H9G2D5_MACMU Loading...

Transmembrane protein 63A

AlphaFold DB , UniProt , Accession H9G2D5, Species MACMU (Macaca mulatta, Rhesus macaque), Gene TMEM63A, Length 805 aa.

						>H9G2D5_MACMU|H9G2D5|TMEM63A
MADSPFLELWQSKAVSIREQLGLGDQPNDSYCYNSAKNSTVLQGVTFGGIPTVLLIDVSCFLFLILVFSIIRRRFWDYGRIALVSEADSESRFQRLSSTSSSGQQDFENELGCCPWLTAIFRLHDDQILEWCGEDAIHYLSFQRHIIFLLVVVSFLSLCVILPVNLSGDLLDKDPYSFGRTTIANLQTDNDLIWLHTIFAVIYLFLTVGFMRHHTQSIKYKEENLVRRTLFITGLPRDARKETVESHFRDAYPTCEVVDVQLCYNVAKLIYLCKERKKTEKSLTYYTNLQVKTGQRTLINPKPCGQFCCCEVLGCEWEDAISYYTRMKDRLLERITEEECHVQDQPLGMAFVTFQEKSMATYILKDFNACKCQSLQCKGEPQPSSHSRELCTSKWTVTFAADPEDICWKNLSIQGLRWWLQWLGINFTLFLGLFFLTTPSIILSTMDKFNVTKPIHALNNPIISQFFPTLLLWSFSALLPSIVYYSTLLESHWTKSGENQIVMTKVYIFLIFMVLILPSLGLTSLDFFFRWLFDKTSSKASIRLECVFLPDQGAFFVNYVIASAFIGNGMELLRLPGLILYTFRMIMAKTAADRRNVKQNQAFQYEFGAMYAWMLCVFTVIMAYSITCPIVAPFGLIYILLKHMVDRHNLYFVYLPAKLEKGIHFAAVNQALAAPILCLFWLYFFSFLRLGMKAPATLFTFLVLLLTILVCLAHTCFGCFKHLSPLNYKTEEPASDKGSEAEAHMPPPFTPYVPRILNGLASERTALSPQQQQTYGAIHNISGTIPGQCLAQSSMGSVAAAPQEA
					

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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	36.1	Very low	39.1	Very low	251 Å²	251	129.9 Å²	129.9	100%	1.236	68%	0.675	S	S	*	*				0	82.5	0	-106.2	177.5	-175	0	0	108.1
2	A	34	Very low	39.7	Very low	90 Å²	90	125.9 Å²	125.9	74%	0.744	67%	0.667	S	S	*	*			trans	-161.4	38.8	169.6	0	0	0	0	0	110.9	S4	A2-S4 PolarHBondContact O-N 2.82Å
3	D	39.7	Very low	40.4	Very low	165 Å²	165	127.2 Å²	127.2	88%	0.882	66%	0.663	S	S	*	*			trans	-93.7	81.6	167.2	-67	-35.3	0	0	0	107.2	P5	D3-P5 WeakPolarHBondContact O-CD 3.39Å
4	S	40.7	Very low	40.7	Very low	56 Å²	56	120.5 Å²	120.5	39%	0.392	64%	0.636	S	S	.	*			trans	-83.8	117.3	174.1	61.9	0	0	0	0	109	A2 F6 L7	A2-S4 PolarHBondContact O-N 2.82Å; S4-F6 PolarHBondContact O-N 2.73Å; S4-L7 PolarHBondContact O-N 3.27Å
5	P	45.3	Very low	41.2	Very low	100 Å²	100	117.3 Å²	117.3	65%	0.649	62%	0.623	S	S	*	*	H	α-helix	trans	-63.3	-14.2	-177.5	23.2	-33	0	0	0	113.6	D3 L7 L9	D3-P5 WeakPolarHBondContact O-CD 3.39Å; P5-L7 VanDerWaalsContact C-N 3.35Å; P5-L9 WeakPolarHBondContact O-CB 3.47Å; P5-L9 PolarHBondContact O-N 2.63Å; P5-L9 VanDerWaalsContact O-N 3.14Å
6	F	36.6	Very low	41.6	Very low	169 Å²	169	113.6 Å²	113.6	74%	0.741	61%	0.609	S	S	*	*	H	α-helix	trans	-68.3	-34	174.7	-151.9	-92.7	0	0	0	112.6	S4 W10	S4-F6 PolarHBondContact O-N 2.73Å; F6-W10 WeakPolarHBondContact O-CB 3.32Å; F6-W10 PolarHBondContact O-N 3.01Å; F6-W10 VanDerWaalsContact O-N 3.16Å
7	L	38	Very low	42.2	Very low	106 Å²	106	111.8 Å²	111.8	56%	0.555	60%	0.598	S	S	*	*	H	α-helix	trans	-71.2	-41.6	178.4	-117.6	141	0	0	0	110.8	S4 P5 W10 Q11	S4-L7 PolarHBondContact O-N 3.27Å; P5-L7 VanDerWaalsContact C-N 3.35Å; L7-W10 PolarHBondContact O-N 2.78Å; L7-Q11 WeakPolarHBondContact O-CB 3.4Å; L7-Q11 PolarHBondContact O-N 3.12Å
8	E	40.6	Very low	42.7	Very low	141 Å²	141	110.4 Å²	110.4	66%	0.659	58%	0.583	S	S	*	*	H	α-helix	trans	-65.4	-41.3	175.5	-72.9	-167.4	147.8	0	0	113	W10 Q11 S12	E8-W10 VanDerWaalsContact C-N 3.33Å; E8-W10 PolarHBondContact O-N 3.49Å; E8-Q11 WeakPolarHBondContact O-CB 3.41Å; E8-Q11 PolarHBondContact O-N 3.22Å; E8-S12 PolarHBondContact O-N 3.23Å
9	L	38.4	Very low	43.2	Very low	119 Å²	119	111.6 Å²	111.6	62%	0.623	59%	0.585	S	S	*	*	H	α-helix	trans	-65.5	-38.6	178.2	-162.1	78.2	0	0	0	111.5	P5 K13	P5-L9 WeakPolarHBondContact O-CB 3.47Å; P5-L9 PolarHBondContact O-N 2.63Å; P5-L9 VanDerWaalsContact O-N 3.14Å; L9-K13 PolarHBondContact O-N 2.73Å; L9-K13 VanDerWaalsContact O-N 3.14Å
10	W	39.3	Very low	43.3	Very low	154 Å²	154	113.1 Å²	113.1	58%	0.583	59%	0.589	S	S	*	*	H	α-helix	trans	-69.5	-36.7	174.3	-159	70.3	0	0	0	111.5	F6 L7 E8 K13 A14 M692	F6-W10 WeakPolarHBondContact O-CB 3.32Å; F6-W10 PolarHBondContact O-N 3.01Å; F6-W10 VanDerWaalsContact O-N 3.16Å; L7-W10 PolarHBondContact O-N 2.78Å; E8-W10 VanDerWaalsContact C-N 3.33Å; E8-W10 PolarHBondContact O-N 3.49Å; W10-K13 PolarHBondContact O-N 3.1Å; W10-A14 WeakPolarHBondContact O-CB 3.28Å; W10-A14 PolarHBondContact O-N 2.85Å; W10-M692 HydrophobicContact CH2-CE 3.97Å
11	Q	41.4	Very low	43.3	Very low	78 Å²	78	109.5 Å²	109.5	36%	0.364	57%	0.57	S	S	.	*	H	α-helix	trans	-61.6	-48.2	174.4	-131.4	161.6	-61.2	0	0	112.1	L7 E8 K13 A14 V15	L7-Q11 WeakPolarHBondContact O-CB 3.4Å; L7-Q11 PolarHBondContact O-N 3.12Å; E8-Q11 WeakPolarHBondContact O-CB 3.41Å; E8-Q11 PolarHBondContact O-N 3.22Å; Q11-K13 VanDerWaalsContact C-N 3.32Å; Q11-K13 PolarHBondContact O-N 3.45Å; Q11-A14 PolarHBondContact O-N 2.9Å; Q11-V15 WeakPolarHBondContact O-CB 3.45Å; Q11-V15 WeakPolarHBondContact O-CG2 3.26Å; Q11-V15 PolarHBondContact O-N 2.93Å
12	S	45.8	Very low	43.8	Very low	82 Å²	82	98.3 Å²	98.3	57%	0.573	52%	0.519	S	S	*	.	H	α-helix	trans	-60.3	-42.3	176.6	169.9	0	0	0	0	111.4	E8 S16	E8-S12 PolarHBondContact O-N 3.23Å; S12-S16 WeakPolarHBondContact O-CB 3.48Å; S12-S16 PolarHBondContact O-N 3.22Å
13	K	48.7	Very low	44.4	Very low	143 Å²	143	94.2 Å²	94.2	62%	0.622	49%	0.485	S	S	*	.	H	α-helix	trans	-67.5	-43.1	177.1	-116.7	175.4	179.7	176.7	0	113	L9 W10 Q11 S16 I17	L9-K13 PolarHBondContact O-N 2.73Å; L9-K13 VanDerWaalsContact O-N 3.14Å; W10-K13 PolarHBondContact O-N 3.1Å; Q11-K13 VanDerWaalsContact C-N 3.32Å; Q11-K13 PolarHBondContact O-N 3.45Å; K13-S16 PolarHBondContact O-N 3.49Å; K13-I17 WeakPolarHBondContact O-CB 3.36Å; K13-I17 WeakPolarHBondContact O-CD1 3.45Å; K13-I17 WeakPolarHBondContact O-CG1 3.42Å; K13-I17 PolarHBondContact O-N 3.04Å
14	A	44.9	Very low	44.6	Very low	33 Å²	33	88.3 Å²	88.3	27%	0.273	46%	0.463	S	S	.	.	H	α-helix	trans	-68.7	-39.6	179.7	0	0	0	0	0	112.1	W10 Q11 I17 R18	W10-A14 WeakPolarHBondContact O-CB 3.28Å; W10-A14 PolarHBondContact O-N 2.85Å; Q11-A14 PolarHBondContact O-N 2.9Å; A14-I17 PolarHBondContact O-N 2.89Å; A14-R18 WeakPolarHBondContact O-CB 3.34Å; A14-R18 PolarHBondContact O-N 3.39Å
15	V	47.9	Very low	44.7	Very low	73 Å²	73	92.4 Å²	92.4	44%	0.442	48%	0.48	S	S	.	.	H	α-helix	trans	-64.5	-44	172.7	172.6	0	0	0	0	110.4	Q11 I17 R18 E19	Q11-V15 WeakPolarHBondContact O-CB 3.45Å; Q11-V15 WeakPolarHBondContact O-CG2 3.26Å; Q11-V15 PolarHBondContact O-N 2.93Å; V15-I17 VanDerWaalsContact C-N 3.35Å; V15-I17 PolarHBondContact O-N 3.35Å; V15-R18 PolarHBondContact O-N 3Å; V15-E19 PolarHBondContact O-N 3.48Å
16	S	48.6	Very low	44.3	Very low	57 Å²	57	95.6 Å²	95.6	40%	0.399	49%	0.487	S	S	.	.	H	α-helix	trans	-61.3	-38.7	175.1	176.4	0	0	0	0	113	S12 K13 Q20	S12-S16 WeakPolarHBondContact O-CB 3.48Å; S12-S16 PolarHBondContact O-N 3.22Å; K13-S16 PolarHBondContact O-N 3.49Å; S16-Q20 WeakPolarHBondContact O-CB 3.41Å; S16-Q20 PolarHBondContact O-N 2.96Å
17	I	51.4	Low	44.5	Very low	84 Å²	84	92.2 Å²	92.2	43%	0.431	48%	0.482	S	S	.	.	H	α-helix	trans	-66.9	-41.4	174.6	-70.1	162.7	0	0	0	110.9	K13 A14 V15 Q20 L21	K13-I17 WeakPolarHBondContact O-CB 3.36Å; K13-I17 WeakPolarHBondContact O-CD1 3.45Å; K13-I17 WeakPolarHBondContact O-CG1 3.42Å; K13-I17 PolarHBondContact O-N 3.04Å; A14-I17 PolarHBondContact O-N 2.89Å; V15-I17 VanDerWaalsContact C-N 3.35Å; V15-I17 PolarHBondContact O-N 3.35Å; I17-Q20 PolarHBondContact O-N 3.32Å; I17-L21 HydrophobicContact CG2-CD1 3.97Å; I17-L21 WeakPolarHBondContact O-CB 3.34Å; I17-L21 VanDerWaalsContact O-CG 3.29Å; I17-L21 WeakPolarHBondContact O-CG 3.36Å; I17-L21 PolarHBondContact O-N 3.21Å
18	R	51.5	Low	44.6	Very low	87 Å²	87	93 Å²	93	33%	0.328	49%	0.486	S	S	.	.	H	α-helix	trans	-63.3	-43.7	177.8	-173.7	173.5	-179.7	-123.3	1	111.5	A14 V15 L21 G22 L23 D25	A14-R18 WeakPolarHBondContact O-CB 3.34Å; A14-R18 PolarHBondContact O-N 3.39Å; V15-R18 PolarHBondContact O-N 3Å; R18-L21 CarbonylContact O-C 3.5Å; R18-L21 PolarHBondContact O-N 3.48Å; R18-G22 PolarHBondContact O-N 2.98Å; R18-L23 HydrophobicContact CG-CB 3.52Å; R18-L23 HydrophobicContact CG-CD1 3.89Å; R18-L23 HydrophobicContact CG-CG 4.33Å; R18-L23 WeakPolarHBondContact O-CB 3.49Å; R18-L23 PolarHBondContact O-N 2.93Å; R18-D25 IonicContact CZ-OD1 3.08Å; R18-D25 IonicContact NH1-OD1 2.56Å; R18-D25 PolarHBondContact NH1-OD1 2.86Å; R18-D25 IonicContact NH2-OD1 3.96Å
19	E	51	Low	44.8	Very low	132 Å²	132	91.2 Å²	91.2	62%	0.617	48%	0.481	S	S	*	.	H	α-helix	trans	-66.6	-37.8	172.9	-72.4	-175.6	163.8	0	0	112.6	V15 L21 G22	V15-E19 PolarHBondContact O-N 3.48Å; E19-L21 VanDerWaalsContact C-N 3.26Å; E19-L21 PolarHBondContact O-N 3.34Å; E19-G22 WeakPolarHBondContact O-CA 3.46Å; E19-G22 PolarHBondContact O-N 3.49Å
20	Q	45.9	Very low	44.9	Very low	142 Å²	142	89 Å²	89	66%	0.664	48%	0.476	S	S	*	.	H	α-helix	trans	-64	-29.2	172.9	-107.9	178.6	-27	0	0	113.1	S16 I17 G22 S541	S16-Q20 WeakPolarHBondContact O-CB 3.41Å; S16-Q20 PolarHBondContact O-N 2.96Å; I17-Q20 PolarHBondContact O-N 3.32Å; Q20-G22 VanDerWaalsContact C-N 3.26Å; Q20-S541 WeakPolarHBondContact O-CA 3.5Å; Q20-S541 VanDerWaalsContact O-CB 3.26Å; Q20-S541 WeakPolarHBondContact O-CB 3.41Å
21	L	44.4	Very low	45.1	Very low	37 Å²	37	88.4 Å²	88.4	19%	0.194	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	3.7	171.4	-66.7	170.9	0	0	0	112.8	I17 R18 E19 L23 I542 R543 L544	I17-L21 HydrophobicContact CG2-CD1 3.97Å; I17-L21 WeakPolarHBondContact O-CB 3.34Å; I17-L21 VanDerWaalsContact O-CG 3.29Å; I17-L21 WeakPolarHBondContact O-CG 3.36Å; I17-L21 PolarHBondContact O-N 3.21Å; R18-L21 CarbonylContact O-C 3.5Å; R18-L21 PolarHBondContact O-N 3.48Å; E19-L21 VanDerWaalsContact C-N 3.26Å; E19-L21 PolarHBondContact O-N 3.34Å; L21-L23 VanDerWaalsContact C-N 3.34Å; L21-L23 HydrophobicContact CB-CD1 4.13Å; L21-L23 HydrophobicContact CB-CG 4.39Å; L21-L23 PolarHBondContact O-N 3Å; L21-I542 CarbonylContact C-O 3.54Å; L21-I542 CarbonylContact O-C 3.17Å; L21-R543 WeakPolarHBondContact O-CA 3.45Å; L21-L544 HydrophobicContact CD1-CD1 4.2Å; L21-L544 HydrophobicContact CD2-CD1 3.64Å; L21-L544 HydrophobicContact CD2-CG 4.29Å; L21-L544 HydrophobicContact CG-CD1 4.37Å
