D56 PolarHBondContact O-N 3.24Å; V53-D56 PolarHBondContact O-N 3.28Å; D56-V58 VanDerWaalsContact C-N 3.29Å; D56-V58 PolarHBondContact O-N 2.93Å; D56-D59 PolarHBondContact O-N 3.18Å; D56-K60 PolarHBondContact O-N 3.26Å; D56-K60 WeakPolarHBondContact OD1-CD 3.46Å; D56-K60 WeakPolarHBondContact OD1-CE 3.24Å; D56-K60 IonicContact OD1-NZ 3.03Å; D56-K60 PolarHBondContact OD1-NZ 3.35Å; D56-K60 IonicContact OD2-NZ 2.83Å; D56-K60 PolarHBondContact OD2-NZ 3.05Å
57	A	56.7	Low	62.8	Low	38 Å²	38	62.6 Å²	62.6	31%	0.314	39%	0.392	S	S	.	.	H	α-helix	trans	-61	-38.3	179.6	0	0	0	0	0	112.2	V53 G61	V53-A57 WeakPolarHBondContact O-CB 3.48Å; V53-A57 PolarHBondContact O-N 3.1Å; A57-G61 PolarHBondContact O-N 3.35Å
58	V	66.2	Low	62.1	Low	75 Å²	75	65.6 Å²	65.6	46%	0.455	40%	0.396	S	S	.	.	H	α-helix	trans	-71.8	-40.4	177.4	170.5	0	0	0	0	111.8	T54 A55 D56 G61 K62	T54-V58 WeakPolarHBondContact O-CB 3.39Å; T54-V58 WeakPolarHBondContact O-CG2 3.36Å; T54-V58 PolarHBondContact O-N 2.97Å; A55-V58 PolarHBondContact O-N 3.2Å; D56-V58 VanDerWaalsContact C-N 3.29Å; D56-V58 PolarHBondContact O-N 2.93Å; V58-G61 PolarHBondContact O-N 2.88Å; V58-K62 HydrophobicContact CG1-CD 4.2Å; V58-K62 WeakPolarHBondContact O-CB 3.45Å; V58-K62 WeakPolarHBondContact O-CG 3.46Å; V58-K62 PolarHBondContact O-N 3.28Å
59	D	67	Low	61.4	Low	55 Å²	55	64.6 Å²	64.6	29%	0.294	40%	0.401	S	S	.	.	H	α-helix	trans	-64.9	-46.2	178.4	-170.8	62.1	0	0	0	111.5	A55 D56 K62 K63	A55-D59 PolarHBondContact O-N 3.31Å; D56-D59 PolarHBondContact O-N 3.18Å; D59-K62 PolarHBondContact O-N 3.46Å; D59-K63 PolarHBondContact O-N 3.45Å; D59-K63 IonicContact OD1-NZ 3.88Å; D59-K63 WeakPolarHBondContact OD2-CE 3.19Å; D59-K63 IonicContact OD2-NZ 2.71Å; D59-K63 PolarHBondContact OD2-NZ 2.95Å
60	K	59.4	Low	60.7	Low	89 Å²	89	72.8 Å²	72.8	39%	0.387	45%	0.445	S	S	.	.	H	α-helix	trans	-65.9	-40.1	175.6	-73.5	174.4	177.8	155.2	0	112.2	D56 K62 K63 A64	D56-K60 PolarHBondContact O-N 3.26Å; D56-K60 WeakPolarHBondContact OD1-CD 3.46Å; D56-K60 WeakPolarHBondContact OD1-CE 3.24Å; D56-K60 IonicContact OD1-NZ 3.03Å; D56-K60 PolarHBondContact OD1-NZ 3.35Å; D56-K60 IonicContact OD2-NZ 2.83Å; D56-K60 PolarHBondContact OD2-NZ 3.05Å; K60-K62 PolarHBondContact O-N 3.03Å; K60-K63 PolarHBondContact O-N 3.03Å; K60-A64 WeakPolarHBondContact O-CB 3.27Å; K60-A64 PolarHBondContact O-N 3.03Å
61	G	59.2	Low	60.3	Low	27 Å²	27	74.4 Å²	74.4	28%	0.278	45%	0.451	S	S	.	.	H	α-helix	trans	-61.8	-41.9	175.6	0	0	0	0	0	112.9	A57 V58 A65	A57-G61 PolarHBondContact O-N 3.35Å; V58-G61 PolarHBondContact O-N 2.88Å; G61-A65 WeakPolarHBondContact O-CB 3.17Å; G61-A65 PolarHBondContact O-N 3Å
62	K	62.9	Low	58.9	Low	138 Å²	138	77.9 Å²	77.9	60%	0.6	47%	0.469	S	S	*	.	H	α-helix	trans	-66.2	-44.4	175.7	-77.7	178.9	177.1	-176.7	0	112.1	V58 D59 K60 A64 A65 V66	V58-K62 HydrophobicContact CG1-CD 4.2Å; V58-K62 WeakPolarHBondContact O-CB 3.45Å; V58-K62 WeakPolarHBondContact O-CG 3.46Å; V58-K62 PolarHBondContact O-N 3.28Å; D59-K62 PolarHBondContact O-N 3.46Å; K60-K62 PolarHBondContact O-N 3.03Å; K62-A64 PolarHBondContact O-N 2.91Å; K62-A65 PolarHBondContact O-N 2.91Å; K62-V66 WeakPolarHBondContact O-CG2 3.23Å; K62-V66 PolarHBondContact O-N 2.83Å
63	K	60.1	Low	58.3	Low	134 Å²	134	78.5 Å²	78.5	58%	0.583	49%	0.485	S	S	*	.	H	α-helix	trans	-63.2	-40.2	176.7	-75.8	171	178.1	160.9	0	112.1	D59 K60 V66 A67	D59-K63 PolarHBondContact O-N 3.45Å; D59-K63 IonicContact OD1-NZ 3.88Å; D59-K63 WeakPolarHBondContact OD2-CE 3.19Å; D59-K63 IonicContact OD2-NZ 2.71Å; D59-K63 PolarHBondContact OD2-NZ 2.95Å; K60-K63 PolarHBondContact O-N 3.03Å; K63-V66 PolarHBondContact O-N 3.48Å; K63-A67 WeakPolarHBondContact O-CB 3.16Å; K63-A67 PolarHBondContact O-N 3.35Å; K63-A67 VanDerWaalsContact O-N 3.1Å
64	A	54.6	Low	58.1	Low	53 Å²	53	82 Å²	82	44%	0.438	50%	0.5	S	S	.	.	H	α-helix	trans	-68.2	-35.2	175.7	0	0	0	0	0	113	K60 K62 A67 H68	K60-A64 WeakPolarHBondContact O-CB 3.27Å; K60-A64 PolarHBondContact O-N 3.03Å; K62-A64 PolarHBondContact O-N 2.91Å; A64-A67 PolarHBondContact O-N 3.5Å; A64-H68 WeakPolarHBondContact O-CB 3.35Å; A64-H68 PolarHBondContact O-N 3.37Å
65	A	57.7	Low	57.7	Low	72 Å²	72	84.5 Å²	84.5	60%	0.595	52%	0.515	S	S	*	.	H	α-helix	trans	-67.6	-40.7	176.2	0	0	0	0	0	112.3	G61 K62	G61-A65 WeakPolarHBondContact O-CB 3.17Å; G61-A65 PolarHBondContact O-N 3Å; K62-A65 PolarHBondContact O-N 2.91Å
66	V	60.2	Low	57.2	Low	132 Å²	132	86.8 Å²	86.8	80%	0.8	52%	0.524	S	S	*	.	H	α-helix	trans	-68.6	-35	176.7	174.7	0	0	0	0	111.4	K62 K63 H68	K62-V66 WeakPolarHBondContact O-CG2 3.23Å; K62-V66 PolarHBondContact O-N 2.83Å; K63-V66 PolarHBondContact O-N 3.48Å; V66-H68 VanDerWaalsContact C-N 3.34Å; V66-H68 PolarHBondContact O-N 2.83Å
67	A	56.5	Low	56.9	Low	74 Å²	74	95.4 Å²	95.4	61%	0.612	56%	0.555	S	S	*	*	H	α-helix	trans	-74.6	-15.4	-179.2	0	0	0	0	0	114.9	K63 A64	K63-A67 WeakPolarHBondContact O-CB 3.16Å; K63-A67 PolarHBondContact O-N 3.35Å; K63-A67 VanDerWaalsContact O-N 3.1Å; A64-A67 PolarHBondContact O-N 3.5Å
68	H	50.3	Low	57	Low	122 Å²	122	97.1 Å²	97.1	57%	0.565	56%	0.561	S	S	*	*	H	α-helix	trans	-124.5	-0.4	-163.1	-88.5	-44.6	0	0	0	120	A64 V66	A64-H68 WeakPolarHBondContact O-CB 3.35Å; A64-H68 PolarHBondContact O-N 3.37Å; V66-H68 VanDerWaalsContact C-N 3.34Å; V66-H68 PolarHBondContact O-N 2.83Å
69	G	56.1	Low	56.6	Low	54 Å²	54	96.1 Å²	96.1	56%	0.557	56%	0.561	S	S	*	*			trans	58.5	156.4	165.6	0	0	0	0	0	117.5	N71	G69-N71 PolarHBondContact O-N 3.48Å; G69-N71 VanDerWaalsContact O-N 3.1Å; G69-N71 PolarHBondContact O-ND2 3.25Å
70	D	50.9	Low	56.5	Low	172 Å²	172	98 Å²	98	92%	0.92	57%	0.574	S	S	*	*			trans	-65.3	105	-166.7	-155.5	11.5	0	0	0	113.1
71	N	52.9	Low	56.4	Low	90 Å²	90	96.1 Å²	96.1	48%	0.481	58%	0.575	S	S	.	*			trans	-124.7	125	173	-81.1	-78.6	0	0	0	108.8	G69 G73 K74	G69-N71 PolarHBondContact O-N 3.48Å; G69-N71 VanDerWaalsContact O-N 3.1Å; G69-N71 PolarHBondContact O-ND2 3.25Å; N71-G73 PolarHBondContact O-N 2.83Å; N71-K74 HydrophobicContact CB-CB 4.31Å; N71-K74 HydrophobicContact CB-CD 3.99Å; N71-K74 WeakPolarHBondContact O-CB 3.44Å; N71-K74 PolarHBondContact O-N 3.47Å
72	P	41.9	Very low	56.5	Low	133 Å²	133	98 Å²	98	86%	0.864	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	130.9	-177.6	24.8	-30.9	0	0	0	111.2
73	G	53.7	Low	56.6	Low	47 Å²	47	95.8 Å²	95.8	49%	0.485	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	92.7	-6.7	-179.6	0	0	0	0	0	115.9	N71	N71-G73 PolarHBondContact O-N 2.83Å
74	K	57.4	Low	56.5	Low	81 Å²	81	92.4 Å²	92.4	35%	0.352	57%	0.567	S	S	.	*	H	α-helix	trans	-76.3	-35	-179.7	-149.3	171.9	-177.7	-179.4	0	112.4	N71 T76 R77 V78	N71-K74 HydrophobicContact CB-CB 4.31Å; N71-K74 HydrophobicContact CB-CD 3.99Å; N71-K74 WeakPolarHBondContact O-CB 3.44Å; N71-K74 PolarHBondContact O-N 3.47Å; K74-T76 PolarHBondContact O-N 3.43Å; K74-R77 PolarHBondContact O-N 3.43Å; K74-V78 HydrophobicContact CG-CG2 4.39Å; K74-V78 WeakPolarHBondContact O-CB 3.11Å; K74-V78 WeakPolarHBondContact O-CG2 3.41Å; K74-V78 PolarHBondContact O-N 2.93Å
75	T	55.1	Low	56.7	Low	113 Å²	113	94 Å²	94	69%	0.693	57%	0.572	S	S	*	*	H	α-helix	trans	-60	-39.9	177.5	28.6	0	0	0	0	112.9	A79	T75-A79 WeakPolarHBondContact O-CB 3.45Å; T75-A79 PolarHBondContact O-N 3.28Å