22	G	46.2	Very low	45.2	Very low	16 Å²	16	85.7 Å²	85.7	17%	0.165	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.6	17.1	170.7	0	0	0	0	0	114.6	R18 E19 Q20 G24 S541	R18-G22 PolarHBondContact O-N 2.98Å; E19-G22 WeakPolarHBondContact O-CA 3.46Å; E19-G22 PolarHBondContact O-N 3.49Å; Q20-G22 VanDerWaalsContact C-N 3.26Å; G22-G24 PolarHBondContact O-N 3.49Å; G22-S541 WeakPolarHBondContact CA-OG 3.37Å; G22-S541 VanDerWaalsContact N-CB 3.33Å
23	L	46.9	Very low	45.1	Very low	5 Å²	5	86.1 Å²	86.1	3%	0.026	45%	0.454	C	S	.	.			trans	-93.7	89	-179.3	-59.7	164.8	0	0	0	108.5	R18 L21 E545 L688	R18-L23 HydrophobicContact CG-CB 3.52Å; R18-L23 HydrophobicContact CG-CD1 3.89Å; R18-L23 HydrophobicContact CG-CG 4.33Å; R18-L23 WeakPolarHBondContact O-CB 3.49Å; R18-L23 PolarHBondContact O-N 2.93Å; L21-L23 VanDerWaalsContact C-N 3.34Å; L21-L23 HydrophobicContact CB-CD1 4.13Å; L21-L23 HydrophobicContact CB-CG 4.39Å; L21-L23 PolarHBondContact O-N 3Å; L23-E545 HydrophobicContact CD2-CB 3.62Å; L23-E545 HydrophobicContact CD2-CG 3.43Å; L23-E545 VanDerWaalsContact CD2-CG 3.43Å; L23-E545 WeakPolarHBondContact CD2-OE1 3.24Å; L23-L688 HydrophobicContact CD1-CD2 4.44Å
24	G	43.9	Very low	44.5	Very low	41 Å²	41	83.1 Å²	83.1	42%	0.423	44%	0.444	S	S	.	.			trans	-91.9	157.4	177.8	0	0	0	0	0	112.6	G22 Q26	G22-G24 PolarHBondContact O-N 3.49Å; G24-Q26 PolarHBondContact O-N 3.19Å
25	D	41.2	Very low	43.9	Very low	141 Å²	141	84.6 Å²	84.6	75%	0.754	45%	0.452	S	S	*	.	S	Bend	trans	-71.7	15.9	-177.6	-76.7	-22.7	0	0	0	115.2	R18	R18-D25 IonicContact CZ-OD1 3.08Å; R18-D25 IonicContact NH1-OD1 2.56Å; R18-D25 PolarHBondContact NH1-OD1 2.86Å; R18-D25 IonicContact NH2-OD1 3.96Å
26	Q	38.4	Very low	43.4	Very low	168 Å²	168	81.8 Å²	81.8	79%	0.785	44%	0.437	S	S	*	.	S	Bend	trans	-111.9	116.3	171.6	-76.9	-162	-14	0	0	111	G24 N28	G24-Q26 PolarHBondContact O-N 3.19Å; Q26-N28 PolarHBondContact O-N 3.23Å
27	P	39.3	Very low	42.7	Very low	98 Å²	98	85.2 Å²	85.2	64%	0.636	45%	0.445	S	S	*	.			trans	-74.2	94.1	177	30.1	-30.7	0	0	0	109	D29	P27-D29 PolarHBondContact O-N 3.3Å
28	N	41.6	Very low	41.9	Very low	122 Å²	122	87.5 Å²	87.5	65%	0.652	46%	0.458	S	S	*	.			trans	-88.7	55.9	158.9	-105.3	-10.7	0	0	0	108.7	Q26 S30 Y31	Q26-N28 PolarHBondContact O-N 3.23Å; N28-S30 PolarHBondContact O-N 3.29Å; N28-Y31 PolarHBondContact O-N 3.39Å
29	D	43.5	Very low	41.2	Very low	103 Å²	103	87 Å²	87	55%	0.551	47%	0.468	S	S	*	.	H	α-helix	trans	-52.8	-30.1	-177.8	-67.7	-22.3	0	0	0	111.5	P27 Y31 Y33	P27-D29 PolarHBondContact O-N 3.3Å; D29-Y31 VanDerWaalsContact C-N 3.28Å; D29-Y31 PolarHBondContact O-N 3.16Å; D29-Y33 WeakPolarHBondContact O-CD2 3.42Å
30	S	41	Very low	40.6	Very low	72 Å²	72	86.7 Å²	86.7	50%	0.503	48%	0.475	S	S	.	.	H	α-helix	trans	-64.4	-20.3	178.6	69	0	0	0	0	115.5	N28 N34	N28-S30 PolarHBondContact O-N 3.29Å; S30-N34 WeakPolarHBondContact O-CB 3.41Å; S30-N34 PolarHBondContact O-N 3.37Å; S30-N34 PolarHBondContact O-ND2 2.86Å
31	Y	42.9	Very low	40.4	Very low	143 Å²	143	86 Å²	86	56%	0.561	48%	0.481	S	S	*	.	H	α-helix	trans	-79.1	-41.3	-175.6	-174.8	-98.9	0	0	0	112.8	N28 D29 Y33 N34 S35	N28-Y31 PolarHBondContact O-N 3.39Å; D29-Y31 VanDerWaalsContact C-N 3.28Å; D29-Y31 PolarHBondContact O-N 3.16Å; Y31-Y33 PolarHBondContact O-N 3.32Å; Y31-N34 PolarHBondContact O-N 3.24Å; Y31-S35 WeakPolarHBondContact O-CB 3.32Å; Y31-S35 PolarHBondContact O-N 3.13Å
32	C	45	Very low	40.1	Very low	21 Å²	21	87.9 Å²	87.9	14%	0.142	49%	0.49	C	S	.	.	H	α-helix	trans	-64.3	-40.7	177.3	-74.7	0	0	0	0	111.7	S35 A36 C546	C32-S35 PolarHBondContact O-N 3.37Å; C32-A36 PolarHBondContact O-N 3.18Å; C32-C546 VanDerWaalsContact CA-SG 3.58Å; C32-C546 HydrophobicContact CB-CB 3.86Å; C32-C546 WeakPolarHBondContact CB-SG 3.42Å; C32-C546 VanDerWaalsContact SG-CA 3.55Å; C32-C546 WeakPolarHBondContact SG-CB 3.37Å; C32-C546 CovalentContact SG-SG 2.05Å; C32-C546 PolarHBondContact SG-SG 3.25Å
33	Y	43.2	Very low	39.7	Very low	91 Å²	91	91.6 Å²	91.6	36%	0.357	50%	0.503	S	S	.	.	H	α-helix	trans	-70.2	-32.1	177.6	-70	-74.8	0	0	0	113.4	D29 Y31 L171 P550	D29-Y33 WeakPolarHBondContact O-CD2 3.42Å; Y31-Y33 PolarHBondContact O-N 3.32Å; Y33-L171 HydrophobicContact CD1-CD2 4.47Å; Y33-L171 HydrophobicContact CE1-CD2 3.61Å; Y33-P550 HydrophobicContact CE1-CG 4.25Å
34	N	35.7	Very low	39.7	Very low	80 Å²	80	95.5 Å²	95.5	43%	0.428	55%	0.545	S	S	.	.	H	α-helix	trans	-83.3	-19.8	176.1	-75.5	-42.8	0	0	0	113.7	S30 Y31 K37	S30-N34 WeakPolarHBondContact O-CB 3.41Å; S30-N34 PolarHBondContact O-N 3.37Å; S30-N34 PolarHBondContact O-ND2 2.86Å; Y31-N34 PolarHBondContact O-N 3.24Å; N34-K37 WeakPolarHBondContact O-CB 2.93Å; N34-K37 PolarHBondContact O-N 3.48Å; N34-K37 PolarHBondContact OD1-NZ 2.9Å
35	S	33.3	Very low	40.2	Very low	63 Å²	63	96.7 Å²	96.7	44%	0.441	54%	0.544	S	S	.	.	H	α-helix	trans	-76.8	-34.1	173.2	-161	0	0	0	0	112	Y31 C32 K37 N38	Y31-S35 WeakPolarHBondContact O-CB 3.32Å; Y31-S35 PolarHBondContact O-N 3.13Å; C32-S35 PolarHBondContact O-N 3.37Å; S35-K37 PolarHBondContact O-N 3.16Å; S35-N38 PolarHBondContact O-N 3.2Å; S35-N38 VanDerWaalsContact O-N 3.15Å
36	A	35.5	Very low	41.3	Very low	15 Å²	15	93.9 Å²	93.9	12%	0.124	53%	0.532	C	S	.	.	G	3₁₀ helix	trans	-63.4	-21.3	170.1	0	0	0	0	0	113.3	C32 N38 S39 L549	C32-A36 PolarHBondContact O-N 3.18Å; A36-N38 PolarHBondContact O-N 3.13Å; A36-N38 VanDerWaalsContact O-N 3.13Å; A36-S39 PolarHBondContact O-N 3.08Å; A36-S39 PolarHBondContact O-OG 3.13Å; A36-L549 HydrophobicContact CB-CD1 4.26Å; A36-L549 HydrophobicContact CB-CD2 3.93Å
37	K	34	Very low	43	Very low	128 Å²	128	88.3 Å²	88.3	56%	0.557	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-69.8	4.3	171.4	-84.2	179.9	-177.4	163.3	0	114.8	N34 S35 Q43	N34-K37 WeakPolarHBondContact O-CB 2.93Å; N34-K37 PolarHBondContact O-N 3.48Å; N34-K37 PolarHBondContact OD1-NZ 2.9Å; S35-K37 PolarHBondContact O-N 3.16Å; K37-Q43 PolarHBondContact O-NE2 2.81Å; K37-Q43 PolarHBondContact O-OE1 3.16Å
38	N	35.3	Very low	44.4	Very low	132 Å²	132	84.4 Å²	84.4	71%	0.706	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-119.1	3.6	176.4	-70.2	-23	0	0	0	113.6	S35 A36	S35-N38 PolarHBondContact O-N 3.2Å; S35-N38 VanDerWaalsContact O-N 3.15Å; A36-N38 PolarHBondContact O-N 3.13Å; A36-N38 VanDerWaalsContact O-N 3.13Å
39	S	37.9	Very low	45.9	Very low	77 Å²	77	78.7 Å²	78.7	54%	0.538	45%	0.453	S	S	.	.			trans	-89.6	106.4	173.1	33.8	0	0	0	0	111	A36 V41 Q43	A36-S39 PolarHBondContact O-N 3.08Å; A36-S39 PolarHBondContact O-OG 3.13Å; S39-V41 PolarHBondContact O-N 3.49Å; S39-Q43 PolarHBondContact O-OE1 2.98Å
40	T	38.2	Very low	47.8	Very low	125 Å²	125	74.1 Å²	74.1	77%	0.767	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	4.8	-156.6	47	0	0	0	0	117.5
41	V	40.6	Very low	49.9	Very low	129 Å²	129	74 Å²	74	78%	0.782	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-21.7	-170	-175.4	0	0	0	0	113.9	S39	S39-V41 PolarHBondContact O-N 3.49Å
42	L	38.1	Very low	51.7	Low	75 Å²	75	70.4 Å²	70.4	39%	0.393	42%	0.418	S	S	.	.	S	Bend	trans	-130.9	5.3	-179.1	-72.2	168.2	0	0	0	114	G44	L42-G44 PolarHBondContact O-N 3.32Å
43	Q	37.5	Very low	53.4	Low	94 Å²	94	71.1 Å²	71.1	44%	0.439	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	122.8	177.9	-79.1	-173.3	-83.7	0	0	111.8	K37 S39	K37-Q43 PolarHBondContact O-NE2 2.81Å; K37-Q43 PolarHBondContact O-OE1 3.16Å; S39-Q43 PolarHBondContact O-OE1 2.98Å
44	G	47.5	Very low	55.4	Low	88 Å²	88	69.1 Å²	69.1	91%	0.907	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	112.1	-4.3	174.2	0	0	0	0	0	115.1	L42	L42-G44 PolarHBondContact O-N 3.32Å
45	V	53.5	Low	57.9	Low	66 Å²	66	71 Å²	71	40%	0.4	43%	0.427	S	S	.	.	S	Bend	trans	-100.1	132.8	177.3	-127.4	0	0	0	0	110.7
46	T	65.4	Low	60.3	Low	81 Å²	81	72.5 Å²	72.5	50%	0.497	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-59.7	139.1	-180	49.5	0	0	0	0	111.1	G48 G49 Y176	T46-G48 VanDerWaalsContact C-N 3.35Å; T46-G48 PolarHBondContact O-N 2.94Å; T46-G49 PolarHBondContact O-N 2.74Å; T46-G49 VanDerWaalsContact O-N 3.14Å; T46-Y176 HydrophobicContact CG2-CD1 3.99Å; T46-Y176 HydrophobicContact CG2-CG 4.32Å
47	F	75.1	Confident	62.8	Low	52 Å²	52	72.2 Å²	72.2	23%	0.228	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	53.9	42.3	174.1	-157.5	-100.9	0	0	0	114.7	G49 I50 Y176 F178 T181 I630	F47-G49 PolarHBondContact O-N 3.28Å; F47-G49 VanDerWaalsContact O-N 3.17Å; F47-I50 HydrophobicContact CD1-CB 4.29Å; F47-I50 HydrophobicContact CD1-CD1 4Å; F47-I50 HydrophobicContact CE1-CD1 3.98Å; F47-I50 PolarHBondContact O-N 3.11Å; F47-Y176 VanDerWaalsContact CA-O 3.29Å; F47-Y176 WeakPolarHBondContact CA-O 3.01Å; F47-Y176 PolarHBondContact N-O 3.28Å; F47-F178 AromaticContact CD1-CD2 4Å; F47-F178 HydrophobicContact CD1-CD2 4Å; F47-F178 HydrophobicContact CD2-CB 4.4Å; F47-F178 AromaticContact CE1-CD2 3.65Å; F47-F178 HydrophobicContact CE1-CD2 3.65Å; F47-F178 HydrophobicContact CE1-CE2 4.13Å; F47-F178 HydrophobicContact CE2-CD2 4.21Å; F47-F178 HydrophobicContact CG-CD2 4.42Å; F47-F178 AromaticContact CZ-CD2 3.77Å; F47-F178 HydrophobicContact CZ-CD2 3.77Å; F47-F178 HydrophobicContact CZ-CE2 4.35Å; F47-T181 HydrophobicContact CE2-CG2 3.97Å; F47-T181 HydrophobicContact CZ-CG2 3.91Å; F47-I630 HydrophobicContact CE1-CD1 4.15Å; F47-I630 HydrophobicContact CZ-CD1 3.74Å
48	G	67.9	Low	65.6	Low	15 Å²	15	68.4 Å²	68.4	16%	0.155	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	66.4	17	177.7	0	0	0	0	0	114.6	T46 I50 N558	T46-G48 VanDerWaalsContact C-N 3.35Å; T46-G48 PolarHBondContact O-N 2.94Å; G48-I50 VanDerWaalsContact C-N 3.27Å; G48-I50 PolarHBondContact O-N 3.17Å; G48-N558 PolarHBondContact O-ND2 2.89Å; G48-N558 VanDerWaalsContact O-ND2 3.12Å
49	G	73.1	Confident	68.2	Low	3 Å²	3	65.2 Å²	65.2	3%	0.031	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	77.5	1.7	178.9	0	0	0	0	0	115.2	T46 F47 T52 V53	T46-G49 PolarHBondContact O-N 2.74Å; T46-G49 VanDerWaalsContact O-N 3.14Å; F47-G49 PolarHBondContact O-N 3.28Å; F47-G49 VanDerWaalsContact O-N 3.17Å; G49-T52 WeakPolarHBondContact O-CB 3.49Å; G49-T52 PolarHBondContact O-N 2.71Å; G49-T52 VanDerWaalsContact O-N 3.16Å; G49-V53 WeakPolarHBondContact O-CG2 3.06Å; G49-V53 PolarHBondContact O-N 3.49Å
50	I	82.9	Confident	70.6	Confident	7 Å²	7	63.7 Å²	63.7	4%	0.036	39%	0.389	C	S	.	.	H	α-helix	trans	-56.6	-48.5	-174.1	-65.5	161.6	0	0	0	113.1	F47 G48 T52 V53 L54 F178 A554 V557 N558 I561 F634	F47-I50 HydrophobicContact CD1-CB 4.29Å; F47-I50 HydrophobicContact CD1-CD1 4Å; F47-I50 HydrophobicContact CE1-CD1 3.98Å; F47-I50 PolarHBondContact O-N 3.11Å; G48-I50 VanDerWaalsContact C-N 3.27Å; G48-I50 PolarHBondContact O-N 3.17Å; I50-T52 VanDerWaalsContact C-N 3.28Å; I50-T52 PolarHBondContact O-N 3.19Å; I50-V53 PolarHBondContact O-N 2.88Å; I50-L54 VanDerWaalsContact O-CB 3.27Å; I50-L54 WeakPolarHBondContact O-CB 3.13Å; I50-L54 PolarHBondContact O-N 2.98Å; I50-F178 HydrophobicContact CD1-CD2 3.54Å; I50-F178 HydrophobicContact CD1-CE2 3.23Å; I50-F178 HydrophobicContact CD1-CZ 4.06Å; I50-A554 HydrophobicContact CD1-CB 4.4Å; I50-V557 HydrophobicContact CD1-CB 3.99Å; I50-V557 HydrophobicContact CD1-CG1 3.77Å; I50-V557 HydrophobicContact CD1-CG2 4.34Å; I50-V557 HydrophobicContact CG1-CB 4.3Å; I50-V557 HydrophobicContact CG1-CG1 3.94Å; I50-V557 HydrophobicContact CG2-CG1 4.06Å; I50-N558 WeakPolarHBondContact CA-OD1 3.29Å; I50-N558 VanDerWaalsContact CG1-OD1 3.3Å; I50-N558 WeakPolarHBondContact CG1-OD1 3.4Å; I50-I561 HydrophobicContact CG2-CD1 3.77Å; I50-F634 HydrophobicContact CG2-CE2 4.44Å
51	P	86.3	Confident	73.1	Confident	69 Å²	69	58.9 Å²	58.9	45%	0.448	36%	0.358	S	S	.	.	H	α-helix	trans	-62.6	-36.7	179.9	-23	35.1	0	0	0	112.7	L55	P51-L55 WeakPolarHBondContact O-CB 3.5Å; P51-L55 PolarHBondContact O-N 3.32Å; P51-L55 VanDerWaalsContact O-N 3.09Å
52	T	79.4	Confident	75.6	Confident	67 Å²	67	57.9 Å²	57.9	41%	0.411	35%	0.348	S	S	.	.	H	α-helix	trans	-68.7	-47.8	178	-52.7	0	0	0	0	111.1	G49 I50 L55 I56	G49-T52 WeakPolarHBondContact O-CB 3.49Å; G49-T52 PolarHBondContact O-N 2.71Å; G49-T52 VanDerWaalsContact O-N 3.16Å; I50-T52 VanDerWaalsContact C-N 3.28Å; I50-T52 PolarHBondContact O-N 3.19Å; T52-L55 PolarHBondContact O-N 3.21Å; T52-I56 HydrophobicContact CG2-CD1 3.97Å; T52-I56 VanDerWaalsContact O-CG1 3.32Å; T52-I56 WeakPolarHBondContact O-CG1 3.43Å; T52-I56 PolarHBondContact O-N 2.82Å
53	V	80.2	Confident	78.1	Confident	37 Å²	37	60.3 Å²	60.3	22%	0.224	36%	0.355	C	S	.	.	H	α-helix	trans	-60.4	-46.6	177	171.5	0	0	0	0	110.4	G49 I50 L55 I56 D57 N558 I561	G49-V53 WeakPolarHBondContact O-CG2 3.06Å; G49-V53 PolarHBondContact O-N 3.49Å; I50-V53 PolarHBondContact O-N 2.88Å; V53-L55 VanDerWaalsContact C-N 3.35Å; V53-L55 PolarHBondContact O-N 3.4Å; V53-I56 PolarHBondContact O-N 3.01Å; V53-D57 VanDerWaalsContact CG1-OD2 3.27Å; V53-D57 WeakPolarHBondContact CG1-OD2 2.96Å; V53-D57 VanDerWaalsContact O-CB 3.32Å; V53-D57 WeakPolarHBondContact O-CB 3.26Å; V53-D57 VanDerWaalsContact O-CG 3.26Å; V53-D57 PolarHBondContact O-N 3.32Å; V53-N558 HydrophobicContact CG1-CB 4.21Å; V53-I561 HydrophobicContact CG1-CG2 4.43Å
54	L	86.7	Confident	80.6	Confident	49 Å²	49	56.4 Å²	56.4	26%	0.257	34%	0.337	S	S	.	.	H	α-helix	trans	-57	-46.1	176.9	-178.9	65	0	0	0	112.2	I50 D57 V58 I561 F565 F634	I50-L54 VanDerWaalsContact O-CB 3.27Å; I50-L54 WeakPolarHBondContact O-CB 3.13Å; I50-L54 PolarHBondContact O-N 2.98Å; L54-D57 PolarHBondContact O-N 2.89Å; L54-V58 HydrophobicContact CD1-CG2 4Å; L54-V58 HydrophobicContact CG-CG2 4.4Å; L54-V58 WeakPolarHBondContact O-CB 3.36Å; L54-V58 WeakPolarHBondContact O-CG2 3.28Å; L54-V58 PolarHBondContact O-N 3.44Å; L54-I561 HydrophobicContact CB-CD1 4.47Å; L54-I561 HydrophobicContact CB-CG2 4.35Å; L54-I561 HydrophobicContact CD1-CD1 4.48Å; L54-I561 HydrophobicContact CD1-CG2 3.77Å; L54-F565 HydrophobicContact CD1-CD2 4.46Å; L54-F565 HydrophobicContact CD1-CE2 3.66Å; L54-F565 HydrophobicContact CD1-CZ 4.36Å; L54-F634 HydrophobicContact CD1-CE1 3.99Å; L54-F634 HydrophobicContact CD2-CE1 4.07Å; L54-F634 HydrophobicContact CD2-CZ 4.33Å
55	L	87.1	Confident	82.6	Confident	118 Å²	118	53.9 Å²	53.9	62%	0.618	30%	0.303	S	S	*	.	H	α-helix	trans	-63.9	-43.3	179.2	-173.3	150.4	0	0	0	111.6	P51 T52 V53 S59	P51-L55 WeakPolarHBondContact O-CB 3.5Å; P51-L55 PolarHBondContact O-N 3.32Å; P51-L55 VanDerWaalsContact O-N 3.09Å; T52-L55 PolarHBondContact O-N 3.21Å; V53-L55 VanDerWaalsContact C-N 3.35Å; V53-L55 PolarHBondContact O-N 3.4Å; L55-S59 VanDerWaalsContact O-CB 3.28Å; L55-S59 WeakPolarHBondContact O-CB 3.2Å; L55-S59 PolarHBondContact O-N 2.97Å; L55-S59 PolarHBondContact O-OG 3.47Å
56	I	84.9	Confident	84.3	Confident	95 Å²	95	54.8 Å²	54.8	49%	0.487	31%	0.305	S	S	.	.	H	α-helix	trans	-63.2	-48.4	177.3	-69.3	168.6	0	0	0	110.3	T52 V53 S59 C60	T52-I56 HydrophobicContact CG2-CD1 3.97Å; T52-I56 VanDerWaalsContact O-CG1 3.32Å; T52-I56 WeakPolarHBondContact O-CG1 3.43Å; T52-I56 PolarHBondContact O-N 2.82Å; V53-I56 PolarHBondContact O-N 3.01Å; I56-S59 PolarHBondContact O-N 3.04Å; I56-C60 VanDerWaalsContact O-CB 3.3Å; I56-C60 WeakPolarHBondContact O-CB 3.42Å; I56-C60 PolarHBondContact O-N 3.38Å
57	D	87.1	Confident	85.4	Confident	10 Å²	10	52.6 Å²	52.6	5%	0.053	29%	0.291	C	S	.	.	H	α-helix	trans	-67.9	-41.4	-175.4	-73	-13.5	0	0	0	111.9	V53 L54 C60 F61 I561 A562 F565 I566	V53-D57 VanDerWaalsContact CG1-OD2 3.27Å; V53-D57 WeakPolarHBondContact CG1-OD2 2.96Å; V53-D57 VanDerWaalsContact O-CB 3.32Å; V53-D57 WeakPolarHBondContact O-CB 3.26Å; V53-D57 VanDerWaalsContact O-CG 3.26Å; V53-D57 PolarHBondContact O-N 3.32Å; L54-D57 PolarHBondContact O-N 2.89Å; D57-C60 PolarHBondContact O-N 3.34Å; D57-F61 VanDerWaalsContact O-CB 3.29Å; D57-F61 WeakPolarHBondContact O-CB 3.47Å; D57-F61 PolarHBondContact O-N 2.97Å; D57-I561 HydrophobicContact CB-CG2 4.18Å; D57-I561 WeakPolarHBondContact OD2-CG2 3.42Å; D57-A562 WeakPolarHBondContact OD2-CA 3.34Å; D57-A562 PolarHBondContact OD2-N 2.9Å; D57-F565 HydrophobicContact CB-CB 4Å; D57-F565 HydrophobicContact CB-CD2 4.16Å; D57-F565 HydrophobicContact CB-CG 4.42Å; D57-I566 WeakPolarHBondContact OD1-CD1 3.28Å
58	V	91.9	Very high	86	Confident	48 Å²	48	51 Å²	51	29%	0.291	28%	0.284	S	S	.	.	H	α-helix	trans	-63.2	-44.5	173.5	170.9	0	0	0	0	110.6	L54 C60 F61 L62 F565	L54-V58 HydrophobicContact CD1-CG2 4Å; L54-V58 HydrophobicContact CG-CG2 4.4Å; L54-V58 WeakPolarHBondContact O-CB 3.36Å; L54-V58 WeakPolarHBondContact O-CG2 3.28Å; L54-V58 PolarHBondContact O-N 3.44Å; V58-C60 PolarHBondContact O-N 3.41Å; V58-F61 PolarHBondContact O-N 3.5Å; V58-L62 HydrophobicContact CG1-CD1 4.38Å; V58-L62 WeakPolarHBondContact O-CG 3.42Å; V58-L62 PolarHBondContact O-N 3.14Å; V58-F565 HydrophobicContact CG2-CD1 4.21Å; V58-F565 HydrophobicContact CG2-CD2 4.15Å; V58-F565 HydrophobicContact CG2-CE1 3.81Å; V58-F565 HydrophobicContact CG2-CE2 3.76Å; V58-F565 HydrophobicContact CG2-CG 4.37Å; V58-F565 HydrophobicContact CG2-CZ 3.58Å
59	S	90.6	Very high	86.8	Confident	64 Å²	64	50.8 Å²	50.8	45%	0.448	28%	0.28	S	S	.	.	H	α-helix	trans	-62.9	-42.9	177.6	-59.1	0	0	0	0	111.5	L55 I56 L62 F63	L55-S59 VanDerWaalsContact O-CB 3.28Å; L55-S59 WeakPolarHBondContact O-CB 3.2Å; L55-S59 PolarHBondContact O-N 2.97Å; L55-S59 PolarHBondContact O-OG 3.47Å; I56-S59 PolarHBondContact O-N 3.04Å; S59-L62 PolarHBondContact O-N 3.32Å; S59-F63 PolarHBondContact O-N 3.1Å
60	C	88.2	Confident	87.3	Confident	45 Å²	45	55.3 Å²	55.3	30%	0.304	30%	0.303	S	S	.	.	H	α-helix	trans	-63	-42.3	175.5	-170.7	0	0	0	0	111.2	I56 D57 V58 F63 L64 I566	I56-C60 VanDerWaalsContact O-CB 3.3Å; I56-C60 WeakPolarHBondContact O-CB 3.42Å; I56-C60 PolarHBondContact O-N 3.38Å; D57-C60 PolarHBondContact O-N 3.34Å; V58-C60 PolarHBondContact O-N 3.41Å; C60-F63 CarbonylContact O-C 3.57Å; C60-F63 WeakPolarHBondContact O-CB 3.44Å; C60-F63 PolarHBondContact O-N 3.21Å; C60-L64 WeakPolarHBondContact O-CG 3.44Å; C60-L64 PolarHBondContact O-N 3.28Å; C60-I566 HydrophobicContact CB-CG1 4.48Å