76	T	57.2	Low	57.1	Low	98 Å²	98	94.7 Å²	94.7	60%	0.601	56%	0.562	S	S	*	*	H	α-helix	trans	-68.5	-42	175.7	-50	0	0	0	0	111.6	K74 A79 V80	K74-T76 PolarHBondContact O-N 3.43Å; T76-A79 PolarHBondContact O-N 3.34Å; T76-V80 WeakPolarHBondContact O-CB 3.35Å; T76-V80 VanDerWaalsContact O-CG2 3.25Å; T76-V80 WeakPolarHBondContact O-CG2 3.44Å; T76-V80 PolarHBondContact O-N 3.36Å
77	R	59.8	Low	57.4	Low	206 Å²	206	91.7 Å²	91.7	78%	0.777	54%	0.543	S	S	*	.	H	α-helix	trans	-66.7	-39.5	175.9	-76.1	-176.8	-176.9	170.3	1.6	112.5	K74 A81	K74-R77 PolarHBondContact O-N 3.43Å; R77-A81 WeakPolarHBondContact O-CB 3.32Å; R77-A81 PolarHBondContact O-N 3.39Å
78	V	58.2	Low	57.8	Low	75 Å²	75	91.2 Å²	91.2	46%	0.455	53%	0.526	S	S	.	.	H	α-helix	trans	-66.7	-42.8	174.8	171.3	0	0	0	0	110.2	K74 A81 V82	K74-V78 HydrophobicContact CG-CG2 4.39Å; K74-V78 WeakPolarHBondContact O-CB 3.11Å; K74-V78 WeakPolarHBondContact O-CG2 3.41Å; K74-V78 PolarHBondContact O-N 2.93Å; V78-A81 PolarHBondContact O-N 3.48Å; V78-V82 HydrophobicContact CG1-CG2 4.31Å; V78-V82 WeakPolarHBondContact O-CB 2.96Å; V78-V82 WeakPolarHBondContact O-CG2 3.2Å; V78-V82 PolarHBondContact O-N 3.38Å
79	A	58.4	Low	58.2	Low	53 Å²	53	87.3 Å²	87.3	44%	0.438	51%	0.508	S	S	.	.	H	α-helix	trans	-62.2	-44.6	175.8	0	0	0	0	0	111.8	T75 T76 V82 V83	T75-A79 WeakPolarHBondContact O-CB 3.45Å; T75-A79 PolarHBondContact O-N 3.28Å; T76-A79 PolarHBondContact O-N 3.34Å; A79-V82 PolarHBondContact O-N 2.63Å; A79-V83 VanDerWaalsContact O-CG2 3.3Å; A79-V83 WeakPolarHBondContact O-CG2 3.42Å; A79-V83 PolarHBondContact O-N 3.4Å
80	V	63.2	Low	58.5	Low	94 Å²	94	85.9 Å²	85.9	57%	0.57	49%	0.491	S	S	*	.	H	α-helix	trans	-61.8	-45	175.2	170.4	0	0	0	0	110.8	T76 V82 V83 D84	T76-V80 WeakPolarHBondContact O-CB 3.35Å; T76-V80 VanDerWaalsContact O-CG2 3.25Å; T76-V80 WeakPolarHBondContact O-CG2 3.44Å; T76-V80 PolarHBondContact O-N 3.36Å; V80-V82 VanDerWaalsContact C-N 3.35Å; V80-V82 PolarHBondContact O-N 3.42Å; V80-V83 PolarHBondContact O-N 3.41Å; V80-D84 VanDerWaalsContact O-CB 3.29Å; V80-D84 WeakPolarHBondContact O-CB 3.29Å; V80-D84 PolarHBondContact O-N 2.93Å
81	A	57.9	Low	59	Low	51 Å²	51	81.3 Å²	81.3	42%	0.421	47%	0.466	S	S	.	.	H	α-helix	trans	-63.7	-38.6	177.2	0	0	0	0	0	112.6	R77 V78 D84 T85	R77-A81 WeakPolarHBondContact O-CB 3.32Å; R77-A81 PolarHBondContact O-N 3.39Å; V78-A81 PolarHBondContact O-N 3.48Å; A81-D84 PolarHBondContact O-N 3.17Å; A81-T85 WeakPolarHBondContact O-CB 3.27Å; A81-T85 PolarHBondContact O-N 3.29Å; A81-T85 PolarHBondContact O-OG1 3.1Å
82	V	60.9	Low	59.2	Low	67 Å²	67	77.1 Å²	77.1	41%	0.406	44%	0.443	S	S	.	.	H	α-helix	trans	-66.4	-43.8	176.1	168.4	0	0	0	0	111	V78 A79 V80 D84 T85 F86	V78-V82 HydrophobicContact CG1-CG2 4.31Å; V78-V82 WeakPolarHBondContact O-CB 2.96Å; V78-V82 WeakPolarHBondContact O-CG2 3.2Å; V78-V82 PolarHBondContact O-N 3.38Å; A79-V82 PolarHBondContact O-N 2.63Å; V80-V82 VanDerWaalsContact C-N 3.35Å; V80-V82 PolarHBondContact O-N 3.42Å; V82-D84 VanDerWaalsContact C-N 3.35Å; V82-T85 PolarHBondContact O-N 2.93Å; V82-F86 VanDerWaalsContact O-CB 3.28Å; V82-F86 WeakPolarHBondContact O-CB 3.3Å; V82-F86 PolarHBondContact O-N 2.99Å
83	V	66.3	Low	59.9	Low	91 Å²	91	72.3 Å²	72.3	55%	0.552	41%	0.413	S	S	*	.	H	α-helix	trans	-63.2	-43.8	175.5	170.7	0	0	0	0	110.5	A79 V80 F86 V87	A79-V83 VanDerWaalsContact O-CG2 3.3Å; A79-V83 WeakPolarHBondContact O-CG2 3.42Å; A79-V83 PolarHBondContact O-N 3.4Å; V80-V83 PolarHBondContact O-N 3.41Å; V83-F86 PolarHBondContact O-N 3.07Å; V83-V87 HydrophobicContact CG1-CG2 4.25Å; V83-V87 WeakPolarHBondContact O-CB 3.42Å; V83-V87 VanDerWaalsContact O-CG2 3.27Å; V83-V87 WeakPolarHBondContact O-CG2 3.28Å; V83-V87 PolarHBondContact O-N 3.03Å
84	D	56.5	Low	60	Low	62 Å²	62	70.7 Å²	70.7	33%	0.332	39%	0.394	S	S	.	.	H	α-helix	trans	-64.7	-42.7	179.6	-156.6	60.1	0	0	0	111.2	V80 A81 V82 F86 V87 W88 L154	V80-D84 VanDerWaalsContact O-CB 3.29Å; V80-D84 WeakPolarHBondContact O-CB 3.29Å; V80-D84 PolarHBondContact O-N 2.93Å; A81-D84 PolarHBondContact O-N 3.17Å; V82-D84 VanDerWaalsContact C-N 3.35Å; D84-F86 PolarHBondContact O-N 2.82Å; D84-V87 PolarHBondContact O-N 3.34Å; D84-W88 WeakPolarHBondContact O-CB 3.44Å; D84-W88 PolarHBondContact O-N 3.17Å; D84-L154 WeakPolarHBondContact OD2-CD2 3.06Å
85	T	59.8	Low	60.3	Low	86 Å²	86	71.2 Å²	71.2	53%	0.528	40%	0.4	S	S	.	.	H	α-helix	trans	-63.5	-42.3	174.4	-47.4	0	0	0	0	110.9	A81 V82 W88 Q89	A81-T85 WeakPolarHBondContact O-CB 3.27Å; A81-T85 PolarHBondContact O-N 3.29Å; A81-T85 PolarHBondContact O-OG1 3.1Å; V82-T85 PolarHBondContact O-N 2.93Å; T85-W88 PolarHBondContact O-N 2.96Å; T85-Q89 WeakPolarHBondContact O-CB 3.37Å; T85-Q89 PolarHBondContact O-N 3Å
86	F	66.9	Low	60.7	Low	88 Å²	88	69 Å²	69	39%	0.386	38%	0.382	S	S	.	.	H	α-helix	trans	-65.4	-45.4	178.6	-178.1	-97.5	0	0	0	112	T50 V53 V82 V83 D84 Q89 A90	T50-F86 HydrophobicContact CG2-CZ 4.45Å; V53-F86 HydrophobicContact CG1-CD2 4.29Å; V53-F86 HydrophobicContact CG1-CE2 4.37Å; V82-F86 VanDerWaalsContact O-CB 3.28Å; V82-F86 WeakPolarHBondContact O-CB 3.3Å; V82-F86 PolarHBondContact O-N 2.99Å; V83-F86 PolarHBondContact O-N 3.07Å; D84-F86 PolarHBondContact O-N 2.82Å; F86-Q89 PolarHBondContact O-N 3.38Å; F86-A90 WeakPolarHBondContact O-CB 3.38Å; F86-A90 PolarHBondContact O-N 3.2Å
87	V	65.1	Low	61	Low	68 Å²	68	64.5 Å²	64.5	41%	0.412	36%	0.355	S	S	.	.	H	α-helix	trans	-63.9	-44.8	177.2	169.3	0	0	0	0	110.2	V83 D84 A90 L91	V83-V87 HydrophobicContact CG1-CG2 4.25Å; V83-V87 WeakPolarHBondContact O-CB 3.42Å; V83-V87 VanDerWaalsContact O-CG2 3.27Å; V83-V87 WeakPolarHBondContact O-CG2 3.28Å; V83-V87 PolarHBondContact O-N 3.03Å; D84-V87 PolarHBondContact O-N 3.34Å; V87-A90 PolarHBondContact O-N 2.9Å; V87-L91 HydrophobicContact CG1-CD1 3.78Å; V87-L91 HydrophobicContact CG1-CG 4.48Å; V87-L91 WeakPolarHBondContact O-CB 3.48Å; V87-L91 VanDerWaalsContact O-CG 3.23Å; V87-L91 WeakPolarHBondContact O-CG 3.17Å; V87-L91 PolarHBondContact O-N 3.32Å
88	W	64.6	Low	61.2	Low	65 Å²	65	54.7 Å²	54.7	25%	0.246	32%	0.318	C	S	.	.	H	α-helix	trans	-59.5	-48.6	175.5	-179.2	83.4	0	0	0	111.5	D84 T85 A90 L91 A92 V146 L150	D84-W88 WeakPolarHBondContact O-CB 3.44Å; D84-W88 PolarHBondContact O-N 3.17Å; T85-W88 PolarHBondContact O-N 2.96Å; W88-A90 PolarHBondContact O-N 3.19Å; W88-L91 PolarHBondContact O-N 3.42Å; W88-A92 HydrophobicContact CD2-CB 4.18Å; W88-A92 HydrophobicContact CE3-CB 4.14Å; W88-A92 HydrophobicContact CH2-CB 4.37Å; W88-A92 HydrophobicContact CZ2-CB 4.49Å; W88-A92 HydrophobicContact CZ3-CB 4.18Å; W88-A92 WeakPolarHBondContact O-CB 3.21Å; W88-A92 PolarHBondContact O-N 3.38Å; W88-V146 HydrophobicContact CD2-CG1 3.96Å; W88-V146 HydrophobicContact CG-CG1 4.47Å; W88-V146 HydrophobicContact CH2-CG1 3.96Å; W88-V146 HydrophobicContact CZ2-CB 4.38Å; W88-V146 HydrophobicContact CZ2-CG1 3.09Å; W88-V146 PolarHBondContact NE1-O 2.74Å; W88-L150 HydrophobicContact CB-CD2 4.2Å; W88-L150 HydrophobicContact CD2-CD1 3.69Å; W88-L150 HydrophobicContact CD2-CG 4.4Å; W88-L150 HydrophobicContact CG-CD1 3.58Å; W88-L150 HydrophobicContact CG-CD2 3.89Å; W88-L150 HydrophobicContact CG-CG 3.86Å; W88-L150 HydrophobicContact CZ2-CD1 3.87Å