61	F	91.6	Very high	87.2	Confident	25 Å²	25	56.7 Å²	56.7	11%	0.11	31%	0.31	C	S	.	.	H	α-helix	trans	-63.6	-42.3	177.5	178.9	-113.9	0	0	0	112.9	D57 V58 F63 L64 I65 F565 L641	D57-F61 VanDerWaalsContact O-CB 3.29Å; D57-F61 WeakPolarHBondContact O-CB 3.47Å; D57-F61 PolarHBondContact O-N 2.97Å; V58-F61 PolarHBondContact O-N 3.5Å; F61-F63 VanDerWaalsContact C-N 3.3Å; F61-F63 PolarHBondContact O-N 3.5Å; F61-L64 PolarHBondContact O-N 2.94Å; F61-I65 HydrophobicContact CD1-CD1 3.82Å; F61-I65 HydrophobicContact CE1-CD1 3.36Å; F61-I65 HydrophobicContact CE1-CG1 4.38Å; F61-I65 HydrophobicContact CE2-CD1 4.12Å; F61-I65 HydrophobicContact CE2-CG1 4.34Å; F61-I65 HydrophobicContact CG-CD1 4.39Å; F61-I65 HydrophobicContact CZ-CD1 3.54Å; F61-I65 HydrophobicContact CZ-CG1 4.22Å; F61-I65 WeakPolarHBondContact O-CG1 3.49Å; F61-I65 PolarHBondContact O-N 3.04Å; F61-F565 HydrophobicContact CB-CB 3.9Å; F61-F565 HydrophobicContact CB-CD1 4.03Å; F61-F565 HydrophobicContact CB-CG 4.38Å; F61-F565 AromaticContact CD1-CD1 3.83Å; F61-F565 HydrophobicContact CD1-CD1 3.83Å; F61-F565 HydrophobicContact CD1-CE1 4.46Å; F61-F565 WeakPolarHBondContact CD2-O 3.27Å; F61-F565 HydrophobicContact CE1-CD1 4.41Å; F61-F565 HydrophobicContact CG-CB 4.31Å; F61-F565 AromaticContact CG-CD1 3.93Å; F61-F565 HydrophobicContact CG-CD1 3.93Å; F61-L641 HydrophobicContact CE1-CD2 4.43Å; F61-L641 HydrophobicContact CZ-CD1 4.44Å; F61-L641 HydrophobicContact CZ-CD2 4.19Å
62	L	91.8	Very high	86.9	Confident	108 Å²	108	55.2 Å²	55.2	57%	0.565	30%	0.295	S	S	*	.	H	α-helix	trans	-61.6	-40.5	173.6	-69.1	174.8	0	0	0	111.5	V58 S59 I65 L66	V58-L62 HydrophobicContact CG1-CD1 4.38Å; V58-L62 WeakPolarHBondContact O-CG 3.42Å; V58-L62 PolarHBondContact O-N 3.14Å; S59-L62 PolarHBondContact O-N 3.32Å; L62-I65 PolarHBondContact O-N 2.82Å; L62-L66 PolarHBondContact O-N 3.1Å
63	F	91.9	Very high	86.8	Confident	125 Å²	125	62.6 Å²	62.6	55%	0.548	32%	0.316	S	S	.	.	H	α-helix	trans	-63.1	-44.7	173.1	176	-99.1	0	0	0	112.1	S59 C60 F61 I65 L66 V67	S59-F63 PolarHBondContact O-N 3.1Å; C60-F63 CarbonylContact O-C 3.57Å; C60-F63 WeakPolarHBondContact O-CB 3.44Å; C60-F63 PolarHBondContact O-N 3.21Å; F61-F63 VanDerWaalsContact C-N 3.3Å; F61-F63 PolarHBondContact O-N 3.5Å; F63-I65 PolarHBondContact O-N 2.88Å; F63-L66 WeakPolarHBondContact O-CB 3.32Å; F63-L66 PolarHBondContact O-N 2.95Å; F63-L66 VanDerWaalsContact O-N 3.16Å; F63-V67 HydrophobicContact CD1-CG2 4.13Å; F63-V67 HydrophobicContact CD2-CG2 4.49Å; F63-V67 HydrophobicContact CE1-CG2 3.66Å; F63-V67 HydrophobicContact CE2-CG2 4.05Å; F63-V67 HydrophobicContact CZ-CG2 3.61Å; F63-V67 WeakPolarHBondContact O-CG2 3.29Å; F63-V67 PolarHBondContact O-N 3.17Å
64	L	90.1	Very high	86.5	Confident	13 Å²	13	70.5 Å²	70.5	7%	0.068	34%	0.341	C	S	.	.	H	α-helix	trans	-60.1	-43.8	175.9	-72.5	175.3	0	0	0	111.4	C60 F61 L66 V67 F68 M570 L573	C60-L64 WeakPolarHBondContact O-CG 3.44Å; C60-L64 PolarHBondContact O-N 3.28Å; F61-L64 PolarHBondContact O-N 2.94Å; L64-L66 VanDerWaalsContact C-N 3.31Å; L64-L66 PolarHBondContact O-N 3.43Å; L64-V67 PolarHBondContact O-N 2.9Å; L64-F68 WeakPolarHBondContact O-CB 3.48Å; L64-F68 PolarHBondContact O-N 3.35Å; L64-M570 HydrophobicContact CD1-CG 4.5Å; L64-M570 HydrophobicContact CD1-SD 4.5Å; L64-M570 HydrophobicContact CD2-SD 4.34Å; L64-L573 HydrophobicContact CB-CD1 3.85Å; L64-L573 HydrophobicContact CD2-CD1 4.1Å; L64-L573 HydrophobicContact CD2-CD2 4.14Å; L64-L573 HydrophobicContact CG-CD1 4.49Å; L64-L573 WeakPolarHBondContact O-CD1 3.26Å
65	I	89.7	Confident	85.7	Confident	35 Å²	35	73.7 Å²	73.7	18%	0.179	35%	0.354	C	S	.	.	H	α-helix	trans	-58.8	-43.5	174.2	-75.2	170.9	0	0	0	111.1	F61 L62 F63 F68 S69 W116	F61-I65 HydrophobicContact CD1-CD1 3.82Å; F61-I65 HydrophobicContact CE1-CD1 3.36Å; F61-I65 HydrophobicContact CE1-CG1 4.38Å; F61-I65 HydrophobicContact CE2-CD1 4.12Å; F61-I65 HydrophobicContact CE2-CG1 4.34Å; F61-I65 HydrophobicContact CG-CD1 4.39Å; F61-I65 HydrophobicContact CZ-CD1 3.54Å; F61-I65 HydrophobicContact CZ-CG1 4.22Å; F61-I65 WeakPolarHBondContact O-CG1 3.49Å; F61-I65 PolarHBondContact O-N 3.04Å; L62-I65 PolarHBondContact O-N 2.82Å; F63-I65 PolarHBondContact O-N 2.88Å; I65-F68 WeakPolarHBondContact O-CB 3.1Å; I65-F68 PolarHBondContact O-N 2.73Å; I65-S69 PolarHBondContact O-N 2.95Å; I65-S69 PolarHBondContact O-OG 2.83Å; I65-W116 HydrophobicContact CG2-CZ2 4.22Å
66	L	88.8	Confident	84.4	Confident	85 Å²	85	72.4 Å²	72.4	45%	0.445	34%	0.341	S	S	.	.	H	α-helix	trans	-63.6	-45.4	177.9	-178.4	146.4	0	0	0	111.4	L62 F63 L64 F68 S69 I70	L62-L66 PolarHBondContact O-N 3.1Å; F63-L66 WeakPolarHBondContact O-CB 3.32Å; F63-L66 PolarHBondContact O-N 2.95Å; F63-L66 VanDerWaalsContact O-N 3.16Å; L64-L66 VanDerWaalsContact C-N 3.31Å; L64-L66 PolarHBondContact O-N 3.43Å; L66-F68 VanDerWaalsContact C-N 3.33Å; L66-F68 PolarHBondContact O-N 3.04Å; L66-S69 PolarHBondContact O-N 2.89Å; L66-I70 HydrophobicContact CD2-CD1 3.55Å; L66-I70 HydrophobicContact CD2-CG1 4.47Å; L66-I70 HydrophobicContact CG-CD1 4.38Å; L66-I70 WeakPolarHBondContact O-CG1 3.38Å; L66-I70 PolarHBondContact O-N 2.76Å
67	V	88.6	Confident	83.3	Confident	35 Å²	35	72 Å²	72	21%	0.212	34%	0.339	C	S	.	.	H	α-helix	trans	-60.5	-43.8	175	172.4	0	0	0	0	110.6	F63 L64 I70 I71 L573	F63-V67 HydrophobicContact CD1-CG2 4.13Å; F63-V67 HydrophobicContact CD2-CG2 4.49Å; F63-V67 HydrophobicContact CE1-CG2 3.66Å; F63-V67 HydrophobicContact CE2-CG2 4.05Å; F63-V67 HydrophobicContact CZ-CG2 3.61Å; F63-V67 WeakPolarHBondContact O-CG2 3.29Å; F63-V67 PolarHBondContact O-N 3.17Å; L64-V67 PolarHBondContact O-N 2.9Å; V67-I70 PolarHBondContact O-N 2.87Å; V67-I71 HydrophobicContact CG1-CD1 3.6Å; V67-I71 HydrophobicContact CG1-CG1 4.2Å; V67-I71 WeakPolarHBondContact O-CB 3.35Å; V67-I71 VanDerWaalsContact O-CG1 3.29Å; V67-I71 WeakPolarHBondContact O-CG1 3.5Å; V67-I71 PolarHBondContact O-N 2.06Å; V67-L573 HydrophobicContact CB-CD2 4.24Å; V67-L573 HydrophobicContact CG1-CD2 3.7Å
68	F	87.6	Confident	82.1	Confident	17 Å²	17	73 Å²	73	8%	0.075	34%	0.343	C	S	.	.	H	α-helix	trans	-59.2	-47.2	175.7	172.7	-102.1	0	0	0	111.8	L64 I65 L66 I70 I71 R72 W116 L572 L573 H648	L64-F68 WeakPolarHBondContact O-CB 3.48Å; L64-F68 PolarHBondContact O-N 3.35Å; I65-F68 WeakPolarHBondContact O-CB 3.1Å; I65-F68 PolarHBondContact O-N 2.73Å; L66-F68 VanDerWaalsContact C-N 3.33Å; L66-F68 PolarHBondContact O-N 3.04Å; F68-I70 VanDerWaalsContact C-N 3.32Å; F68-I70 PolarHBondContact O-N 2.84Å; F68-I71 PolarHBondContact O-N 2.86Å; F68-R72 VanDerWaalsContact O-CB 3.28Å; F68-R72 WeakPolarHBondContact O-CB 3.36Å; F68-R72 PolarHBondContact O-N 2.83Å; F68-W116 HydrophobicContact CD1-CD2 4.43Å; F68-W116 AromaticContact CD1-CE2 3.78Å; F68-W116 HydrophobicContact CD1-CH2 4.19Å; F68-W116 AromaticContact CD1-CZ2 3.66Å; F68-W116 HydrophobicContact CD1-CZ2 3.66Å; F68-W116 AromaticContact CE1-CD2 3.76Å; F68-W116 HydrophobicContact CE1-CD2 3.76Å; F68-W116 AromaticContact CE1-CE2 3.58Å; F68-W116 HydrophobicContact CE1-CE3 4.01Å; F68-W116 HydrophobicContact CE1-CG 4.35Å; F68-W116 HydrophobicContact CE1-CH2 4.02Å; F68-W116 AromaticContact CE1-CZ2 3.74Å; F68-W116 HydrophobicContact CE1-CZ2 3.74Å; F68-W116 HydrophobicContact CE1-CZ3 4.12Å; F68-W116 AromaticContact CE1-NE1 3.99Å; F68-L572 HydrophobicContact CB-CD2 4.41Å; F68-L572 HydrophobicContact CD1-CD2 3.81Å; F68-L572 HydrophobicContact CD1-CG 4.17Å; F68-L572 HydrophobicContact CD2-CD2 4.31Å; F68-L572 HydrophobicContact CD2-CG 3.89Å; F68-L572 HydrophobicContact CE1-CD1 4.27Å; F68-L572 HydrophobicContact CE1-CD2 4.11Å; F68-L572 HydrophobicContact CE1-CG 4.19Å; F68-L572 HydrophobicContact CE2-CD1 4.17Å; F68-L572 HydrophobicContact CE2-CG 3.91Å; F68-L572 HydrophobicContact CG-CD2 3.91Å; F68-L572 HydrophobicContact CG-CG 4.02Å; F68-L572 HydrophobicContact CZ-CD1 3.97Å; F68-L572 HydrophobicContact CZ-CD2 4.48Å; F68-L572 HydrophobicContact CZ-CG 4.06Å; F68-L573 HydrophobicContact CB-CD1 4.01Å; F68-L573 HydrophobicContact CB-CG 4.1Å; F68-H648 AromaticContact CZ-NE2 3.58Å
69	S	84.5	Confident	80.8	Confident	11 Å²	11	71.1 Å²	71.1	8%	0.077	33%	0.332	C	S	.	.	H	α-helix	trans	-59.9	-40.3	176.4	-78	0	0	0	0	112.2	I65 L66 R73 C113 W116	I65-S69 PolarHBondContact O-N 2.95Å; I65-S69 PolarHBondContact O-OG 2.83Å; L66-S69 PolarHBondContact O-N 2.89Å; S69-R73 WeakPolarHBondContact O-CB 3.44Å; S69-R73 PolarHBondContact O-N 2.94Å; S69-R73 VanDerWaalsContact O-N 3.07Å; S69-C113 WeakPolarHBondContact CB-O 3.39Å; S69-C113 PolarHBondContact OG-O 3.46Å; S69-W116 PolarHBondContact OG-NE1 2.93Å; S69-W116 VanDerWaalsContact OG-NE1 3.14Å
70	I	84.3	Confident	79.6	Confident	99 Å²	99	69.3 Å²	69.3	51%	0.508	32%	0.316	S	S	.	.	H	α-helix	trans	-66.6	-48.9	175.9	-67.2	171	0	0	0	111.1	L66 V67 F68 R72 R73 R74	L66-I70 HydrophobicContact CD2-CD1 3.55Å; L66-I70 HydrophobicContact CD2-CG1 4.47Å; L66-I70 HydrophobicContact CG-CD1 4.38Å; L66-I70 WeakPolarHBondContact O-CG1 3.38Å; L66-I70 PolarHBondContact O-N 2.76Å; V67-I70 PolarHBondContact O-N 2.87Å; F68-I70 VanDerWaalsContact C-N 3.32Å; F68-I70 PolarHBondContact O-N 2.84Å; I70-R72 VanDerWaalsContact C-N 3.33Å; I70-R72 PolarHBondContact O-N 2.99Å; I70-R73 PolarHBondContact O-N 2.97Å; I70-R74 WeakPolarHBondContact O-CB 3.3Å; I70-R74 PolarHBondContact O-N 2.91Å
71	I	81.1	Confident	78.4	Confident	35 Å²	35	69.3 Å²	69.3	18%	0.179	31%	0.313	C	S	.	.	H	α-helix	trans	-59.5	-47.3	179.7	-71	171.2	0	0	0	109.5	V67 F68 R73 R74 F75 L573 L578	V67-I71 HydrophobicContact CG1-CD1 3.6Å; V67-I71 HydrophobicContact CG1-CG1 4.2Å; V67-I71 WeakPolarHBondContact O-CB 3.35Å; V67-I71 VanDerWaalsContact O-CG1 3.29Å; V67-I71 WeakPolarHBondContact O-CG1 3.5Å; V67-I71 PolarHBondContact O-N 2.06Å; F68-I71 PolarHBondContact O-N 2.86Å; I71-R73 VanDerWaalsContact C-N 3.34Å; I71-R73 PolarHBondContact O-N 3.15Å; I71-R74 PolarHBondContact O-N 2.97Å; I71-F75 HydrophobicContact CG2-CB 4.46Å; I71-F75 HydrophobicContact CG2-CD2 4.08Å; I71-F75 WeakPolarHBondContact O-CA 3.22Å; I71-F75 WeakPolarHBondContact O-CB 3.41Å; I71-F75 PolarHBondContact O-N 3.39Å; I71-L573 HydrophobicContact CD1-CD2 4.36Å; I71-L578 HydrophobicContact CD1-CD2 3.98Å; I71-L578 HydrophobicContact CG2-CD2 4.29Å