89	Q	58.8	Low	61.8	Low	40 Å²	40	56.6 Å²	56.6	19%	0.187	32%	0.321	C	S	.	.	H	α-helix	trans	-72.9	-32.3	-174.8	-145.9	-122	-76.2	0	0	111.9	V53 T85 F86 S93	V53-Q89 VanDerWaalsContact CG2-CD 3.48Å; T85-Q89 WeakPolarHBondContact O-CB 3.37Å; T85-Q89 PolarHBondContact O-N 3Å; F86-Q89 PolarHBondContact O-N 3.38Å; Q89-S93 VanDerWaalsContact O-CB 3.29Å; Q89-S93 WeakPolarHBondContact O-CB 3.49Å; Q89-S93 PolarHBondContact O-N 2.74Å; Q89-S93 PolarHBondContact O-OG 3.28Å
90	A	64.2	Low	62.2	Low	24 Å²	24	56.4 Å²	56.4	20%	0.198	31%	0.314	C	S	.	.	I	π-helix	trans	-64.5	-43	169.7	0	0	0	0	0	111.4	F86 V87 W88 V94 I95	F86-A90 WeakPolarHBondContact O-CB 3.38Å; F86-A90 PolarHBondContact O-N 3.2Å; V87-A90 PolarHBondContact O-N 2.9Å; W88-A90 PolarHBondContact O-N 3.19Å; A90-V94 CarbonylContact O-C 3.58Å; A90-V94 WeakPolarHBondContact O-CA 3.29Å; A90-V94 VanDerWaalsContact O-CB 3.28Å; A90-V94 WeakPolarHBondContact O-CB 3.38Å; A90-V94 PolarHBondContact O-N 3.28Å; A90-V94 VanDerWaalsContact O-N 3.17Å; A90-I95 HydrophobicContact CB-CD1 4.34Å; A90-I95 WeakPolarHBondContact O-CG1 3.26Å; A90-I95 PolarHBondContact O-N 3.08Å
91	L	59.9	Low	62.6	Low	75 Å²	75	52 Å²	52	39%	0.393	29%	0.287	S	S	.	.	I	π-helix	trans	-69.4	-49.6	177.3	-72	169.1	0	0	0	111.6	V87 W88 I95 I96	V87-L91 HydrophobicContact CG1-CD1 3.78Å; V87-L91 HydrophobicContact CG1-CG 4.48Å; V87-L91 WeakPolarHBondContact O-CB 3.48Å; V87-L91 VanDerWaalsContact O-CG 3.23Å; V87-L91 WeakPolarHBondContact O-CG 3.17Å; V87-L91 PolarHBondContact O-N 3.32Å; W88-L91 PolarHBondContact O-N 3.42Å; L91-I95 HydrophobicContact CD2-CB 4.35Å; L91-I95 HydrophobicContact CD2-CD1 3.91Å; L91-I95 HydrophobicContact CD2-CG2 4.38Å; L91-I95 HydrophobicContact CG-CD1 4.48Å; L91-I96 HydrophobicContact CB-CD1 4.25Å; L91-I96 VanDerWaalsContact O-CB 3.3Å; L91-I96 WeakPolarHBondContact O-CB 3.46Å; L91-I96 WeakPolarHBondContact O-CD1 3.28Å; L91-I96 WeakPolarHBondContact O-CG1 3.3Å; L91-I96 PolarHBondContact O-N 3.43Å
92	A	58.6	Low	63.1	Low	2 Å²	2	51.1 Å²	51.1	2%	0.017	28%	0.275	C	S	.	.	I	π-helix	trans	-64.4	-47.7	-174.9	0	0	0	0	0	113.4	W88 P97 V146	W88-A92 HydrophobicContact CD2-CB 4.18Å; W88-A92 HydrophobicContact CE3-CB 4.14Å; W88-A92 HydrophobicContact CH2-CB 4.37Å; W88-A92 HydrophobicContact CZ2-CB 4.49Å; W88-A92 HydrophobicContact CZ3-CB 4.18Å; W88-A92 WeakPolarHBondContact O-CB 3.21Å; W88-A92 PolarHBondContact O-N 3.38Å; A92-P97 WeakPolarHBondContact O-CD 3.4Å; A92-P97 WeakPolarHBondContact O-CG 3.48Å; A92-V146 HydrophobicContact CB-CB 4.27Å; A92-V146 HydrophobicContact CB-CG1 3.35Å; A92-V146 HydrophobicContact CB-CG2 3.97Å
93	S	55.5	Low	63.9	Low	33 Å²	33	54.6 Å²	54.6	23%	0.231	28%	0.281	C	S	.	.	I	π-helix	trans	-101.9	-24.5	-169.8	-47.5	0	0	0	0	112.7	N27 Q89	N27-S93 PolarHBondContact ND2-O 3.15Å; Q89-S93 VanDerWaalsContact O-CB 3.29Å; Q89-S93 WeakPolarHBondContact O-CB 3.49Å; Q89-S93 PolarHBondContact O-N 2.74Å; Q89-S93 PolarHBondContact O-OG 3.28Å
94	V	56.3	Low	64.4	Low	12 Å²	12	52.2 Å²	52.2	7%	0.073	27%	0.267	C	S	.	.	I	π-helix	trans	-115.8	-54	-165.6	-174.5	0	0	0	0	112.5	Y46 A90 G98	Y46-V94 HydrophobicContact CD1-CG1 3.29Å; Y46-V94 HydrophobicContact CE1-CG1 3.38Å; A90-V94 CarbonylContact O-C 3.58Å; A90-V94 WeakPolarHBondContact O-CA 3.29Å; A90-V94 VanDerWaalsContact O-CB 3.28Å; A90-V94 WeakPolarHBondContact O-CB 3.38Å; A90-V94 PolarHBondContact O-N 3.28Å; A90-V94 VanDerWaalsContact O-N 3.17Å; V94-G98 PolarHBondContact O-N 2.95Å
95	I	62.5	Low	65.2	Low	93 Å²	93	49.8 Å²	49.8	48%	0.477	25%	0.254	S	S	.	.	I	π-helix	trans	-81.1	-51.5	-171.1	-62.3	166.4	0	0	0	110.8	A90 L91 F99	A90-I95 HydrophobicContact CB-CD1 4.34Å; A90-I95 WeakPolarHBondContact O-CG1 3.26Å; A90-I95 PolarHBondContact O-N 3.08Å; L91-I95 HydrophobicContact CD2-CB 4.35Å; L91-I95 HydrophobicContact CD2-CD1 3.91Å; L91-I95 HydrophobicContact CD2-CG2 4.38Å; L91-I95 HydrophobicContact CG-CD1 4.48Å; I95-F99 WeakPolarHBondContact O-CB 3.17Å; I95-F99 PolarHBondContact O-N 3.38Å
96	I	63.6	Low	65.8	Low	65 Å²	65	47.9 Å²	47.9	33%	0.333	25%	0.247	S	C	.	.	H	α-helix	trans	-71.8	-48.8	-173.8	-58.4	169.3	0	0	0	111.7	L91 T100 I142	L91-I96 HydrophobicContact CB-CD1 4.25Å; L91-I96 VanDerWaalsContact O-CB 3.3Å; L91-I96 WeakPolarHBondContact O-CB 3.46Å; L91-I96 WeakPolarHBondContact O-CD1 3.28Å; L91-I96 WeakPolarHBondContact O-CG1 3.3Å; L91-I96 PolarHBondContact O-N 3.43Å; I96-T100 WeakPolarHBondContact O-CB 3.1Å; I96-T100 PolarHBondContact O-N 2.9Å; I96-T100 PolarHBondContact O-OG1 3.49Å; I96-I142 HydrophobicContact CG2-CD1 3.81Å; I96-I142 HydrophobicContact CG2-CG1 4.45Å
97	P	64.6	Low	66.5	Low	4 Å²	4	45.9 Å²	45.9	3%	0.026	25%	0.247	C	C	.	.	H	α-helix	trans	-64.7	-45.4	177.2	-19.4	32	0	0	0	111.7	E28 A92 F99 T100 I101 I142	E28-P97 HydrophobicContact CG-CB 4.03Å; E28-P97 WeakPolarHBondContact OE1-CB 3.25Å; A92-P97 WeakPolarHBondContact O-CD 3.4Å; A92-P97 WeakPolarHBondContact O-CG 3.48Å; P97-F99 PolarHBondContact O-N 3.31Å; P97-T100 PolarHBondContact O-N 2.78Å; P97-I101 WeakPolarHBondContact O-CG1 3.49Å; P97-I101 PolarHBondContact O-N 3.22Å; P97-I142 HydrophobicContact CB-CD1 4.21Å; P97-I142 HydrophobicContact CG-CD1 3.91Å; P97-I142 HydrophobicContact CG-CG2 4.38Å
98	G	64.6	Low	67	Low	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62	-44.4	179.9	0	0	0	0	0	113	Y46 V94 T100 N102	Y46-G98 WeakPolarHBondContact OH-CA 3.37Å; V94-G98 PolarHBondContact O-N 2.95Å; G98-T100 PolarHBondContact O-N 3.18Å; G98-N102 VanDerWaalsContact O-CB 3.28Å; G98-N102 WeakPolarHBondContact O-CB 3.39Å; G98-N102 PolarHBondContact O-N 3Å
99	F	69.2	Low	67.5	Low	116 Å²	116	43.4 Å²	43.4	51%	0.509	24%	0.238	S	C	.	.	H	α-helix	trans	-64.1	-40.5	175.4	-177.8	-98.9	0	0	0	112.3	I95 P97 N102 R103	I95-F99 WeakPolarHBondContact O-CB 3.17Å; I95-F99 PolarHBondContact O-N 3.38Å; P97-F99 PolarHBondContact O-N 3.31Å; F99-N102 PolarHBondContact O-N 2.97Å; F99-R103 HydrophobicContact CD1-CG 4.2Å; F99-R103 HydrophobicContact CE1-CG 3.76Å; F99-R103 HydrophobicContact CE2-CG 4.33Å; F99-R103 HydrophobicContact CZ-CG 3.83Å; F99-R103 WeakPolarHBondContact O-CB 3.33Å; F99-R103 WeakPolarHBondContact O-CG 3.27Å; F99-R103 PolarHBondContact O-N 3.43Å
100	T	67.7	Low	68.5	Low	49 Å²	49	48.7 Å²	48.7	30%	0.301	26%	0.257	S	S	.	.	H	α-helix	trans	-64.1	-48.3	179.5	-58	0	0	0	0	111	I96 P97 G98 N102 R103 V104 I138	I96-T100 WeakPolarHBondContact O-CB 3.1Å; I96-T100 PolarHBondContact O-N 2.9Å; I96-T100 PolarHBondContact O-OG1 3.49Å; P97-T100 PolarHBondContact O-N 2.78Å; G98-T100 PolarHBondContact O-N 3.18Å; T100-N102 VanDerWaalsContact C-N 3.35Å; T100-N102 PolarHBondContact O-N 3.37Å; T100-R103 PolarHBondContact O-N 3.08Å; T100-V104 WeakPolarHBondContact O-CG2 3.43Å; T100-V104 PolarHBondContact O-N 3.48Å; T100-I138 HydrophobicContact CG2-CD1 3.68Å; T100-I138 HydrophobicContact CG2-CG1 4.35Å
101	I	70.9	Confident	69.2	Low	1 Å²	1	52.2 Å²	52.2	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-64.2	-40.6	178.1	-69	172.9	0	0	0	111.1	E28 E31 P97 R103 V104 C105 I135 I138	E28-I101 HydrophobicContact CB-CD1 3.61Å; E28-I101 HydrophobicContact CG-CD1 3.81Å; E31-I101 HydrophobicContact CB-CB 4.5Å; E31-I101 HydrophobicContact CB-CG2 4Å; P97-I101 WeakPolarHBondContact O-CG1 3.49Å; P97-I101 PolarHBondContact O-N 3.22Å; I101-R103 VanDerWaalsContact C-N 3.35Å; I101-R103 PolarHBondContact O-N 3.2Å; I101-V104 PolarHBondContact O-N 2.88Å; I101-C105 WeakPolarHBondContact O-CB 3.28Å; I101-C105 PolarHBondContact O-N 3.39Å; I101-C105 PolarHBondContact O-SG 3.43Å; I101-I135 HydrophobicContact CD1-CG1 3.74Å; I101-I138 HydrophobicContact CG1-CD1 3.83Å
102	N	69.7	Low	70	Confident	32 Å²	32	50 Å²	50	17%	0.171	26%	0.26	C	S	.	.	H	α-helix	trans	-60.3	-43.6	175.1	-177.1	31.6	0	0	0	111.8	E31 G98 F99 T100 A106	E31-N102 VanDerWaalsContact OE2-CB 3.27Å; E31-N102 WeakPolarHBondContact OE2-CB 3.21Å; E31-N102 PolarHBondContact OE2-OD1 3.19Å; G98-N102 VanDerWaalsContact O-CB 3.28Å; G98-N102 WeakPolarHBondContact O-CB 3.39Å; G98-N102 PolarHBondContact O-N 3Å; F99-N102 PolarHBondContact O-N 2.97Å; T100-N102 VanDerWaalsContact C-N 3.35Å; T100-N102 PolarHBondContact O-N 3.37Å; N102-A106 VanDerWaalsContact O-CB 3.22Å; N102-A106 WeakPolarHBondContact O-CB 3.29Å; N102-A106 PolarHBondContact O-N 2.88Å
103	R	76.6	Confident	70.7	Confident	141 Å²	141	51.6 Å²	51.6	53%	0.532	28%	0.277	S	S	.	.	H	α-helix	trans	-66	-42.1	176.1	-78.5	-66.5	108.3	127.8	2.7	112.3	F99 T100 I101 A106 A107	F99-R103 HydrophobicContact CD1-CG 4.2Å; F99-R103 HydrophobicContact CE1-CG 3.76Å; F99-R103 HydrophobicContact CE2-CG 4.33Å; F99-R103 HydrophobicContact CZ-CG 3.83Å; F99-R103 WeakPolarHBondContact O-CB 3.33Å; F99-R103 WeakPolarHBondContact O-CG 3.27Å; F99-R103 PolarHBondContact O-N 3.43Å; T100-R103 PolarHBondContact O-N 3.08Å; I101-R103 VanDerWaalsContact C-N 3.35Å; I101-R103 PolarHBondContact O-N 3.2Å; R103-A106 PolarHBondContact O-N 2.91Å; R103-A107 VanDerWaalsContact O-CB 3.22Å; R103-A107 WeakPolarHBondContact O-CB 3.22Å; R103-A107 PolarHBondContact O-N 2.99Å
104	V	76.8	Confident	71.8	Confident	41 Å²	41	57.5 Å²	57.5	25%	0.248	30%	0.298	C	S	.	.	H	α-helix	trans	-61.9	-49.7	175.7	169.9	0	0	0	0	110.2	T100 I101 A106 A107 S108 I130 T134	T100-V104 WeakPolarHBondContact O-CG2 3.43Å; T100-V104 PolarHBondContact O-N 3.48Å; I101-V104 PolarHBondContact O-N 2.88Å; V104-A106 PolarHBondContact O-N 3.48Å; V104-A107 PolarHBondContact O-N 3.15Å; V104-S108 WeakPolarHBondContact O-CB 3.19Å; V104-S108 PolarHBondContact O-N 2.92Å; V104-S108 PolarHBondContact O-OG 2.89Å; V104-I130 HydrophobicContact CG1-CG2 4.13Å; V104-T134 HydrophobicContact CG1-CG2 4.48Å
105	C	73.6	Confident	72.7	Confident	10 Å²	10	61.6 Å²	61.6	7%	0.068	33%	0.328	C	S	.	.	H	α-helix	trans	-61.5	-43.8	178.3	-68.7	0	0	0	0	111.9	I101 S108 L109 T127	I101-C105 WeakPolarHBondContact O-CB 3.28Å; I101-C105 PolarHBondContact O-N 3.39Å; I101-C105 PolarHBondContact O-SG 3.43Å; C105-S108 PolarHBondContact O-N 3.23Å; C105-L109 WeakPolarHBondContact O-CB 3.5Å; C105-L109 PolarHBondContact O-N 2.94Å; C105-T127 HydrophobicContact CB-CG2 3.71Å; C105-T127 WeakPolarHBondContact O-CG2 3.45Å
106	A	73.3	Confident	73.1	Confident	46 Å²	46	59 Å²	59	38%	0.38	32%	0.317	S	S	.	.	H	α-helix	trans	-63.3	-43.3	176.9	0	0	0	0	0	112.2	N102 R103 V104 Y110	N102-A106 VanDerWaalsContact O-CB 3.22Å; N102-A106 WeakPolarHBondContact O-CB 3.29Å; N102-A106 PolarHBondContact O-N 2.88Å; R103-A106 PolarHBondContact O-N 2.91Å; V104-A106 PolarHBondContact O-N 3.48Å; A106-Y110 VanDerWaalsContact O-CB 3.25Å; A106-Y110 WeakPolarHBondContact O-CB 3.43Å; A106-Y110 PolarHBondContact O-N 2.96Å
107	A	79.8	Confident	74	Confident	47 Å²	47	66 Å²	66	39%	0.388	34%	0.344	S	S	.	.	H	α-helix	trans	-66	-44.5	177.3	0	0	0	0	0	111.7	R103 V104 Y110 L111	R103-A107 VanDerWaalsContact O-CB 3.22Å; R103-A107 WeakPolarHBondContact O-CB 3.22Å; R103-A107 PolarHBondContact O-N 2.99Å; V104-A107 PolarHBondContact O-N 3.15Å; A107-Y110 PolarHBondContact O-N 3.35Å; A107-L111 VanDerWaalsContact O-CB 3.3Å; A107-L111 WeakPolarHBondContact O-CB 3.05Å; A107-L111 VanDerWaalsContact O-CG 3.29Å; A107-L111 WeakPolarHBondContact O-CG 3.35Å; A107-L111 PolarHBondContact O-N 3.48Å
108	S	75.6	Confident	74.6	Confident	18 Å²	18	71.7 Å²	71.7	13%	0.126	37%	0.365	C	S	.	.	H	α-helix	trans	-61.2	-45.2	176.2	-64.8	0	0	0	0	111.6	V104 C105 L111 L112	V104-S108 WeakPolarHBondContact O-CB 3.19Å; V104-S108 PolarHBondContact O-N 2.92Å; V104-S108 PolarHBondContact O-OG 2.89Å; C105-S108 PolarHBondContact O-N 3.23Å; S108-L111 PolarHBondContact O-N 2.72Å; S108-L112 WeakPolarHBondContact O-CB 3.16Å; S108-L112 VanDerWaalsContact O-CD1 3.3Å; S108-L112 WeakPolarHBondContact O-CD1 3.41Å; S108-L112 PolarHBondContact O-N 3.06Å
109	L	76.1	Confident	75.3	Confident	63 Å²	63	75.6 Å²	75.6	33%	0.33	39%	0.391	S	S	.	.	H	α-helix	trans	-65.6	-41.3	178.1	-170.5	67.4	0	0	0	111.9	C105 G113 R123 T127	C105-L109 WeakPolarHBondContact O-CB 3.5Å; C105-L109 PolarHBondContact O-N 2.94Å; L109-G113 PolarHBondContact O-N 3.47Å; L109-R123 HydrophobicContact CD1-CB 3.93Å; L109-T127 HydrophobicContact CB-CG2 4.11Å; L109-T127 WeakPolarHBondContact CD1-OG1 3.4Å
110	Y	78.7	Confident	75.5	Confident	151 Å²	151	75.6 Å²	75.6	59%	0.592	40%	0.395	S	S	*	.	H	α-helix	trans	-64.6	-46	176.8	177.7	-102.2	0	0	0	112	A106 A107 G113 K114	A106-Y110 VanDerWaalsContact O-CB 3.25Å; A106-Y110 WeakPolarHBondContact O-CB 3.43Å; A106-Y110 PolarHBondContact O-N 2.96Å; A107-Y110 PolarHBondContact O-N 3.35Å; Y110-G113 WeakPolarHBondContact O-CA 3.25Å; Y110-G113 PolarHBondContact O-N 2.86Å; Y110-K114 PolarHBondContact O-N 2.93Å
111	L	79.9	Confident	75.9	Confident	98 Å²	98	77.1 Å²	77.1	51%	0.513	41%	0.406	S	S	.	.	H	α-helix	trans	-65.1	-43.6	176.8	-75.1	171.1	0	0	0	111.8	A107 S108 G113 K114 S115	A107-L111 VanDerWaalsContact O-CB 3.3Å; A107-L111 WeakPolarHBondContact O-CB 3.05Å; A107-L111 VanDerWaalsContact O-CG 3.29Å; A107-L111 WeakPolarHBondContact O-CG 3.35Å; A107-L111 PolarHBondContact O-N 3.48Å; S108-L111 PolarHBondContact O-N 2.72Å; L111-G113 VanDerWaalsContact C-N 3.26Å; L111-G113 PolarHBondContact O-N 2.76Å; L111-K114 PolarHBondContact O-N 3.34Å; L111-S115 VanDerWaalsContact O-CB 3.31Å; L111-S115 WeakPolarHBondContact O-CB 3.08Å; L111-S115 PolarHBondContact O-N 3.03Å; L111-S115 PolarHBondContact O-OG 3.42Å
112	L	76.4	Confident	76.3	Confident	27 Å²	27	80.2 Å²	80.2	14%	0.141	43%	0.425	C	S	.	.	H	α-helix	trans	-61.9	-38.1	172.8	-97.7	71.3	0	0	0	111	S108 K114 T116 W118 R123 T126	S108-L112 WeakPolarHBondContact O-CB 3.16Å; S108-L112 VanDerWaalsContact O-CD1 3.3Å; S108-L112 WeakPolarHBondContact O-CD1 3.41Å; S108-L112 PolarHBondContact O-N 3.06Å; L112-K114 VanDerWaalsContact C-N 3.3Å; L112-K114 PolarHBondContact O-N 3.37Å; L112-T116 PolarHBondContact O-N 2.99Å; L112-T116 VanDerWaalsContact O-O 3.07Å; L112-T116 PolarHBondContact O-OG1 2.83Å; L112-W118 HydrophobicContact CD2-CE3 3.94Å; L112-W118 HydrophobicContact CD2-CZ3 3.99Å; L112-R123 HydrophobicContact CB-CB 4.49Å; L112-R123 HydrophobicContact CB-CG 4.18Å; L112-R123 HydrophobicContact CD2-CB 4.23Å; L112-R123 HydrophobicContact CD2-CG 4.24Å; L112-R123 PolarHBondContact O-NE 3.37Å; L112-T126 HydrophobicContact CD2-CG2 3.82Å