72	R	78.4	Confident	76.7	Confident	38 Å²	38	68.9 Å²	68.9	14%	0.143	31%	0.313	C	S	.	.	H	α-helix	trans	-59.2	-45.1	178.8	-176.5	175.7	177.6	164.1	-3.9	111.6	F68 I70 R74 W76 H648	F68-R72 VanDerWaalsContact O-CB 3.28Å; F68-R72 WeakPolarHBondContact O-CB 3.36Å; F68-R72 PolarHBondContact O-N 2.83Å; I70-R72 VanDerWaalsContact C-N 3.33Å; I70-R72 PolarHBondContact O-N 2.99Å; R72-R74 PolarHBondContact O-N 2.87Å; R72-W76 HydrophobicContact CG-CE3 4.05Å; R72-W76 HydrophobicContact CG-CZ3 3.82Å; R72-W76 WeakPolarHBondContact O-CA 3.47Å; R72-W76 PolarHBondContact O-N 2.88Å; R72-H648 PolarHBondContact NH1-CE1 2.75Å
73	R	77.3	Confident	75.2	Confident	223 Å²	223	65.8 Å²	65.8	84%	0.842	30%	0.297	S	S	*	.	H	α-helix	trans	-66.8	-34.8	178.8	-170.5	175.8	-179.2	-176.3	1.3	112.9	S69 I70 I71	S69-R73 WeakPolarHBondContact O-CB 3.44Å; S69-R73 PolarHBondContact O-N 2.94Å; S69-R73 VanDerWaalsContact O-N 3.07Å; I70-R73 PolarHBondContact O-N 2.97Å; I71-R73 VanDerWaalsContact C-N 3.34Å; I71-R73 PolarHBondContact O-N 3.15Å
74	R	74.8	Confident	73.5	Confident	202 Å²	202	62 Å²	62	76%	0.762	28%	0.284	S	S	*	.	H	α-helix	trans	-89.1	-31.7	-176.1	-170.6	60.3	173.8	-179	0.9	113.8	I70 I71 R72	I70-R74 WeakPolarHBondContact O-CB 3.3Å; I70-R74 PolarHBondContact O-N 2.91Å; I71-R74 PolarHBondContact O-N 2.97Å; R72-R74 PolarHBondContact O-N 2.87Å
75	F	69.1	Low	71.8	Confident	117 Å²	117	64.1 Å²	64.1	51%	0.513	30%	0.3	S	S	.	.			trans	-120.1	45.4	-175.1	-59.5	-80.8	0	0	0	111.1	I71 D77 Y78	I71-F75 HydrophobicContact CG2-CB 4.46Å; I71-F75 HydrophobicContact CG2-CD2 4.08Å; I71-F75 WeakPolarHBondContact O-CA 3.22Å; I71-F75 WeakPolarHBondContact O-CB 3.41Å; I71-F75 PolarHBondContact O-N 3.39Å; F75-D77 PolarHBondContact O-N 2.64Å; F75-Y78 WeakPolarHBondContact O-CB 3.29Å; F75-Y78 PolarHBondContact O-N 2.86Å
76	W	61.1	Low	70.1	Confident	91 Å²	91	64.5 Å²	64.5	35%	0.345	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-24.9	178.8	-166.4	-100.8	0	0	0	113.7	R72 Y78 I81 E108	R72-W76 HydrophobicContact CG-CE3 4.05Å; R72-W76 HydrophobicContact CG-CZ3 3.82Å; R72-W76 WeakPolarHBondContact O-CA 3.47Å; R72-W76 PolarHBondContact O-N 2.88Å; W76-Y78 PolarHBondContact O-N 3.41Å; W76-I81 HydrophobicContact CZ2-CG2 4.46Å; W76-E108 VanDerWaalsContact CH2-CD 3.46Å; W76-E108 WeakPolarHBondContact CH2-OE1 3.27Å; W76-E108 WeakPolarHBondContact CH2-OE2 3.46Å; W76-E108 WeakPolarHBondContact CZ2-OE1 3.47Å; W76-E108 VanDerWaalsContact CZ2-OE2 3.23Å; W76-E108 WeakPolarHBondContact CZ2-OE2 3.46Å
77	D	60.3	Low	68.6	Low	86 Å²	86	63.1 Å²	63.1	46%	0.46	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	9.2	176.5	-61.2	-0.8	0	0	0	115.3	F75 A82 K598	F75-D77 PolarHBondContact O-N 2.64Å; D77-A82 VanDerWaalsContact C-CB 3.47Å; D77-A82 WeakPolarHBondContact O-CB 3.31Å; D77-K598 IonicContact OD2-NZ 2.7Å; D77-K598 PolarHBondContact OD2-NZ 3.34Å
78	Y	62.1	Low	66.9	Low	32 Å²	32	63.9 Å²	63.9	13%	0.125	31%	0.305	C	S	.	.	S	Bend	trans	-108.9	113.5	-172.7	-173.2	-112.5	0	0	0	113.6	F75 W76 R574 L578 Y581 Q601	F75-Y78 WeakPolarHBondContact O-CB 3.29Å; F75-Y78 PolarHBondContact O-N 2.86Å; W76-Y78 PolarHBondContact O-N 3.41Å; Y78-R574 VanDerWaalsContact CD1-NH2 3.34Å; Y78-L578 HydrophobicContact CD1-CD1 4.47Å; Y78-L578 HydrophobicContact CE1-CD1 4.35Å; Y78-L578 HydrophobicContact CE2-CD1 4.46Å; Y78-Y581 HydrophobicContact CD2-CD1 4.11Å; Y78-Y581 HydrophobicContact CD2-CE1 4.32Å; Y78-Y581 HydrophobicContact CD2-CG 4.21Å; Y78-Y581 HydrophobicContact CE2-CD1 4.23Å; Y78-Y581 HydrophobicContact CE2-CD2 4.43Å; Y78-Y581 AromaticContact CE2-CG 3.99Å; Y78-Y581 HydrophobicContact CE2-CG 3.99Å; Y78-Q601 HydrophobicContact CD2-CG 4.01Å; Y78-Q601 HydrophobicContact CE2-CG 3.57Å
79	G	64.9	Low	65	Low	7 Å²	7	65.7 Å²	65.7	7%	0.072	32%	0.319	C	S	.	.	S	Bend	trans	114	-160.8	171.1	0	0	0	0	0	114.1	I81 A82	G79-I81 VanDerWaalsContact C-N 3.35Å; G79-I81 PolarHBondContact O-N 3.4Å; G79-A82 WeakPolarHBondContact O-CB 3.12Å; G79-A82 PolarHBondContact O-N 3.38Å
80	R	66	Low	63.1	Low	26 Å²	26	70.4 Å²	70.4	10%	0.098	34%	0.34	C	S	.	.	H	α-helix	trans	-59.5	-39.5	179.9	174.3	-173.6	170.4	173.2	13.8	113.3	A82 L83 V84 W131 C132 Y651 V653 Y654	R80-A82 PolarHBondContact O-N 3.38Å; R80-L83 WeakPolarHBondContact O-CB 3.15Å; R80-L83 PolarHBondContact O-N 3.07Å; R80-V84 HydrophobicContact CG-CG2 4.15Å; R80-V84 PolarHBondContact O-N 3.46Å; R80-W131 VanDerWaalsContact CZ-O 3.3Å; R80-W131 PolarHBondContact NH1-O 3.25Å; R80-W131 VanDerWaalsContact NH1-O 3.13Å; R80-W131 PolarHBondContact NH2-O 3.38Å; R80-C132 PolarHBondContact NH1-SG 2.91Å; R80-C132 VanDerWaalsContact NH1-SG 3.37Å; R80-Y651 PolarHBondContact NH1-O 3.1Å; R80-V653 WeakPolarHBondContact CB-O 3.05Å; R80-V653 PolarHBondContact N-O 2.84Å; R80-V653 VanDerWaalsContact N-O 3.11Å; R80-Y654 WeakPolarHBondContact CD-O 3.48Å
81	I	62.3	Low	61.2	Low	46 Å²	46	67.1 Å²	67.1	24%	0.236	33%	0.326	C	S	.	.	H	α-helix	trans	-57.9	-37.5	179.1	-57.9	171.3	0	0	0	111	W76 G79 L83 V84 S85 F652	W76-I81 HydrophobicContact CZ2-CG2 4.46Å; G79-I81 VanDerWaalsContact C-N 3.35Å; G79-I81 PolarHBondContact O-N 3.4Å; I81-L83 VanDerWaalsContact C-N 3.3Å; I81-L83 PolarHBondContact O-N 2.88Å; I81-V84 PolarHBondContact O-N 2.89Å; I81-S85 VanDerWaalsContact O-CB 3.24Å; I81-S85 WeakPolarHBondContact O-CB 3.41Å; I81-S85 PolarHBondContact O-N 3.15Å; I81-S85 PolarHBondContact O-OG 3.35Å; I81-S85 VanDerWaalsContact O-OG 3.12Å; I81-F652 HydrophobicContact CD1-CB 4.08Å; I81-F652 HydrophobicContact CD1-CD1 3.56Å; I81-F652 HydrophobicContact CD1-CE1 4.45Å; I81-F652 HydrophobicContact CD1-CG 4.24Å; I81-F652 HydrophobicContact CG1-CB 4.49Å; I81-F652 HydrophobicContact CG1-CD1 4.18Å
82	A	56.5	Low	59.1	Low	15 Å²	15	72 Å²	72	12%	0.124	34%	0.342	C	S	.	.	H	α-helix	trans	-61.1	-40.9	176.7	0	0	0	0	0	111.6	D77 G79 R80 S85 E86	D77-A82 VanDerWaalsContact C-CB 3.47Å; D77-A82 WeakPolarHBondContact O-CB 3.31Å; G79-A82 WeakPolarHBondContact O-CB 3.12Å; G79-A82 PolarHBondContact O-N 3.38Å; R80-A82 PolarHBondContact O-N 3.38Å; A82-S85 PolarHBondContact O-OG 3.34Å; A82-E86 WeakPolarHBondContact O-CB 3.2Å; A82-E86 PolarHBondContact O-N 2.93Å; A82-E86 VanDerWaalsContact O-N 3.13Å
83	L	59.3	Low	57.1	Low	43 Å²	43	77.2 Å²	77.2	23%	0.225	37%	0.366	C	S	.	.	H	α-helix	trans	-67.7	-45.3	176.7	-61.1	179.5	0	0	0	112.8	R80 I81 E86 A87 Q599 A602 L655	R80-L83 WeakPolarHBondContact O-CB 3.15Å; R80-L83 PolarHBondContact O-N 3.07Å; I81-L83 VanDerWaalsContact C-N 3.3Å; I81-L83 PolarHBondContact O-N 2.88Å; L83-E86 PolarHBondContact O-N 3.35Å; L83-A87 WeakPolarHBondContact O-CB 3.39Å; L83-A87 PolarHBondContact O-N 3.14Å; L83-Q599 HydrophobicContact CD2-CB 4.33Å; L83-Q599 WeakPolarHBondContact CD2-O 3.37Å; L83-A602 HydrophobicContact CD1-CB 3.38Å; L83-A602 HydrophobicContact CG-CB 4.38Å; L83-L655 HydrophobicContact CD1-CD2 4.41Å
84	V	57.5	Low	55.2	Low	46 Å²	46	74.3 Å²	74.3	28%	0.279	36%	0.362	S	S	.	.	H	α-helix	trans	-66.6	-43.7	180	177.7	0	0	0	0	110.3	R80 I81 E86 A87 D88	R80-V84 HydrophobicContact CG-CG2 4.15Å; R80-V84 PolarHBondContact O-N 3.46Å; I81-V84 PolarHBondContact O-N 2.89Å; V84-E86 VanDerWaalsContact C-N 3.26Å; V84-E86 PolarHBondContact O-N 3.48Å; V84-A87 PolarHBondContact O-N 2.76Å; V84-D88 WeakPolarHBondContact O-CB 3.33Å; V84-D88 PolarHBondContact O-N 2.82Å
85	S	53.7	Low	53.3	Low	57 Å²	57	70.7 Å²	70.7	40%	0.399	35%	0.348	S	S	.	.	H	α-helix	trans	-61.9	-34	177.6	72.7	0	0	0	0	112.7	I81 A82 S89	I81-S85 VanDerWaalsContact O-CB 3.24Å; I81-S85 WeakPolarHBondContact O-CB 3.41Å; I81-S85 PolarHBondContact O-N 3.15Å; I81-S85 PolarHBondContact O-OG 3.35Å; I81-S85 VanDerWaalsContact O-OG 3.12Å; A82-S85 PolarHBondContact O-OG 3.34Å; S85-S89 WeakPolarHBondContact O-CB 3.39Å; S85-S89 PolarHBondContact O-N 3.25Å
86	E	54.3	Low	51.6	Low	44 Å²	44	72.3 Å²	72.3	21%	0.206	36%	0.361	C	S	.	.	H	α-helix	trans	-78.8	-39.2	177.6	-162.7	173.5	-166.8	0	0	111.4	A82 L83 V84 D88 S89 E90 R595 Q599	A82-E86 WeakPolarHBondContact O-CB 3.2Å; A82-E86 PolarHBondContact O-N 2.93Å; A82-E86 VanDerWaalsContact O-N 3.13Å; L83-E86 PolarHBondContact O-N 3.35Å; V84-E86 VanDerWaalsContact C-N 3.26Å; V84-E86 PolarHBondContact O-N 3.48Å; E86-D88 VanDerWaalsContact C-N 3.28Å; E86-D88 PolarHBondContact O-N 2.78Å; E86-S89 WeakPolarHBondContact CA-OG 3.4Å; E86-S89 CarbonylContact O-C 3.47Å; E86-S89 WeakPolarHBondContact O-CA 3.35Å; E86-S89 WeakPolarHBondContact O-CB 3.36Å; E86-S89 PolarHBondContact O-N 2.9Å; E86-S89 PolarHBondContact O-OG 3.17Å; E86-E90 PolarHBondContact O-N 3.35Å; E86-R595 IonicContact OE1-CZ 3.75Å; E86-R595 IonicContact OE1-NE 3.81Å; E86-R595 PolarHBondContact OE1-NE 3.15Å; E86-R595 IonicContact OE1-NH2 3.61Å; E86-R595 PolarHBondContact OE1-NH2 2.93Å; E86-Q599 VanDerWaalsContact CD-NE2 3.34Å; E86-Q599 PolarHBondContact OE1-NE2 3.3Å; E86-Q599 WeakPolarHBondContact OE2-CG 3.5Å; E86-Q599 PolarHBondContact OE2-NE2 2.96Å