113	G	73.7	Confident	76.6	Confident	36 Å²	36	80.7 Å²	80.7	37%	0.371	43%	0.425	S	S	.	.	H	α-helix	trans	-60.1	-38.1	175.1	0	0	0	0	0	113.7	L109 Y110 L111	L109-G113 PolarHBondContact O-N 3.47Å; Y110-G113 WeakPolarHBondContact O-CA 3.25Å; Y110-G113 PolarHBondContact O-N 2.86Å; L111-G113 VanDerWaalsContact C-N 3.26Å; L111-G113 PolarHBondContact O-N 2.76Å
114	K	78	Confident	76.4	Confident	157 Å²	157	78 Å²	78	68%	0.683	42%	0.417	S	S	*	.	H	α-helix	trans	-90.1	-34.9	-175.9	-162.5	176.4	-179.1	179.3	0	113.6	Y110 L111 L112	Y110-K114 PolarHBondContact O-N 2.93Å; L111-K114 PolarHBondContact O-N 3.34Å; L112-K114 VanDerWaalsContact C-N 3.3Å; L112-K114 PolarHBondContact O-N 3.37Å
115	S	74.9	Confident	76.3	Confident	99 Å²	99	84 Å²	84	69%	0.692	44%	0.435	S	S	*	.	H	α-helix	trans	-100.2	-17.6	-173	-64.3	0	0	0	0	114.4	L111	L111-S115 VanDerWaalsContact O-CB 3.31Å; L111-S115 WeakPolarHBondContact O-CB 3.08Å; L111-S115 PolarHBondContact O-N 3.03Å; L111-S115 PolarHBondContact O-OG 3.42Å
116	T	72.6	Confident	76.6	Confident	39 Å²	39	85.6 Å²	85.6	24%	0.239	45%	0.445	C	S	.	.			trans	-127.2	143.6	-179.6	57.9	0	0	0	0	112	L112 W118 R123	L112-T116 PolarHBondContact O-N 2.99Å; L112-T116 VanDerWaalsContact O-O 3.07Å; L112-T116 PolarHBondContact O-OG1 2.83Å; T116-W118 HydrophobicContact CG2-CD2 4.3Å; T116-W118 HydrophobicContact CG2-CZ2 4.47Å; T116-W118 PolarHBondContact O-N 2.93Å; T116-R123 PolarHBondContact O-NH2 3.31Å
117	K	81.4	Confident	76.8	Confident	211 Å²	211	83.5 Å²	83.5	92%	0.917	43%	0.427	S	S	*	.			trans	-83.9	20.3	172.9	-66.1	-172.1	-178.7	-178.8	0	113.4
118	W	77.8	Confident	76.6	Confident	123 Å²	123	81.4 Å²	81.4	47%	0.466	41%	0.409	S	S	.	.			trans	-65.3	147.4	-175.5	-67.6	-8.5	0	0	0	112.6	L112 T116 V122 R123 T126	L112-W118 HydrophobicContact CD2-CE3 3.94Å; L112-W118 HydrophobicContact CD2-CZ3 3.99Å; T116-W118 HydrophobicContact CG2-CD2 4.3Å; T116-W118 HydrophobicContact CG2-CZ2 4.47Å; T116-W118 PolarHBondContact O-N 2.93Å; W118-V122 HydrophobicContact CB-CG1 4.49Å; W118-V122 HydrophobicContact CD2-CG1 4.27Å; W118-V122 HydrophobicContact CE3-CG1 3.86Å; W118-V122 HydrophobicContact CZ3-CG1 4.45Å; W118-R123 HydrophobicContact CB-CG 3.99Å; W118-R123 PolarHBondContact O-NE 2.91Å; W118-R123 PolarHBondContact O-NH2 2.82Å; W118-T126 HydrophobicContact CZ3-CG2 4.4Å
119	P	79.1	Confident	76.7	Confident	82 Å²	82	83.2 Å²	83.2	53%	0.532	43%	0.426	S	S	.	.			trans	-65.6	148.3	175.3	26.7	-32.4	0	0	0	110.8	P121 V122 R123	P119-P121 VanDerWaalsContact C-N 3.34Å; P119-V122 HydrophobicContact CG-CB 4.31Å; P119-V122 HydrophobicContact CG-CG2 3.83Å; P119-V122 PolarHBondContact O-N 3.39Å; P119-R123 PolarHBondContact O-N 3.29Å
120	L	73.3	Confident	76.8	Confident	116 Å²	116	82.6 Å²	82.6	61%	0.607	42%	0.422	S	S	*	.	H	α-helix	trans	-51.6	-39.4	-174	-69.2	170.7	0	0	0	114.9	V122 R123 K124	L120-V122 PolarHBondContact O-N 3.47Å; L120-R123 PolarHBondContact O-N 3.15Å; L120-K124 VanDerWaalsContact O-CG 3.31Å; L120-K124 WeakPolarHBondContact O-CG 3.38Å; L120-K124 PolarHBondContact O-N 2.97Å
121	P	76.4	Confident	76.6	Confident	82 Å²	82	75.4 Å²	75.4	53%	0.532	39%	0.394	S	S	.	.	H	α-helix	trans	-61.9	-42.4	177.5	-23.1	34.7	0	0	0	112.5	P119 K124 W125	P119-P121 VanDerWaalsContact C-N 3.34Å; P121-K124 PolarHBondContact O-N 3.27Å; P121-W125 VanDerWaalsContact O-CD1 3.28Å; P121-W125 PolarHBondContact O-N 3.37Å
122	V	78.4	Confident	76.2	Confident	66 Å²	66	73.9 Å²	73.9	40%	0.4	39%	0.386	S	S	.	.	H	α-helix	trans	-64.5	-44.7	179.4	177.3	0	0	0	0	109.9	W118 P119 L120 K124 W125 T126	W118-V122 HydrophobicContact CB-CG1 4.49Å; W118-V122 HydrophobicContact CD2-CG1 4.27Å; W118-V122 HydrophobicContact CE3-CG1 3.86Å; W118-V122 HydrophobicContact CZ3-CG1 4.45Å; P119-V122 HydrophobicContact CG-CB 4.31Å; P119-V122 HydrophobicContact CG-CG2 3.83Å; P119-V122 PolarHBondContact O-N 3.39Å; L120-V122 PolarHBondContact O-N 3.47Å; V122-K124 VanDerWaalsContact C-N 3.31Å; V122-K124 PolarHBondContact O-N 3.37Å; V122-W125 PolarHBondContact O-N 3.23Å; V122-T126 WeakPolarHBondContact O-CB 3.25Å; V122-T126 PolarHBondContact O-N 3.35Å; V122-T126 PolarHBondContact O-OG1 3.37Å
123	R	76.1	Confident	76.3	Confident	42 Å²	42	75.9 Å²	75.9	16%	0.158	40%	0.402	C	S	.	.	H	α-helix	trans	-59.4	-40.7	176.6	-62.7	-171.8	-176.1	145.4	10.5	112.7	L109 L112 T116 W118 P119 L120 T127	L109-R123 HydrophobicContact CD1-CB 3.93Å; L112-R123 HydrophobicContact CB-CB 4.49Å; L112-R123 HydrophobicContact CB-CG 4.18Å; L112-R123 HydrophobicContact CD2-CB 4.23Å; L112-R123 HydrophobicContact CD2-CG 4.24Å; L112-R123 PolarHBondContact O-NE 3.37Å; T116-R123 PolarHBondContact O-NH2 3.31Å; W118-R123 HydrophobicContact CB-CG 3.99Å; W118-R123 PolarHBondContact O-NE 2.91Å; W118-R123 PolarHBondContact O-NH2 2.82Å; P119-R123 PolarHBondContact O-N 3.29Å; L120-R123 PolarHBondContact O-N 3.15Å; R123-T127 WeakPolarHBondContact O-CB 3.43Å; R123-T127 PolarHBondContact O-N 3.43Å; R123-T127 PolarHBondContact O-OG1 3.2Å
124	K	72.3	Confident	76.1	Confident	85 Å²	85	75.6 Å²	75.6	37%	0.37	39%	0.393	S	S	.	.	H	α-helix	trans	-66.3	-47.8	178.3	-71.2	175.8	166.9	-150.7	0	111.8	A35 L36 L120 P121 V122 T127 T128	A35-K124 HydrophobicContact CB-CB 4.15Å; A35-K124 HydrophobicContact CB-CG 4.16Å; A35-K124 VanDerWaalsContact O-CD 3.24Å; A35-K124 WeakPolarHBondContact O-CD 3.35Å; A35-K124 WeakPolarHBondContact O-CE 3.46Å; A35-K124 PolarHBondContact O-NZ 3.47Å; A35-K124 VanDerWaalsContact O-NZ 3.15Å; L36-K124 HydrophobicContact CD2-CB 3.74Å; L36-K124 HydrophobicContact CD2-CD 4.44Å; L36-K124 HydrophobicContact CG-CB 4.47Å; L120-K124 VanDerWaalsContact O-CG 3.31Å; L120-K124 WeakPolarHBondContact O-CG 3.38Å; L120-K124 PolarHBondContact O-N 2.97Å; P121-K124 PolarHBondContact O-N 3.27Å; V122-K124 VanDerWaalsContact C-N 3.31Å; V122-K124 PolarHBondContact O-N 3.37Å; K124-T127 PolarHBondContact O-N 3.09Å; K124-T128 PolarHBondContact O-N 3.46Å; K124-T128 PolarHBondContact O-OG1 3.32Å
125	W	75.3	Confident	75.6	Confident	167 Å²	167	69.3 Å²	69.3	63%	0.633	37%	0.367	S	S	*	.	H	α-helix	trans	-62.6	-42.6	176.3	-85.2	99.9	0	0	0	112.6	L36 P121 V122 T127 T128 A129	L36-W125 HydrophobicContact CD1-CD2 4.22Å; L36-W125 HydrophobicContact CD1-CE3 4.42Å; P121-W125 VanDerWaalsContact O-CD1 3.28Å; P121-W125 PolarHBondContact O-N 3.37Å; V122-W125 PolarHBondContact O-N 3.23Å; W125-T127 VanDerWaalsContact C-N 3.34Å; W125-T127 PolarHBondContact O-N 3.5Å; W125-T128 PolarHBondContact O-N 2.98Å; W125-A129 WeakPolarHBondContact O-CB 3.31Å; W125-A129 PolarHBondContact O-N 2.88Å
126	T	79.1	Confident	75.3	Confident	43 Å²	43	68.5 Å²	68.5	26%	0.264	36%	0.359	S	S	.	.	H	α-helix	trans	-63.6	-40.9	175.4	-54.6	0	0	0	0	111.5	L112 W118 V122 A129 I130	L112-T126 HydrophobicContact CD2-CG2 3.82Å; W118-T126 HydrophobicContact CZ3-CG2 4.4Å; V122-T126 WeakPolarHBondContact O-CB 3.25Å; V122-T126 PolarHBondContact O-N 3.35Å; V122-T126 PolarHBondContact O-OG1 3.37Å; T126-A129 PolarHBondContact O-N 3.46Å; T126-I130 HydrophobicContact CG2-CD1 3.98Å; T126-I130 HydrophobicContact CG2-CG1 4.5Å; T126-I130 VanDerWaalsContact O-CG1 3.26Å; T126-I130 WeakPolarHBondContact O-CG1 3.5Å; T126-I130 PolarHBondContact O-N 3.19Å
127	T	77.8	Confident	74.9	Confident	1 Å²	1	74.6 Å²	74.6	1%	0.006	38%	0.383	C	S	.	.	H	α-helix	trans	-62.6	-43.8	176.6	-59.1	0	0	0	0	111.4	C105 L109 R123 K124 W125 I130 G131	C105-T127 HydrophobicContact CB-CG2 3.71Å; C105-T127 WeakPolarHBondContact O-CG2 3.45Å; L109-T127 HydrophobicContact CB-CG2 4.11Å; L109-T127 WeakPolarHBondContact CD1-OG1 3.4Å; R123-T127 WeakPolarHBondContact O-CB 3.43Å; R123-T127 PolarHBondContact O-N 3.43Å; R123-T127 PolarHBondContact O-OG1 3.2Å; K124-T127 PolarHBondContact O-N 3.09Å; W125-T127 VanDerWaalsContact C-N 3.34Å; W125-T127 PolarHBondContact O-N 3.5Å; T127-I130 PolarHBondContact O-N 3.24Å; T127-G131 PolarHBondContact O-N 2.72Å
128	T	74.9	Confident	74.1	Confident	3 Å²	3	65.4 Å²	65.4	2%	0.018	34%	0.344	C	S	.	.	H	α-helix	trans	-64.3	-41.4	175.8	-66.4	0	0	0	0	112	A32 F33 L36 K124 W125 I130 G131 L132	A32-T128 WeakPolarHBondContact O-CA 3.28Å; A32-T128 WeakPolarHBondContact O-CB 3.39Å; A32-T128 WeakPolarHBondContact O-CG2 3.24Å; A32-T128 PolarHBondContact O-OG1 2.83Å; F33-T128 HydrophobicContact CD1-CG2 3.92Å; F33-T128 HydrophobicContact CD2-CG2 4.44Å; F33-T128 HydrophobicContact CE1-CG2 3.9Å; F33-T128 HydrophobicContact CE2-CG2 4.42Å; F33-T128 HydrophobicContact CG-CG2 4.2Å; F33-T128 HydrophobicContact CZ-CG2 4.16Å; L36-T128 HydrophobicContact CD1-CG2 4.22Å; K124-T128 PolarHBondContact O-N 3.46Å; K124-T128 PolarHBondContact O-OG1 3.32Å; W125-T128 PolarHBondContact O-N 2.98Å; T128-I130 VanDerWaalsContact C-N 3.34Å; T128-I130 PolarHBondContact O-N 2.9Å; T128-G131 PolarHBondContact O-N 3.24Å; T128-L132 HydrophobicContact CG2-CD1 4.07Å; T128-L132 HydrophobicContact CG2-CG 4.41Å; T128-L132 WeakPolarHBondContact O-CB 3.49Å; T128-L132 WeakPolarHBondContact O-CG 3.47Å; T128-L132 PolarHBondContact O-N 3.01Å
129	A	79	Confident	73.2	Confident	57 Å²	57	61.3 Å²	61.3	47%	0.471	33%	0.33	S	S	.	.	H	α-helix	trans	-61.7	-41.6	175	0	0	0	0	0	112	W125 T126 S133	W125-A129 WeakPolarHBondContact O-CB 3.31Å; W125-A129 PolarHBondContact O-N 2.88Å; T126-A129 PolarHBondContact O-N 3.46Å; A129-S133 WeakPolarHBondContact O-CB 3.35Å; A129-S133 PolarHBondContact O-N 3.44Å; A129-S133 PolarHBondContact O-OG 3.46Å
130	I	78.8	Confident	72.2	Confident	50 Å²	50	61.4 Å²	61.4	26%	0.256	33%	0.329	S	S	.	.	H	α-helix	trans	-62.3	-50	174.1	-68	165	0	0	0	110	V104 T126 T127 T128 L132 S133 T134	V104-I130 HydrophobicContact CG1-CG2 4.13Å; T126-I130 HydrophobicContact CG2-CD1 3.98Å; T126-I130 HydrophobicContact CG2-CG1 4.5Å; T126-I130 VanDerWaalsContact O-CG1 3.26Å; T126-I130 WeakPolarHBondContact O-CG1 3.5Å; T126-I130 PolarHBondContact O-N 3.19Å; T127-I130 PolarHBondContact O-N 3.24Å; T128-I130 VanDerWaalsContact C-N 3.34Å; T128-I130 PolarHBondContact O-N 2.9Å; I130-L132 PolarHBondContact O-N 2.94Å; I130-S133 WeakPolarHBondContact CA-OG 3.42Å; I130-S133 PolarHBondContact O-N 3.49Å; I130-S133 PolarHBondContact O-OG 3.27Å; I130-T134 PolarHBondContact O-N 2.96Å; I130-T134 PolarHBondContact O-OG1 3.14Å
131	G	72.8	Confident	71.5	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-53.6	-50.5	177.6	0	0	0	0	0	112.6	T127 T128 S133 T134 I135	T127-G131 PolarHBondContact O-N 2.72Å; T128-G131 PolarHBondContact O-N 3.24Å; G131-S133 PolarHBondContact O-N 3.34Å; G131-T134 WeakPolarHBondContact O-CB 3.38Å; G131-T134 PolarHBondContact O-N 2.98Å; G131-T134 VanDerWaalsContact O-N 3.14Å; G131-I135 PolarHBondContact O-N 2.74Å
132	L	72.9	Confident	70.7	Confident	65 Å²	65	55.8 Å²	55.8	34%	0.34	30%	0.299	S	S	.	.	H	α-helix	trans	-62.4	-40.7	177.5	-69.6	173.2	0	0	0	112.8	A32 F33 T128 I130 T134 I135 P136	A32-L132 HydrophobicContact CB-CD2 3.79Å; A32-L132 HydrophobicContact CB-CG 3.97Å; F33-L132 HydrophobicContact CE2-CD1 4.14Å; F33-L132 HydrophobicContact CE2-CD2 4.19Å; F33-L132 HydrophobicContact CZ-CD1 4.21Å; T128-L132 HydrophobicContact CG2-CD1 4.07Å; T128-L132 HydrophobicContact CG2-CG 4.41Å; T128-L132 WeakPolarHBondContact O-CB 3.49Å; T128-L132 WeakPolarHBondContact O-CG 3.47Å; T128-L132 PolarHBondContact O-N 3.01Å; I130-L132 PolarHBondContact O-N 2.94Å; L132-T134 PolarHBondContact O-N 2.91Å; L132-I135 HydrophobicContact CD2-CD1 3.85Å; L132-I135 WeakPolarHBondContact O-CB 3.31Å; L132-I135 PolarHBondContact O-N 3.32Å; L132-P136 WeakPolarHBondContact O-CD 3.44Å
133	S	77.9	Confident	69.5	Low	70 Å²	70	55.8 Å²	55.8	49%	0.49	30%	0.296	S	S	.	.	H	α-helix	trans	-68	-22.8	176.9	71.5	0	0	0	0	113.4	A129 I130 G131 P136	A129-S133 WeakPolarHBondContact O-CB 3.35Å; A129-S133 PolarHBondContact O-N 3.44Å; A129-S133 PolarHBondContact O-OG 3.46Å; I130-S133 WeakPolarHBondContact CA-OG 3.42Å; I130-S133 PolarHBondContact O-N 3.49Å; I130-S133 PolarHBondContact O-OG 3.27Å; G131-S133 PolarHBondContact O-N 3.34Å; S133-P136 WeakPolarHBondContact O-CD 3.47Å; S133-P136 WeakPolarHBondContact O-CG 3.28Å
134	T	69.2	Low	68.7	Low	29 Å²	29	62.4 Å²	62.4	18%	0.178	32%	0.321	C	S	.	.	H	α-helix	trans	-81.2	-24.9	-179.7	-44.6	0	0	0	0	111.7	V104 I130 G131 L132 F137 I138	V104-T134 HydrophobicContact CG1-CG2 4.48Å; I130-T134 PolarHBondContact O-N 2.96Å; I130-T134 PolarHBondContact O-OG1 3.14Å; G131-T134 WeakPolarHBondContact O-CB 3.38Å; G131-T134 PolarHBondContact O-N 2.98Å; G131-T134 VanDerWaalsContact O-N 3.14Å; L132-T134 PolarHBondContact O-N 2.91Å; T134-F137 PolarHBondContact O-N 3.23Å; T134-F137 VanDerWaalsContact O-N 3.1Å; T134-I138 HydrophobicContact CG2-CD1 3.33Å; T134-I138 HydrophobicContact CG2-CG1 3.82Å; T134-I138 WeakPolarHBondContact O-CG1 3.22Å; T134-I138 PolarHBondContact O-N 3.06Å; T134-I138 VanDerWaalsContact O-N 3.09Å
135	I	68	Low	68	Low	26 Å²	26	61.6 Å²	61.6	13%	0.133	33%	0.327	C	S	.	.	H	α-helix	trans	-48.9	-56.7	178	-64.6	174.2	0	0	0	112.6	E28 I101 G131 L132 F137 I138 I139	E28-I135 HydrophobicContact CB-CD1 4.42Å; I101-I135 HydrophobicContact CD1-CG1 3.74Å; G131-I135 PolarHBondContact O-N 2.74Å; L132-I135 HydrophobicContact CD2-CD1 3.85Å; L132-I135 WeakPolarHBondContact O-CB 3.31Å; L132-I135 PolarHBondContact O-N 3.32Å; I135-F137 PolarHBondContact O-N 3.17Å; I135-F137 VanDerWaalsContact O-N 3.15Å; I135-I138 PolarHBondContact O-N 3.46Å; I135-I139 HydrophobicContact CG2-CD1 3.58Å; I135-I139 HydrophobicContact CG2-CG1 4.43Å; I135-I139 WeakPolarHBondContact O-CD1 3.48Å; I135-I139 VanDerWaalsContact O-CG1 3.28Å; I135-I139 WeakPolarHBondContact O-CG1 3.44Å; I135-I139 PolarHBondContact O-N 3.1Å
136	P	67.5	Low	67	Low	82 Å²	82	54 Å²	54	53%	0.532	30%	0.299	S	S	.	.	H	α-helix	trans	-63.6	-23.2	-178.1	22.9	-33.7	0	0	0	114.3	L132 S133	L132-P136 WeakPolarHBondContact O-CD 3.44Å; S133-P136 WeakPolarHBondContact O-CD 3.47Å; S133-P136 WeakPolarHBondContact O-CG 3.28Å
137	F	64.8	Low	66	Low	166 Å²	166	56.4 Å²	56.4	73%	0.728	31%	0.31	S	S	*	.	H	α-helix	trans	-86.4	-23.2	179.6	-83.1	-86.1	0	0	0	113.7	T134 I135 P141	T134-F137 PolarHBondContact O-N 3.23Å; T134-F137 VanDerWaalsContact O-N 3.1Å; I135-F137 PolarHBondContact O-N 3.17Å; I135-F137 VanDerWaalsContact O-N 3.15Å; F137-P141 VanDerWaalsContact O-CD 3.25Å; F137-P141 WeakPolarHBondContact O-CD 3.36Å; F137-P141 VanDerWaalsContact O-CG 3.3Å; F137-P141 WeakPolarHBondContact O-CG 3.46Å