87	A	57	Low	50.4	Low	55 Å²	55	73 Å²	73	46%	0.455	38%	0.38	S	S	.	.	H	α-helix	trans	-61.1	-38.1	171.2	0	0	0	0	0	111.5	L83 V84 S89 E90 S91	L83-A87 WeakPolarHBondContact O-CB 3.39Å; L83-A87 PolarHBondContact O-N 3.14Å; V84-A87 PolarHBondContact O-N 2.76Å; A87-S89 VanDerWaalsContact C-N 3.29Å; A87-S89 PolarHBondContact O-N 3.46Å; A87-E90 PolarHBondContact O-N 2.96Å; A87-S91 VanDerWaalsContact O-CB 3.29Å; A87-S91 WeakPolarHBondContact O-CB 3.41Å; A87-S91 PolarHBondContact O-N 2.98Å; A87-S91 PolarHBondContact O-OG 2.88Å
88	D	52.5	Low	48.8	Very low	52 Å²	52	72.6 Å²	72.6	28%	0.278	38%	0.384	S	S	.	.	H	α-helix	trans	-70.7	-23.8	172	-85.7	-17.1	0	0	0	113.4	V84 E86 S91 R92	V84-D88 WeakPolarHBondContact O-CB 3.33Å; V84-D88 PolarHBondContact O-N 2.82Å; E86-D88 VanDerWaalsContact C-N 3.28Å; E86-D88 PolarHBondContact O-N 2.78Å; D88-S91 WeakPolarHBondContact CA-OG 3.36Å; D88-S91 PolarHBondContact O-OG 3.4Å; D88-R92 WeakPolarHBondContact O-CB 3.03Å; D88-R92 PolarHBondContact O-N 3.39Å; D88-R92 PolarHBondContact O-NE 3.41Å
89	S	47.8	Very low	47.4	Very low	54 Å²	54	77.6 Å²	77.6	38%	0.378	42%	0.418	S	S	.	.	H	α-helix	trans	-78.4	-38.4	172.9	81.3	0	0	0	0	111.9	S85 E86 A87 R92 F93	S85-S89 WeakPolarHBondContact O-CB 3.39Å; S85-S89 PolarHBondContact O-N 3.25Å; E86-S89 WeakPolarHBondContact CA-OG 3.4Å; E86-S89 CarbonylContact O-C 3.47Å; E86-S89 WeakPolarHBondContact O-CA 3.35Å; E86-S89 WeakPolarHBondContact O-CB 3.36Å; E86-S89 PolarHBondContact O-N 2.9Å; E86-S89 PolarHBondContact O-OG 3.17Å; A87-S89 VanDerWaalsContact C-N 3.29Å; A87-S89 PolarHBondContact O-N 3.46Å; S89-R92 WeakPolarHBondContact O-CB 3.24Å; S89-R92 PolarHBondContact O-N 2.71Å; S89-F93 PolarHBondContact O-N 2.93Å
90	E	45.3	Very low	45.8	Very low	111 Å²	111	82.7 Å²	82.7	52%	0.519	45%	0.452	S	S	.	.	H	α-helix	trans	-69.1	-42	172.6	-75.8	-172.4	167.6	0	0	110.6	E86 A87 R92 F93 Q94 R595	E86-E90 PolarHBondContact O-N 3.35Å; A87-E90 PolarHBondContact O-N 2.96Å; E90-R92 VanDerWaalsContact C-N 3.34Å; E90-R92 PolarHBondContact O-N 3.38Å; E90-F93 WeakPolarHBondContact O-CA 3.12Å; E90-F93 WeakPolarHBondContact O-CB 3.44Å; E90-F93 PolarHBondContact O-N 3.05Å; E90-F93 VanDerWaalsContact O-N 3.08Å; E90-Q94 PolarHBondContact O-N 2.8Å; E90-Q94 VanDerWaalsContact O-N 3.08Å; E90-R595 IonicContact OE1-NH2 3.75Å
91	S	43.1	Very low	44.1	Very low	29 Å²	29	86 Å²	86	20%	0.203	48%	0.48	C	S	.	.	H	α-helix	trans	-65.8	-36.3	172.7	82.2	0	0	0	0	111.2	A87 D88 F93 Q94 R95	A87-S91 VanDerWaalsContact O-CB 3.29Å; A87-S91 WeakPolarHBondContact O-CB 3.41Å; A87-S91 PolarHBondContact O-N 2.98Å; A87-S91 PolarHBondContact O-OG 2.88Å; D88-S91 WeakPolarHBondContact CA-OG 3.36Å; D88-S91 PolarHBondContact O-OG 3.4Å; S91-F93 VanDerWaalsContact C-N 3.31Å; S91-F93 PolarHBondContact O-N 3.44Å; S91-Q94 CarbonylContact O-C 3.42Å; S91-Q94 PolarHBondContact O-N 2.92Å; S91-R95 VanDerWaalsContact O-CB 3.27Å; S91-R95 WeakPolarHBondContact O-CB 3.47Å; S91-R95 PolarHBondContact O-N 3.46Å
92	R	37	Very low	42.8	Very low	138 Å²	138	89.2 Å²	89.2	52%	0.521	51%	0.506	S	S	.	.	H	α-helix	trans	-61.7	-35.8	168.4	-106.1	177.6	-85.2	-157.6	-9.1	113	D88 S89 E90 Q94 R95 L96	D88-R92 WeakPolarHBondContact O-CB 3.03Å; D88-R92 PolarHBondContact O-N 3.39Å; D88-R92 PolarHBondContact O-NE 3.41Å; S89-R92 WeakPolarHBondContact O-CB 3.24Å; S89-R92 PolarHBondContact O-N 2.71Å; E90-R92 VanDerWaalsContact C-N 3.34Å; E90-R92 PolarHBondContact O-N 3.38Å; R92-Q94 VanDerWaalsContact C-N 3.26Å; R92-Q94 PolarHBondContact O-N 3.27Å; R92-R95 PolarHBondContact O-N 3.37Å; R92-L96 WeakPolarHBondContact O-CD1 3.43Å; R92-L96 PolarHBondContact O-N 3Å; R92-L96 VanDerWaalsContact O-N 3.08Å
93	F	38	Very low	41.7	Very low	148 Å²	148	91.9 Å²	91.9	65%	0.649	54%	0.535	S	S	*	.	H	α-helix	trans	-67	-30	176	-150	-94.1	0	0	0	111.7	S89 E90 S91	S89-F93 PolarHBondContact O-N 2.93Å; E90-F93 WeakPolarHBondContact O-CA 3.12Å; E90-F93 WeakPolarHBondContact O-CB 3.44Å; E90-F93 PolarHBondContact O-N 3.05Å; E90-F93 VanDerWaalsContact O-N 3.08Å; S91-F93 VanDerWaalsContact C-N 3.31Å; S91-F93 PolarHBondContact O-N 3.44Å
94	Q	36.7	Very low	40.8	Very low	161 Å²	161	96.7 Å²	96.7	75%	0.752	56%	0.556	S	S	*	*	H	α-helix	trans	-82.6	-28.9	168.8	-86.9	171.1	-34.5	0	0	114	E90 S91 R92 S97	E90-Q94 PolarHBondContact O-N 2.8Å; E90-Q94 VanDerWaalsContact O-N 3.08Å; S91-Q94 CarbonylContact O-C 3.42Å; S91-Q94 PolarHBondContact O-N 2.92Å; R92-Q94 VanDerWaalsContact C-N 3.26Å; R92-Q94 PolarHBondContact O-N 3.27Å; Q94-S97 PolarHBondContact O-OG 3.31Å
95	R	33.9	Very low	39.9	Very low	127 Å²	127	101.6 Å²	101.6	48%	0.479	58%	0.576	S	S	.	*	H	α-helix	trans	-88.3	1.9	-177.3	-129.7	178.9	-70.2	171.4	-0.7	114.2	S91 R92 S97 S98	S91-R95 VanDerWaalsContact O-CB 3.27Å; S91-R95 WeakPolarHBondContact O-CB 3.47Å; S91-R95 PolarHBondContact O-N 3.46Å; R92-R95 PolarHBondContact O-N 3.37Å; R95-S97 PolarHBondContact O-N 2.84Å; R95-S98 PolarHBondContact O-N 3.4Å; R95-S98 VanDerWaalsContact O-O 3.08Å
96	L	35.2	Very low	39.1	Very low	150 Å²	150	105.6 Å²	105.6	79%	0.785	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	9.3	170.6	-95.8	144.9	0	0	0	114.1	R92	R92-L96 WeakPolarHBondContact O-CD1 3.43Å; R92-L96 PolarHBondContact O-N 3Å; R92-L96 VanDerWaalsContact O-N 3.08Å
97	S	35.4	Very low	38.5	Very low	105 Å²	105	111 Å²	111	73%	0.734	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111	4.1	167.3	51.5	0	0	0	0	114.6	Q94 R95	Q94-S97 PolarHBondContact O-OG 3.31Å; R95-S97 PolarHBondContact O-N 2.84Å
98	S	26.2	Very low	38.1	Very low	78 Å²	78	113.8 Å²	113.8	55%	0.545	62%	0.62	S	S	.	*	S	Bend	trans	-159.5	129.9	169.6	43.6	0	0	0	0	113.8	R95	R95-S98 PolarHBondContact O-N 3.4Å; R95-S98 VanDerWaalsContact O-O 3.08Å
99	T	32.7	Very low	37.4	Very low	138 Å²	138	118.5 Å²	118.5	85%	0.847	65%	0.645	S	S	*	*			trans	-67.4	153.7	-171.6	-33.8	0	0	0	0	114
100	S	31.7	Very low	36.9	Very low	113 Å²	113	124.2 Å²	124.2	79%	0.79	67%	0.666	S	S	*	*			trans	87.2	105.9	156.9	70.5	0	0	0	0	119.7
101	S	30.1	Very low	36.7	Very low	97 Å²	97	126.9 Å²	126.9	68%	0.678	68%	0.683	S	S	*	*			trans	-166.9	87.8	134.1	65.8	0	0	0	0	110	G103	S101-G103 VanDerWaalsContact C-N 3.3Å; S101-G103 PolarHBondContact O-N 3.29Å
102	S	34.8	Very low	37.3	Very low	113 Å²	113	128.8 Å²	128.8	79%	0.79	71%	0.707	S	S	*	*			trans	-86.1	48.3	179.8	55.5	0	0	0	0	112.7
103	G	34.4	Very low	38.2	Very low	70 Å²	70	126.1 Å²	126.1	72%	0.722	71%	0.709	S	S	*	*			trans	-101.7	-11.9	-169.7	0	0	0	0	0	116.8	S101	S101-G103 VanDerWaalsContact C-N 3.3Å; S101-G103 PolarHBondContact O-N 3.29Å
104	Q	39.7	Very low	39.4	Very low	144 Å²	144	121.7 Å²	121.7	67%	0.673	70%	0.695	S	S	*	*	S	Bend	trans	-120	-5	-163.5	-140.2	156.6	-6.1	0	0	114.6
105	Q	38.3	Very low	40.9	Very low	149 Å²	149	116.6 Å²	116.6	70%	0.696	68%	0.676	S	S	*	*	S	Bend	trans	-88.3	-8.4	-178.9	-89.5	179.5	-28.2	0	0	114.6
106	D	36.7	Very low	42.7	Very low	142 Å²	142	111.6 Å²	111.6	76%	0.759	66%	0.657	S	S	*	*	S	Bend	trans	-95	-1.4	-171.8	-63.8	-21.6	0	0	0	114.7
107	F	42.9	Very low	44.6	Very low	158 Å²	158	107.7 Å²	107.7	69%	0.693	64%	0.637	S	S	*	*	S	Bend	trans	-84.2	-11	-173.8	-126.1	-87	0	0	0	115.2
108	E	46.8	Very low	46.4	Very low	112 Å²	112	106.7 Å²	106.7	52%	0.523	63%	0.626	S	S	.	*	S	Bend	trans	-120.5	-7.3	-164.8	-79.3	-179.4	172.7	0	0	116.3	W76	W76-E108 VanDerWaalsContact CH2-CD 3.46Å; W76-E108 WeakPolarHBondContact CH2-OE1 3.27Å; W76-E108 WeakPolarHBondContact CH2-OE2 3.46Å; W76-E108 WeakPolarHBondContact CZ2-OE1 3.47Å; W76-E108 VanDerWaalsContact CZ2-OE2 3.23Å; W76-E108 WeakPolarHBondContact CZ2-OE2 3.46Å
109	N	39.3	Very low	48.6	Very low	152 Å²	152	104 Å²	104	81%	0.813	61%	0.609	S	S	*	*	S	Bend	trans	-101	6.3	-169.5	-98.6	-5.4	0	0	0	117
110	E	37.8	Very low	50.8	Low	174 Å²	174	97.6 Å²	97.6	81%	0.813	57%	0.569	S	S	*	*	S	Bend	trans	-118.5	108.1	178.1	-62	-145.9	156	0	0	114
111	L	40.3	Very low	53	Low	167 Å²	167	98.6 Å²	98.6	87%	0.874	56%	0.56	S	S	*	*	S	Bend	trans	58.5	111.7	162.2	-85.4	74.5	0	0	0	120.8
112	G	55.3	Low	55.3	Low	68 Å²	68	102.1 Å²	102.1	70%	0.701	56%	0.558	S	S	*	*			trans	123.1	168.3	152.3	0	0	0	0	0	117.8	P115	G112-P115 VanDerWaalsContact O-CD 3.31Å; G112-P115 WeakPolarHBondContact O-CD 3.39Å
113	C	55.4	Low	57.4	Low	83 Å²	83	97.3 Å²	97.3	56%	0.561	52%	0.524	S	S	*	.	S	Bend	trans	-80.2	-13.9	175.2	-169.1	0	0	0	0	113.5	S69	S69-C113 WeakPolarHBondContact CB-O 3.39Å; S69-C113 PolarHBondContact OG-O 3.46Å
114	C	63.3	Low	59.8	Low	55 Å²	55	99.7 Å²	99.7	37%	0.372	52%	0.516	S	S	.	.			trans	-130.9	29.5	-171.2	-53.2	0	0	0	0	117.4	W116 L117	C114-W116 PolarHBondContact O-N 2.93Å; C114-W116 VanDerWaalsContact O-N 3.08Å; C114-L117 HydrophobicContact CB-CB 4.37Å; C114-L117 WeakPolarHBondContact O-CB 3.44Å; C114-L117 PolarHBondContact O-N 2.87Å
115	P	68.3	Low	62	Low	53 Å²	53	95.2 Å²	95.2	34%	0.344	50%	0.496	S	S	.	.	H	α-helix	trans	-56	-27	176	-23.2	31.5	0	0	0	113.9	G112 L117 T118 A119	G112-P115 VanDerWaalsContact O-CD 3.31Å; G112-P115 WeakPolarHBondContact O-CD 3.39Å; P115-L117 PolarHBondContact O-N 3.18Å; P115-T118 PolarHBondContact O-N 2.91Å; P115-T118 PolarHBondContact O-OG1 2.99Å; P115-A119 PolarHBondContact O-N 3.15Å; P115-A119 VanDerWaalsContact O-N 3.07Å
116	W	73.1	Confident	64.3	Low	23 Å²	23	94.1 Å²	94.1	9%	0.087	50%	0.495	C	S	.	.	H	α-helix	trans	-63.4	-28.4	176.6	70.6	-92.7	0	0	0	113.5	I65 F68 S69 C114 I120 L572	I65-W116 HydrophobicContact CG2-CZ2 4.22Å; F68-W116 HydrophobicContact CD1-CD2 4.43Å; F68-W116 AromaticContact CD1-CE2 3.78Å; F68-W116 HydrophobicContact CD1-CH2 4.19Å; F68-W116 AromaticContact CD1-CZ2 3.66Å; F68-W116 HydrophobicContact CD1-CZ2 3.66Å; F68-W116 AromaticContact CE1-CD2 3.76Å; F68-W116 HydrophobicContact CE1-CD2 3.76Å; F68-W116 AromaticContact CE1-CE2 3.58Å; F68-W116 HydrophobicContact CE1-CE3 4.01Å; F68-W116 HydrophobicContact CE1-CG 4.35Å; F68-W116 HydrophobicContact CE1-CH2 4.02Å; F68-W116 AromaticContact CE1-CZ2 3.74Å; F68-W116 HydrophobicContact CE1-CZ2 3.74Å; F68-W116 HydrophobicContact CE1-CZ3 4.12Å; F68-W116 AromaticContact CE1-NE1 3.99Å; S69-W116 PolarHBondContact OG-NE1 2.93Å; S69-W116 VanDerWaalsContact OG-NE1 3.14Å; C114-W116 PolarHBondContact O-N 2.93Å; C114-W116 VanDerWaalsContact O-N 3.08Å; W116-I120 HydrophobicContact CE3-CD1 3.48Å; W116-I120 VanDerWaalsContact CE3-CD1 3.48Å; W116-I120 HydrophobicContact CE3-CG1 4.47Å; W116-I120 HydrophobicContact CZ3-CD1 3.39Å; W116-I120 WeakPolarHBondContact O-CG1 3.49Å; W116-I120 PolarHBondContact O-N 2.93Å; W116-L572 HydrophobicContact CH2-CD1 4.38Å; W116-L572 HydrophobicContact CH2-CD2 3.54Å; W116-L572 HydrophobicContact CZ2-CD2 4.14Å; W116-L572 HydrophobicContact CZ3-CD1 4.25Å; W116-L572 HydrophobicContact CZ3-CD2 4.23Å
117	L	73.4	Confident	66.6	Low	68 Å²	68	91.3 Å²	91.3	36%	0.356	48%	0.477	S	S	.	.	H	α-helix	trans	-71.9	-40.1	179.6	-171.8	68.4	0	0	0	110.8	C114 P115 I120 F121 M644	C114-L117 HydrophobicContact CB-CB 4.37Å; C114-L117 WeakPolarHBondContact O-CB 3.44Å; C114-L117 PolarHBondContact O-N 2.87Å; P115-L117 PolarHBondContact O-N 3.18Å; L117-I120 HydrophobicContact CD1-CD1 4.5Å; L117-I120 PolarHBondContact O-N 3.34Å; L117-F121 WeakPolarHBondContact O-CD2 3.29Å; L117-M644 HydrophobicContact CD1-CE 3.97Å
118	T	74.8	Confident	68.6	Low	83 Å²	83	83.8 Å²	83.8	51%	0.509	45%	0.445	S	S	.	.	H	α-helix	trans	-71.7	-32.8	175.9	56.5	0	0	0	0	111.6	P115 I120 F121 R122	P115-T118 PolarHBondContact O-N 2.91Å; P115-T118 PolarHBondContact O-OG1 2.99Å; T118-I120 VanDerWaalsContact C-N 3.29Å; T118-I120 PolarHBondContact O-N 3.5Å; T118-F121 PolarHBondContact O-N 2.93Å; T118-R122 PolarHBondContact O-N 3.15Å
119	A	71.6	Confident	70.4	Confident	22 Å²	22	82.2 Å²	82.2	18%	0.182	44%	0.439	C	S	.	.	H	α-helix	trans	-59.7	-37.2	173.6	0	0	0	0	0	112.6	P115 F121 R122 L123	P115-A119 PolarHBondContact O-N 3.15Å; P115-A119 VanDerWaalsContact O-N 3.07Å; A119-F121 VanDerWaalsContact C-N 3.29Å; A119-F121 PolarHBondContact O-N 3.35Å; A119-R122 PolarHBondContact O-N 3.26Å; A119-R122 VanDerWaalsContact O-N 3.13Å; A119-L123 WeakPolarHBondContact O-CD1 3.28Å; A119-L123 PolarHBondContact O-N 2.67Å; A119-L123 VanDerWaalsContact O-N 3.11Å
120	I	78.6	Confident	72.5	Confident	4 Å²	4	82.4 Å²	82.4	2%	0.021	44%	0.435	C	S	.	.	H	α-helix	trans	-59.4	-39.3	177.8	-68.1	163.5	0	0	0	112	W116 L117 T118 R647 H648	W116-I120 HydrophobicContact CE3-CD1 3.48Å; W116-I120 VanDerWaalsContact CE3-CD1 3.48Å; W116-I120 HydrophobicContact CE3-CG1 4.47Å; W116-I120 HydrophobicContact CZ3-CD1 3.39Å; W116-I120 WeakPolarHBondContact O-CG1 3.49Å; W116-I120 PolarHBondContact O-N 2.93Å; L117-I120 HydrophobicContact CD1-CD1 4.5Å; L117-I120 PolarHBondContact O-N 3.34Å; T118-I120 VanDerWaalsContact C-N 3.29Å; T118-I120 PolarHBondContact O-N 3.5Å; I120-R647 PolarHBondContact O-NH1 3.27Å; I120-H648 HydrophobicContact CD1-CB 3.66Å; I120-H648 HydrophobicContact CG1-CB 3.97Å
121	F	77.6	Confident	74.4	Confident	134 Å²	134	78.4 Å²	78.4	59%	0.588	41%	0.413	S	S	*	.	H	α-helix	trans	-76.2	-23.9	179.2	-69.7	-71.9	0	0	0	113.2	L117 T118 A119 M644	L117-F121 WeakPolarHBondContact O-CD2 3.29Å; T118-F121 PolarHBondContact O-N 2.93Å; A119-F121 VanDerWaalsContact C-N 3.29Å; A119-F121 PolarHBondContact O-N 3.35Å; F121-M644 HydrophobicContact CD2-CE 4.44Å; F121-M644 HydrophobicContact CE1-CE 3.94Å; F121-M644 HydrophobicContact CE1-SD 4.31Å; F121-M644 HydrophobicContact CE2-CE 3.43Å; F121-M644 VanDerWaalsContact CE2-CE 3.43Å; F121-M644 HydrophobicContact CZ-CE 3.13Å; F121-M644 HydrophobicContact CZ-SD 3.81Å
122	R	78.6	Confident	76.5	Confident	171 Å²	171	70.8 Å²	70.8	65%	0.645	37%	0.373	S	S	*	.	H	α-helix	trans	-87.5	-13.6	178.7	-71.3	-174.5	179.2	175	0.4	114.2	T118 A119 H124	T118-R122 PolarHBondContact O-N 3.15Å; A119-R122 PolarHBondContact O-N 3.26Å; A119-R122 VanDerWaalsContact O-N 3.13Å; R122-H124 PolarHBondContact O-CD2 3.24Å
123	L	79.5	Confident	77.9	Confident	12 Å²	12	68.8 Å²	68.8	6%	0.063	35%	0.353	C	S	.	.			trans	-60.1	137.1	174.9	-92.4	138.7	0	0	0	110.2	A119 I128 R647 Y651 F652	A119-L123 WeakPolarHBondContact O-CD1 3.28Å; A119-L123 PolarHBondContact O-N 2.67Å; A119-L123 VanDerWaalsContact O-N 3.11Å; L123-I128 HydrophobicContact CD2-CG1 4.19Å; L123-R647 PolarHBondContact O-NH2 2.96Å; L123-Y651 HydrophobicContact CD1-CD1 4.3Å; L123-Y651 HydrophobicContact CD1-CG 4.4Å; L123-Y651 HydrophobicContact CD2-CD1 3.83Å; L123-Y651 HydrophobicContact CD2-CD2 3.37Å; L123-Y651 HydrophobicContact CD2-CE1 3.89Å; L123-Y651 HydrophobicContact CD2-CE2 3.43Å; L123-Y651 VanDerWaalsContact CD2-CE2 3.43Å; L123-Y651 HydrophobicContact CD2-CG 3.57Å; L123-F652 HydrophobicContact CD1-CE2 3.98Å; L123-F652 HydrophobicContact CD1-CZ 4.31Å
124	H	85.2	Confident	79.3	Confident	120 Å²	120	68.4 Å²	68.4	56%	0.556	34%	0.343	S	S	*	.			trans	-103.1	148.8	174.4	-72.7	-78.8	0	0	0	110.7	R122 D126 Q127 I128	R122-H124 PolarHBondContact O-CD2 3.24Å; H124-D126 PolarHBondContact O-N 3.27Å; H124-Q127 HydrophobicContact CB-CG 4.49Å; H124-Q127 PolarHBondContact O-N 2.7Å; H124-I128 PolarHBondContact O-N 3.46Å
125	D	85.8	Confident	80.4	Confident	49 Å²	49	66.2 Å²	66.2	26%	0.262	33%	0.328	S	S	.	.	H	α-helix	trans	-61.7	-31.2	179.9	-79.4	14.9	0	0	0	111.4	Q127 I128 L129 I137 R144 R647	D125-Q127 VanDerWaalsContact C-N 3.35Å; D125-Q127 PolarHBondContact O-N 3.24Å; D125-I128 PolarHBondContact O-N 3.06Å; D125-L129 PolarHBondContact O-N 2.95Å; D125-I137 HydrophobicContact CB-CD1 4.19Å; D125-I137 WeakPolarHBondContact O-CD1 3.5Å; D125-R144 IonicContact OD1-NH1 2.72Å; D125-R144 PolarHBondContact OD1-NH1 3.47Å; D125-R144 IonicContact OD2-CZ 2.82Å; D125-R144 VanDerWaalsContact OD2-CZ 3.26Å; D125-R144 IonicContact OD2-NH1 3.04Å; D125-R144 PolarHBondContact OD2-NH1 2.59Å; D125-R144 IonicContact OD2-NH2 3.96Å; D125-R144 PolarHBondContact OD2-NH2 3.02Å; D125-R647 IonicContact OD1-NH2 3.51Å; D125-R647 PolarHBondContact OD1-NH2 3.39Å
126	D	85.7	Confident	81.5	Confident	127 Å²	127	63.8 Å²	63.8	68%	0.679	31%	0.312	S	S	*	.	H	α-helix	trans	-62.8	-39.8	176.6	-54	-42.6	0	0	0	112.5	H124 L129 E130	H124-D126 PolarHBondContact O-N 3.27Å; D126-L129 PolarHBondContact O-N 2.98Å; D126-E130 PolarHBondContact O-N 2.75Å; D126-E130 VanDerWaalsContact O-N 3.09Å
127	Q	84.4	Confident	82.2	Confident	82 Å²	82	64.1 Å²	64.1	38%	0.383	32%	0.315	S	S	.	.	H	α-helix	trans	-67.9	-38.7	175.8	-65.5	178.1	-34.1	0	0	111	H124 D125 L129 W131	H124-Q127 HydrophobicContact CB-CG 4.49Å; H124-Q127 PolarHBondContact O-N 2.7Å; D125-Q127 VanDerWaalsContact C-N 3.35Å; D125-Q127 PolarHBondContact O-N 3.24Å; Q127-L129 VanDerWaalsContact C-N 3.32Å; Q127-W131 VanDerWaalsContact O-CB 3.29Å; Q127-W131 WeakPolarHBondContact O-CB 3.37Å; Q127-W131 PolarHBondContact O-N 2.53Å
128	I	85	Confident	83	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-67.3	-37.7	177.2	-63	171.2	0	0	0	110	L123 H124 D125 C132 A136 I137 L140 R647 Y651	L123-I128 HydrophobicContact CD2-CG1 4.19Å; H124-I128 PolarHBondContact O-N 3.46Å; D125-I128 PolarHBondContact O-N 3.06Å; I128-C132 HydrophobicContact CG2-CB 4.1Å; I128-C132 WeakPolarHBondContact O-CA 3.41Å; I128-C132 WeakPolarHBondContact O-CB 3.35Å; I128-C132 PolarHBondContact O-N 3.45Å; I128-A136 HydrophobicContact CG2-CB 4.3Å; I128-I137 HydrophobicContact CB-CD1 3.78Å; I128-I137 HydrophobicContact CG2-CD1 3.63Å; I128-I137 HydrophobicContact CG2-CG1 4.44Å; I128-L140 HydrophobicContact CD1-CD1 4.03Å; I128-L140 HydrophobicContact CG2-CD1 4.2Å; I128-R647 HydrophobicContact CD1-CG 4.03Å; I128-Y651 HydrophobicContact CG1-CD2 4.2Å
129	L	85.8	Confident	83.9	Confident	79 Å²	79	57.8 Å²	57.8	41%	0.414	28%	0.277	S	S	.	.	H	α-helix	trans	-61.9	-51	176.8	178.8	61.9	0	0	0	111.7	D125 D126 Q127 W131 G133 E134 I137	D125-L129 PolarHBondContact O-N 2.95Å; D126-L129 PolarHBondContact O-N 2.98Å; Q127-L129 VanDerWaalsContact C-N 3.32Å; L129-W131 VanDerWaalsContact C-N 3.34Å; L129-W131 PolarHBondContact O-N 3.38Å; L129-G133 WeakPolarHBondContact O-CA 3.45Å; L129-G133 PolarHBondContact O-N 3.42Å; L129-E134 HydrophobicContact CD1-CB 4.4Å; L129-E134 HydrophobicContact CD1-CG 3.78Å; L129-I137 HydrophobicContact CB-CD1 4.42Å; L129-I137 HydrophobicContact CB-CG1 4.02Å; L129-I137 HydrophobicContact CD1-CG1 4.17Å
130	E	82.6	Confident	84.9	Confident	156 Å²	156	56.7 Å²	56.7	73%	0.729	27%	0.269	S	S	*	.	H	α-helix	trans	-64.1	-39.3	-178.8	178.6	-176.1	-153.6	0	0	111.9	D126	D126-E130 PolarHBondContact O-N 2.75Å; D126-E130 VanDerWaalsContact O-N 3.09Å
131	W	79.3	Confident	85.5	Confident	89 Å²	89	57.2 Å²	57.2	34%	0.337	27%	0.273	S	S	.	.	H	α-helix	trans	-93	-29.2	-172	-71.5	67	0	0	0	113.6	R80 Q127 L129 Y651	R80-W131 VanDerWaalsContact CZ-O 3.3Å; R80-W131 PolarHBondContact NH1-O 3.25Å; R80-W131 VanDerWaalsContact NH1-O 3.13Å; R80-W131 PolarHBondContact NH2-O 3.38Å; Q127-W131 VanDerWaalsContact O-CB 3.29Å; Q127-W131 WeakPolarHBondContact O-CB 3.37Å; Q127-W131 PolarHBondContact O-N 2.53Å; L129-W131 VanDerWaalsContact C-N 3.34Å; L129-W131 PolarHBondContact O-N 3.38Å; W131-Y651 HydrophobicContact CB-CE2 4.32Å; W131-Y651 HydrophobicContact CG-CE2 4.43Å