138	I	65	Low	65.1	Low	19 Å²	19	63.4 Å²	63.4	10%	0.097	34%	0.34	C	S	.	.	H	α-helix	trans	-86.8	-35.9	-178	-74.5	170.4	0	0	0	111.9	T100 I101 T134 I135 T140 P141 I142	T100-I138 HydrophobicContact CG2-CD1 3.68Å; T100-I138 HydrophobicContact CG2-CG1 4.35Å; I101-I138 HydrophobicContact CG1-CD1 3.83Å; T134-I138 HydrophobicContact CG2-CD1 3.33Å; T134-I138 HydrophobicContact CG2-CG1 3.82Å; T134-I138 WeakPolarHBondContact O-CG1 3.22Å; T134-I138 PolarHBondContact O-N 3.06Å; T134-I138 VanDerWaalsContact O-N 3.09Å; I135-I138 PolarHBondContact O-N 3.46Å; I138-T140 PolarHBondContact O-N 2.99Å; I138-P141 VanDerWaalsContact O-CD 3.28Å; I138-P141 WeakPolarHBondContact O-CD 3.32Å; I138-P141 WeakPolarHBondContact O-CG 3.37Å; I138-I142 HydrophobicContact CG2-CD1 3.28Å; I138-I142 HydrophobicContact CG2-CG1 4.01Å; I138-I142 WeakPolarHBondContact O-CB 3.42Å; I138-I142 VanDerWaalsContact O-CG1 3.31Å; I138-I142 WeakPolarHBondContact O-CG1 3.33Å; I138-I142 PolarHBondContact O-N 3.34Å
139	I	58.3	Low	64.5	Low	37 Å²	37	68.1 Å²	68.1	19%	0.19	37%	0.365	C	S	.	.	H	α-helix	trans	-63.8	-47.9	-170.1	-62.7	160.9	0	0	0	112.3	Y25 I135 I142 D143	Y25-I139 HydrophobicContact CD1-CD1 4.1Å; Y25-I139 HydrophobicContact CE1-CD1 3.85Å; Y25-I139 HydrophobicContact CE1-CG1 4.11Å; Y25-I139 HydrophobicContact CE1-CG2 4.11Å; I135-I139 HydrophobicContact CG2-CD1 3.58Å; I135-I139 HydrophobicContact CG2-CG1 4.43Å; I135-I139 WeakPolarHBondContact O-CD1 3.48Å; I135-I139 VanDerWaalsContact O-CG1 3.28Å; I135-I139 WeakPolarHBondContact O-CG1 3.44Å; I135-I139 PolarHBondContact O-N 3.1Å; I139-I142 PolarHBondContact O-N 3.28Å; I139-D143 PolarHBondContact O-N 3.34Å
140	T	58.2	Low	63.4	Low	83 Å²	83	67.5 Å²	67.5	51%	0.509	35%	0.354	S	S	.	.	H	α-helix	trans	-65.8	-38.7	-175.7	22.3	0	0	0	0	116	I138	I138-T140 PolarHBondContact O-N 2.99Å
141	P	58.8	Low	62.4	Low	62 Å²	62	68.9 Å²	68.9	40%	0.403	36%	0.362	S	S	.	.	H	α-helix	trans	-77.4	-30.1	173.8	24.6	-31.5	0	0	0	113.2	F137 I138 S145	F137-P141 VanDerWaalsContact O-CD 3.25Å; F137-P141 WeakPolarHBondContact O-CD 3.36Å; F137-P141 VanDerWaalsContact O-CG 3.3Å; F137-P141 WeakPolarHBondContact O-CG 3.46Å; I138-P141 VanDerWaalsContact O-CD 3.28Å; I138-P141 WeakPolarHBondContact O-CD 3.32Å; I138-P141 WeakPolarHBondContact O-CG 3.37Å; P141-S145 WeakPolarHBondContact O-CB 3.42Å; P141-S145 PolarHBondContact O-N 3.47Å; P141-S145 PolarHBondContact O-OG 2.69Å
142	I	59.3	Low	61.7	Low	18 Å²	18	71.6 Å²	71.6	9%	0.092	38%	0.38	C	S	.	.	H	α-helix	trans	-66.8	-50.4	174.8	-70.9	-174.8	0	0	0	110.1	I96 P97 I138 I139 R144 S145 V146	I96-I142 HydrophobicContact CG2-CD1 3.81Å; I96-I142 HydrophobicContact CG2-CG1 4.45Å; P97-I142 HydrophobicContact CB-CD1 4.21Å; P97-I142 HydrophobicContact CG-CD1 3.91Å; P97-I142 HydrophobicContact CG-CG2 4.38Å; I138-I142 HydrophobicContact CG2-CD1 3.28Å; I138-I142 HydrophobicContact CG2-CG1 4.01Å; I138-I142 WeakPolarHBondContact O-CB 3.42Å; I138-I142 VanDerWaalsContact O-CG1 3.31Å; I138-I142 WeakPolarHBondContact O-CG1 3.33Å; I138-I142 PolarHBondContact O-N 3.34Å; I139-I142 PolarHBondContact O-N 3.28Å; I142-R144 PolarHBondContact O-N 2.87Å; I142-S145 WeakPolarHBondContact O-CB 3.46Å; I142-S145 PolarHBondContact O-N 3.06Å; I142-V146 HydrophobicContact CG2-CG2 3.78Å; I142-V146 WeakPolarHBondContact O-CB 3.26Å; I142-V146 WeakPolarHBondContact O-CG2 3.25Å; I142-V146 PolarHBondContact O-N 2.88Å
143	D	54.1	Low	61	Low	66 Å²	66	71.8 Å²	71.8	35%	0.353	39%	0.387	S	S	.	.	H	α-helix	trans	-52.5	-43.6	178.3	-78.7	-1.3	0	0	0	111.2	I139 V146 D147	I139-D143 PolarHBondContact O-N 3.34Å; D143-V146 PolarHBondContact O-N 3.38Å; D143-D147 WeakPolarHBondContact O-CB 3.43Å; D143-D147 VanDerWaalsContact O-CG 3.28Å; D143-D147 PolarHBondContact O-N 2.91Å
144	R	59.3	Low	59.6	Low	181 Å²	181	72.6 Å²	72.6	68%	0.683	39%	0.386	S	S	*	.	H	α-helix	trans	-66.8	-38.4	175.5	-83.2	-168.2	-88.3	-174.9	-8.7	114.6	I142 V146 F148	I142-R144 PolarHBondContact O-N 2.87Å; R144-V146 VanDerWaalsContact C-N 3.29Å; R144-F148 WeakPolarHBondContact O-CB 3.48Å; R144-F148 PolarHBondContact O-N 2.66Å
145	S	56.5	Low	58.7	Low	69 Å²	69	78.6 Å²	78.6	48%	0.483	41%	0.405	S	S	.	.	H	α-helix	trans	-69	-36.7	-179.8	-59.3	0	0	0	0	111.3	P141 I142 F148 L149	P141-S145 WeakPolarHBondContact O-CB 3.42Å; P141-S145 PolarHBondContact O-N 3.47Å; P141-S145 PolarHBondContact O-OG 2.69Å; I142-S145 WeakPolarHBondContact O-CB 3.46Å; I142-S145 PolarHBondContact O-N 3.06Å; S145-F148 PolarHBondContact O-N 2.94Å; S145-L149 WeakPolarHBondContact O-CB 3.32Å; S145-L149 PolarHBondContact O-N 2.92Å
146	V	54.9	Low	57.8	Low	8 Å²	8	85 Å²	85	5%	0.048	43%	0.432	C	S	.	.	H	α-helix	trans	-74.8	-40.4	-179.4	162.3	0	0	0	0	110.4	W88 A92 I142 D143 R144 F148 L149 L150	W88-V146 HydrophobicContact CD2-CG1 3.96Å; W88-V146 HydrophobicContact CG-CG1 4.47Å; W88-V146 HydrophobicContact CH2-CG1 3.96Å; W88-V146 HydrophobicContact CZ2-CB 4.38Å; W88-V146 HydrophobicContact CZ2-CG1 3.09Å; W88-V146 PolarHBondContact NE1-O 2.74Å; A92-V146 HydrophobicContact CB-CB 4.27Å; A92-V146 HydrophobicContact CB-CG1 3.35Å; A92-V146 HydrophobicContact CB-CG2 3.97Å; I142-V146 HydrophobicContact CG2-CG2 3.78Å; I142-V146 WeakPolarHBondContact O-CB 3.26Å; I142-V146 WeakPolarHBondContact O-CG2 3.25Å; I142-V146 PolarHBondContact O-N 2.88Å; D143-V146 PolarHBondContact O-N 3.38Å; R144-V146 VanDerWaalsContact C-N 3.29Å; V146-F148 VanDerWaalsContact C-N 3.35Å; V146-L149 PolarHBondContact O-N 2.86Å; V146-L150 PolarHBondContact O-N 2.82Å
147	D	57.3	Low	57.1	Low	93 Å²	93	86.4 Å²	86.4	50%	0.497	44%	0.439	S	S	.	.	H	α-helix	trans	-59.2	-45.9	168.1	-79.8	-23.7	0	0	0	110.8	D143 L149 L150 D151	D143-D147 WeakPolarHBondContact O-CB 3.43Å; D143-D147 VanDerWaalsContact O-CG 3.28Å; D143-D147 PolarHBondContact O-N 2.91Å; D147-L149 VanDerWaalsContact C-N 3.32Å; D147-L149 PolarHBondContact O-N 3.47Å; D147-L150 PolarHBondContact O-N 3.27Å; D147-D151 WeakPolarHBondContact O-CB 3.3Å; D147-D151 PolarHBondContact O-N 3.32Å
148	F	60.1	Low	56.4	Low	147 Å²	147	86 Å²	86	65%	0.645	43%	0.434	S	S	*	.	H	α-helix	trans	-64.5	-35.6	178.7	-170.7	-93.6	0	0	0	113	R144 S145 V146 S152	R144-F148 WeakPolarHBondContact O-CB 3.48Å; R144-F148 PolarHBondContact O-N 2.66Å; S145-F148 PolarHBondContact O-N 2.94Å; V146-F148 VanDerWaalsContact C-N 3.35Å; F148-S152 VanDerWaalsContact O-CB 3.25Å; F148-S152 WeakPolarHBondContact O-CB 3.09Å; F148-S152 PolarHBondContact O-N 2.87Å; F148-S152 PolarHBondContact O-OG 2.92Å
149	L	61	Low	55.6	Low	103 Å²	103	90.1 Å²	90.1	54%	0.539	46%	0.456	S	S	.	.	H	α-helix	trans	-67.8	-44.2	175.5	-99.1	161.2	0	0	0	112.1	S145 V146 D147 S152 S153	S145-L149 WeakPolarHBondContact O-CB 3.32Å; S145-L149 PolarHBondContact O-N 2.92Å; V146-L149 PolarHBondContact O-N 2.86Å; D147-L149 VanDerWaalsContact C-N 3.32Å; D147-L149 PolarHBondContact O-N 3.47Å; L149-S152 PolarHBondContact O-N 3.02Å; L149-S153 WeakPolarHBondContact O-CB 3.36Å; L149-S153 PolarHBondContact O-N 3.46Å; L149-S153 PolarHBondContact O-OG 2.9Å
150	L	57.6	Low	55.1	Low	44 Å²	44	93.3 Å²	93.3	23%	0.23	47%	0.473	C	S	.	.	H	α-helix	trans	-66	-42.7	173.2	-78.9	178.4	0	0	0	111.7	W88 V146 D147 S152 S153 L154	W88-L150 HydrophobicContact CB-CD2 4.2Å; W88-L150 HydrophobicContact CD2-CD1 3.69Å; W88-L150 HydrophobicContact CD2-CG 4.4Å; W88-L150 HydrophobicContact CG-CD1 3.58Å; W88-L150 HydrophobicContact CG-CD2 3.89Å; W88-L150 HydrophobicContact CG-CG 3.86Å; W88-L150 HydrophobicContact CZ2-CD1 3.87Å; V146-L150 PolarHBondContact O-N 2.82Å; D147-L150 PolarHBondContact O-N 3.27Å; L150-S152 PolarHBondContact O-N 2.96Å; L150-S153 PolarHBondContact O-N 3.36Å; L150-L154 HydrophobicContact CB-CD1 4.29Å; L150-L154 HydrophobicContact CD2-CD1 3.6Å; L150-L154 HydrophobicContact CD2-CG 4.16Å; L150-L154 HydrophobicContact CG-CD1 4.34Å; L150-L154 WeakPolarHBondContact O-CA 3.25Å; L150-L154 VanDerWaalsContact O-CB 3.26Å; L150-L154 WeakPolarHBondContact O-CB 3.29Å; L150-L154 PolarHBondContact O-N 2.71Å
151	D	57.9	Low	54.4	Low	79 Å²	79	91.9 Å²	91.9	42%	0.422	48%	0.475	S	S	.	.	H	α-helix	trans	-62.1	-33.9	177.6	-113.3	11.3	0	0	0	111.1	D147 R155	D147-D151 WeakPolarHBondContact O-CB 3.3Å; D147-D151 PolarHBondContact O-N 3.32Å; D151-R155 WeakPolarHBondContact O-CB 3.3Å; D151-R155 PolarHBondContact O-N 3.37Å; D151-R155 WeakPolarHBondContact OD1-CD 3.34Å; D151-R155 IonicContact OD1-CZ 3.67Å; D151-R155 IonicContact OD1-NE 3.53Å; D151-R155 IonicContact OD1-NH1 3.55Å; D151-R155 IonicContact OD2-CZ 3.62Å; D151-R155 IonicContact OD2-NH1 2.76Å; D151-R155 PolarHBondContact OD2-NH1 2.83Å
152	S	58	Low	53.6	Low	56 Å²	56	95.5 Å²	95.5	39%	0.392	48%	0.484	S	S	.	.	H	α-helix	trans	-79.1	-29.5	178.5	-63.9	0	0	0	0	114.2	F148 L149 L150 K156	F148-S152 VanDerWaalsContact O-CB 3.25Å; F148-S152 WeakPolarHBondContact O-CB 3.09Å; F148-S152 PolarHBondContact O-N 2.87Å; F148-S152 PolarHBondContact O-OG 2.92Å; L149-S152 PolarHBondContact O-N 3.02Å; L150-S152 PolarHBondContact O-N 2.96Å; S152-K156 VanDerWaalsContact O-CB 3.25Å; S152-K156 WeakPolarHBondContact O-CB 3.3Å
153	S	57	Low	52.7	Low	70 Å²	70	103 Å²	103	49%	0.49	52%	0.516	S	S	.	.	H	α-helix	trans	-92.5	-51.9	179.4	-68.5	0	0	0	0	112.3	L149 L150 V157	L149-S153 WeakPolarHBondContact O-CB 3.36Å; L149-S153 PolarHBondContact O-N 3.46Å; L149-S153 PolarHBondContact O-OG 2.9Å; L150-S153 PolarHBondContact O-N 3.36Å; S153-V157 VanDerWaalsContact O-CG2 3.3Å; S153-V157 WeakPolarHBondContact O-CG2 3.35Å; S153-V157 PolarHBondContact O-N 2.86Å; S153-V157 VanDerWaalsContact O-N 3.15Å
154	L	48.9	Very low	51.8	Low	86 Å²	86	108 Å²	108	45%	0.45	54%	0.537	S	S	.	.	H	α-helix	trans	-72.7	-43.9	-177.1	-78.5	172	0	0	0	113	D84 L150 K156 V157 Y158	D84-L154 WeakPolarHBondContact OD2-CD2 3.06Å; L150-L154 HydrophobicContact CB-CD1 4.29Å; L150-L154 HydrophobicContact CD2-CD1 3.6Å; L150-L154 HydrophobicContact CD2-CG 4.16Å; L150-L154 HydrophobicContact CG-CD1 4.34Å; L150-L154 WeakPolarHBondContact O-CA 3.25Å; L150-L154 VanDerWaalsContact O-CB 3.26Å; L150-L154 WeakPolarHBondContact O-CB 3.29Å; L150-L154 PolarHBondContact O-N 2.71Å; L154-K156 VanDerWaalsContact C-N 3.26Å; L154-K156 PolarHBondContact O-N 3.04Å; L154-V157 PolarHBondContact O-N 3.27Å; L154-Y158 WeakPolarHBondContact O-CB 3.5Å; L154-Y158 PolarHBondContact O-N 3.4Å
155	R	50.2	Low	50.8	Low	155 Å²	155	111 Å²	111	59%	0.585	56%	0.559	S	S	*	*	H	α-helix	trans	-67.6	-29.6	177.6	-71.3	178.4	152.4	161.6	-8	112.2	D151 N159	D151-R155 WeakPolarHBondContact O-CB 3.3Å; D151-R155 PolarHBondContact O-N 3.37Å; D151-R155 WeakPolarHBondContact OD1-CD 3.34Å; D151-R155 IonicContact OD1-CZ 3.67Å; D151-R155 IonicContact OD1-NE 3.53Å; D151-R155 IonicContact OD1-NH1 3.55Å; D151-R155 IonicContact OD2-CZ 3.62Å; D151-R155 IonicContact OD2-NH1 2.76Å; D151-R155 PolarHBondContact OD2-NH1 2.83Å; R155-N159 VanDerWaalsContact O-CB 3.28Å; R155-N159 WeakPolarHBondContact O-CB 3.22Å; R155-N159 PolarHBondContact O-N 3.05Å
156	K	48.3	Very low	50.5	Low	161 Å²	161	113.1 Å²	113.1	70%	0.7	56%	0.563	S	S	*	*	H	α-helix	trans	-72.6	-41.1	178.7	-156.5	170.2	-173.2	178.7	0	111.3	S152 L154 D160	S152-K156 VanDerWaalsContact O-CB 3.25Å; S152-K156 WeakPolarHBondContact O-CB 3.3Å; L154-K156 VanDerWaalsContact C-N 3.26Å; L154-K156 PolarHBondContact O-N 3.04Å; K156-D160 WeakPolarHBondContact O-CB 3.31Å; K156-D160 PolarHBondContact O-N 3.43Å; K156-D160 VanDerWaalsContact O-N 3.08Å
157	V	54.4	Low	50.3	Low	112 Å²	112	118.6 Å²	118.6	68%	0.679	59%	0.59	S	S	*	*	H	α-helix	trans	-69	-35.4	174	174.1	0	0	0	0	112.1	S153 L154 G161	S153-V157 VanDerWaalsContact O-CG2 3.3Å; S153-V157 WeakPolarHBondContact O-CG2 3.35Å; S153-V157 PolarHBondContact O-N 2.86Å; S153-V157 VanDerWaalsContact O-N 3.15Å; L154-V157 PolarHBondContact O-N 3.27Å; V157-G161 PolarHBondContact O-N 2.64Å
158	Y	50	Low	49.9	Very low	158 Å²	158	120.1 Å²	120.1	62%	0.62	60%	0.595	S	S	*	*	H	α-helix	trans	-73.3	-37.1	177.1	-165.3	-95.8	0	0	0	113.3	L154 K162	L154-Y158 WeakPolarHBondContact O-CB 3.5Å; L154-Y158 PolarHBondContact O-N 3.4Å; Y158-K162 HydrophobicContact CE1-CD 4.4Å; Y158-K162 PolarHBondContact O-N 3.21Å
159	N	47	Very low	49.3	Very low	105 Å²	105	118.5 Å²	118.5	56%	0.561	59%	0.592	S	S	*	*	H	α-helix	trans	-76.2	-28.5	177.1	-85.3	-20.4	0	0	0	113.5	R155 K162 K163	R155-N159 VanDerWaalsContact O-CB 3.28Å; R155-N159 WeakPolarHBondContact O-CB 3.22Å; R155-N159 PolarHBondContact O-N 3.05Å; N159-K162 PolarHBondContact O-N 3.2Å; N159-K163 PolarHBondContact O-N 3.49Å
160	D	47.6	Very low	48.6	Very low	103 Å²	103	119.4 Å²	119.4	55%	0.551	60%	0.595	S	S	*	*	H	α-helix	trans	-71.5	-33.5	172.5	-117.3	25.7	0	0	0	111.7	K156 K162 K163	K156-D160 WeakPolarHBondContact O-CB 3.31Å; K156-D160 PolarHBondContact O-N 3.43Å; K156-D160 VanDerWaalsContact O-N 3.08Å; D160-K162 VanDerWaalsContact C-N 3.28Å; D160-K162 PolarHBondContact O-N 2.98Å; D160-K163 PolarHBondContact O-N 2.81Å
161	G	44.8	Very low	48	Very low	53 Å²	53	124.5 Å²	124.5	55%	0.546	62%	0.62	S	S	.	*	H	α-helix	trans	-67.9	-23.1	174.7	0	0	0	0	0	114.5	V157	V157-G161 PolarHBondContact O-N 2.64Å
162	K	42.3	Very low	47.3	Very low	139 Å²	139	127.7 Å²	127.7	60%	0.604	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	-8.1	175.5	-81.5	-158.8	176.2	-171.8	0	114.7	Y158 N159 D160	Y158-K162 HydrophobicContact CE1-CD 4.4Å; Y158-K162 PolarHBondContact O-N 3.21Å; N159-K162 PolarHBondContact O-N 3.2Å; D160-K162 VanDerWaalsContact C-N 3.28Å; D160-K162 PolarHBondContact O-N 2.98Å
163	K	38.5	Very low	46.5	Very low	175 Å²	175	133.2 Å²	133.2	76%	0.761	65%	0.652	S	S	*	*	S	Bend	trans	-89.6	-8.2	175.2	-96.2	-174.3	175.2	-177.1	0	113.6	N159 D160	N159-K163 PolarHBondContact O-N 3.49Å; D160-K163 PolarHBondContact O-N 2.81Å
164	H	36.6	Very low	45.6	Very low	170 Å²	170	138.5 Å²	138.5	79%	0.787	67%	0.666	S	S	*	*			trans	-114	12.5	-178.8	-79.6	-70.5	0	0	0	114
165	E	38.5	Very low	45.3	Very low	245 Å²	245	143.3 Å²	143.3	100%	1.145	69%	0.685	S	S	*	*			trans	-113.9	0	164.8	-163.2	172.6	106.2	0	0	110.2

Retrieved 165 of 165 residues in 222.9 ms (Link to these results)

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