132	C	82.4	Confident	86.3	Confident	7 Å²	7	50.9 Å²	50.9	5%	0.047	25%	0.245	C	C	.	.	H	α-helix	trans	-116.8	-13.1	-172.6	-54.2	0	0	0	0	113.8	R80 I128 A136 L650 P656	R80-C132 PolarHBondContact NH1-SG 2.91Å; R80-C132 VanDerWaalsContact NH1-SG 3.37Å; I128-C132 HydrophobicContact CG2-CB 4.1Å; I128-C132 WeakPolarHBondContact O-CA 3.41Å; I128-C132 WeakPolarHBondContact O-CB 3.35Å; I128-C132 PolarHBondContact O-N 3.45Å; C132-A136 HydrophobicContact CB-CB 3.76Å; C132-L650 PolarHBondContact SG-O 3.34Å; C132-P656 WeakPolarHBondContact O-CB 3.41Å
133	G	84.8	Confident	87.1	Confident	26 Å²	26	42.8 Å²	42.8	27%	0.268	21%	0.214	S	C	.	.			trans	88.9	172.4	179.6	0	0	0	0	0	114.5	L129 D135 A136	L129-G133 WeakPolarHBondContact O-CA 3.45Å; L129-G133 PolarHBondContact O-N 3.42Å; G133-D135 PolarHBondContact O-N 3.38Å; G133-A136 PolarHBondContact O-N 3.08Å
134	E	85.4	Confident	87.8	Confident	76 Å²	76	45.3 Å²	45.3	36%	0.355	22%	0.223	S	C	.	.	H	α-helix	trans	-62.9	-40.2	-175	-68.2	-177.3	179.5	0	0	113.1	L129 A136 I137 H138	L129-E134 HydrophobicContact CD1-CB 4.4Å; L129-E134 HydrophobicContact CD1-CG 3.78Å; E134-A136 VanDerWaalsContact C-N 3.26Å; E134-A136 PolarHBondContact O-N 2.82Å; E134-I137 WeakPolarHBondContact O-CB 3.44Å; E134-I137 PolarHBondContact O-N 3.07Å; E134-H138 PolarHBondContact O-N 3Å; E134-H138 PolarHBondContact O-ND1 2.88Å
135	D	87.6	Confident	88.3	Confident	9 Å²	9	40.6 Å²	40.6	5%	0.048	20%	0.201	C	C	.	.	H	α-helix	trans	-63.7	-31.4	-175.9	-64.2	-39.9	0	0	0	112.8	G133 H138 Y139 Y220 F607 L659 H664	G133-D135 PolarHBondContact O-N 3.38Å; D135-H138 PolarHBondContact O-N 3.19Å; D135-Y139 WeakPolarHBondContact O-CB 3.24Å; D135-Y139 PolarHBondContact O-N 3.49Å; D135-Y220 PolarHBondContact OD1-OH 3.32Å; D135-F607 HydrophobicContact CB-CE2 4.43Å; D135-F607 HydrophobicContact CB-CZ 4.07Å; D135-L659 PolarHBondContact OD2-N 2.87Å; D135-H664 PolarHBondContact O-CE1 2.84Å; D135-H664 IonicContact OD1-NE2 2.63Å; D135-H664 PolarHBondContact OD1-NE2 3.29Å
136	A	89.4	Confident	88.7	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.008	19%	0.189	C	C	.	.	H	α-helix	trans	-64.7	-41.1	174	0	0	0	0	0	111.7	I128 C132 G133 E134 Y139 L140 L650	I128-A136 HydrophobicContact CG2-CB 4.3Å; C132-A136 HydrophobicContact CB-CB 3.76Å; G133-A136 PolarHBondContact O-N 3.08Å; E134-A136 VanDerWaalsContact C-N 3.26Å; E134-A136 PolarHBondContact O-N 2.82Å; A136-Y139 PolarHBondContact O-N 3.15Å; A136-L140 WeakPolarHBondContact O-CG 3.46Å; A136-L140 PolarHBondContact O-N 2.88Å; A136-L650 HydrophobicContact CB-CD1 4.39Å; A136-L650 HydrophobicContact CB-CD2 4.24Å
137	I	89.8	Confident	89.3	Confident	31 Å²	31	33.1 Å²	33.1	16%	0.159	16%	0.161	C	C	.	.	H	α-helix	trans	-68.5	-41.9	177	-62.7	-62.7	0	0	0	110.9	D125 I128 L129 E134 Y139 L140 S141	D125-I137 HydrophobicContact CB-CD1 4.19Å; D125-I137 WeakPolarHBondContact O-CD1 3.5Å; I128-I137 HydrophobicContact CB-CD1 3.78Å; I128-I137 HydrophobicContact CG2-CD1 3.63Å; I128-I137 HydrophobicContact CG2-CG1 4.44Å; L129-I137 HydrophobicContact CB-CD1 4.42Å; L129-I137 HydrophobicContact CB-CG1 4.02Å; L129-I137 HydrophobicContact CD1-CG1 4.17Å; E134-I137 WeakPolarHBondContact O-CB 3.44Å; E134-I137 PolarHBondContact O-N 3.07Å; I137-Y139 VanDerWaalsContact C-N 3.32Å; I137-Y139 PolarHBondContact O-N 3.05Å; I137-L140 PolarHBondContact O-N 2.8Å; I137-S141 WeakPolarHBondContact O-CB 3.39Å; I137-S141 PolarHBondContact O-N 2.92Å
138	H	89.7	Confident	89.8	Confident	17 Å²	17	35.4 Å²	35.4	8%	0.079	17%	0.17	C	C	.	.	H	α-helix	trans	-61	-42.2	176.1	-66.3	147.6	0	0	0	111.7	E134 D135 S141 F142 Y220 H664	E134-H138 PolarHBondContact O-N 3Å; E134-H138 PolarHBondContact O-ND1 2.88Å; D135-H138 PolarHBondContact O-N 3.19Å; H138-S141 PolarHBondContact O-N 3.07Å; H138-F142 WeakPolarHBondContact O-CB 3.2Å; H138-F142 PolarHBondContact O-N 3.36Å; H138-Y220 AromaticContact CE1-CE1 3.71Å; H138-Y220 AromaticContact CE1-CE2 3.82Å; H138-Y220 AromaticContact CE1-CZ 3.55Å; H138-Y220 AromaticContact ND1-CE1 3.78Å; H138-Y220 AromaticContact ND1-CE2 3.89Å; H138-Y220 AromaticContact ND1-CZ 3.36Å; H138-Y220 PolarHBondContact ND1-OH 3.02Å; H138-H664 VanDerWaalsContact CB-CE1 3.46Å; H138-H664 WeakPolarHBondContact CB-CE1 3.35Å
139	Y	92.4	Very high	90.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.3	-49.5	174.2	178.6	-94.4	0	0	0	112.8	D135 A136 I137 S141 F142 Q143 Y605 F607 M610 Y611 D646 L650	D135-Y139 WeakPolarHBondContact O-CB 3.24Å; D135-Y139 PolarHBondContact O-N 3.49Å; A136-Y139 PolarHBondContact O-N 3.15Å; I137-Y139 VanDerWaalsContact C-N 3.32Å; I137-Y139 PolarHBondContact O-N 3.05Å; Y139-S141 VanDerWaalsContact C-N 3.34Å; Y139-S141 PolarHBondContact O-N 3.01Å; Y139-F142 WeakPolarHBondContact O-CB 3.27Å; Y139-F142 PolarHBondContact O-N 2.87Å; Y139-Q143 HydrophobicContact CE1-CG 4.38Å; Y139-Q143 VanDerWaalsContact CZ-NE2 3.26Å; Y139-Q143 PolarHBondContact O-N 2.98Å; Y139-Q143 VanDerWaalsContact O-N 3.13Å; Y139-Q143 PolarHBondContact OH-NE2 3.39Å; Y139-Y605 HydrophobicContact CD1-CE1 4.49Å; Y139-Y605 HydrophobicContact CE1-CE1 4.26Å; Y139-Y605 PolarHBondContact OH-OH 3.43Å; Y139-F607 AromaticContact CD2-CD1 3.92Å; Y139-F607 HydrophobicContact CD2-CD1 3.92Å; Y139-F607 HydrophobicContact CD2-CE1 4.36Å; Y139-F607 HydrophobicContact CG-CD1 4.07Å; Y139-F607 HydrophobicContact CG-CE1 4.04Å; Y139-M610 HydrophobicContact CE2-CB 4.35Å; Y139-Y611 WeakPolarHBondContact CA-OH 3.47Å; Y139-Y611 HydrophobicContact CD2-CD1 4.03Å; Y139-Y611 HydrophobicContact CD2-CD2 4.1Å; Y139-Y611 AromaticContact CD2-CE1 3.55Å; Y139-Y611 HydrophobicContact CD2-CE1 3.55Å; Y139-Y611 AromaticContact CD2-CE2 3.63Å; Y139-Y611 HydrophobicContact CD2-CE2 3.63Å; Y139-Y611 HydrophobicContact CD2-CG 4.28Å; Y139-Y611 AromaticContact CD2-CZ 3.33Å; Y139-Y611 AromaticContact CE2-CD1 3.89Å; Y139-Y611 HydrophobicContact CE2-CD1 3.89Å; Y139-Y611 HydrophobicContact CE2-CD2 4.25Å; Y139-Y611 AromaticContact CE2-CE1 3.87Å; Y139-Y611 HydrophobicContact CE2-CE1 3.87Å; Y139-Y611 HydrophobicContact CE2-CE2 4.23Å; Y139-Y611 HydrophobicContact CE2-CG 4.07Å; Y139-D646 HydrophobicContact CE1-CB 3.92Å; Y139-D646 WeakPolarHBondContact CE1-OD2 3.38Å; Y139-D646 PolarHBondContact OH-OD2 3.23Å; Y139-L650 HydrophobicContact CD1-CD1 3.97Å; Y139-L650 HydrophobicContact CE1-CD1 4.45Å
140	L	92.8	Very high	90.9	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-66.3	-36.3	178.5	-68.8	174.9	0	0	0	112.2	I128 A136 I137 Q143 R144 R647 L650	I128-L140 HydrophobicContact CD1-CD1 4.03Å; I128-L140 HydrophobicContact CG2-CD1 4.2Å; A136-L140 WeakPolarHBondContact O-CG 3.46Å; A136-L140 PolarHBondContact O-N 2.88Å; I137-L140 PolarHBondContact O-N 2.8Å; L140-Q143 PolarHBondContact O-N 2.9Å; L140-R144 WeakPolarHBondContact O-CG 3.4Å; L140-R144 PolarHBondContact O-N 2.98Å; L140-R144 VanDerWaalsContact O-N 3.09Å; L140-R647 HydrophobicContact CD1-CG 4.36Å; L140-R647 HydrophobicContact CD2-CB 4.14Å; L140-L650 HydrophobicContact CD1-CD1 4.3Å; L140-L650 HydrophobicContact CD2-CD1 4.07Å; L140-L650 HydrophobicContact CG-CD1 4.04Å
141	S	92.1	Very high	91.6	Very high	15 Å²	15	27.6 Å²	27.6	11%	0.105	14%	0.136	C	C	.	.	H	α-helix	trans	-62.2	-43	173.6	-177.4	0	0	0	0	111.4	I137 H138 Y139 Q143 R144 H145	I137-S141 WeakPolarHBondContact O-CB 3.39Å; I137-S141 PolarHBondContact O-N 2.92Å; H138-S141 PolarHBondContact O-N 3.07Å; Y139-S141 VanDerWaalsContact C-N 3.34Å; Y139-S141 PolarHBondContact O-N 3.01Å; S141-Q143 VanDerWaalsContact C-N 3.35Å; S141-Q143 PolarHBondContact O-N 3.4Å; S141-R144 PolarHBondContact O-N 3.2Å; S141-H145 PolarHBondContact O-N 3.44Å; S141-H145 VanDerWaalsContact O-N 3.14Å; S141-H145 PolarHBondContact O-ND1 3.45Å
142	F	94	Very high	92.4	Very high	1 Å²	1	25.8 Å²	25.8	0%	0.004	14%	0.135	C	C	.	.	H	α-helix	trans	-59	-45.9	176	179.5	-107	0	0	0	111.8	H138 Y139 R144 H145 I146 M211 H214 Y611 M614 L615 A667 V668 A671	H138-F142 WeakPolarHBondContact O-CB 3.2Å; H138-F142 PolarHBondContact O-N 3.36Å; Y139-F142 WeakPolarHBondContact O-CB 3.27Å; Y139-F142 PolarHBondContact O-N 2.87Å; F142-R144 VanDerWaalsContact C-N 3.34Å; F142-R144 PolarHBondContact O-N 3.21Å; F142-H145 PolarHBondContact O-N 2.88Å; F142-I146 HydrophobicContact CD1-CD1 3.85Å; F142-I146 HydrophobicContact CE1-CD1 3.31Å; F142-I146 HydrophobicContact CE1-CG1 4.34Å; F142-I146 HydrophobicContact CE2-CD1 4.31Å; F142-I146 HydrophobicContact CZ-CD1 3.59Å; F142-I146 HydrophobicContact CZ-CG1 4.39Å; F142-I146 PolarHBondContact O-N 3.28Å; F142-M211 HydrophobicContact CD2-SD 4.47Å; F142-M211 HydrophobicContact CE2-CE 4.32Å; F142-M211 HydrophobicContact CE2-SD 3.69Å; F142-M211 HydrophobicContact CZ-SD 4.48Å; F142-H214 WeakPolarHBondContact CA-CE1 3.41Å; F142-H214 AromaticContact CD2-CD2 3.62Å; F142-H214 AromaticContact CD2-NE2 3.56Å; F142-H214 PolarHBondContact N-CE1 3.37Å; F142-H214 VanDerWaalsContact N-CE1 3.3Å; F142-Y611 HydrophobicContact CD1-CD1 4.11Å; F142-Y611 AromaticContact CD1-CE1 3.55Å; F142-Y611 HydrophobicContact CD1-CE1 3.55Å; F142-Y611 AromaticContact CE1-CD1 3.99Å; F142-Y611 HydrophobicContact CE1-CD1 3.99Å; F142-Y611 AromaticContact CE1-CE1 3.84Å; F142-Y611 HydrophobicContact CE1-CE1 3.84Å; F142-Y611 HydrophobicContact CG-CE1 4.16Å; F142-M614 HydrophobicContact CD1-CE 3.66Å; F142-M614 HydrophobicContact CE1-CE 3.44Å; F142-M614 VanDerWaalsContact CE1-CE 3.44Å; F142-L615 HydrophobicContact CE1-CD2 4Å; F142-L615 HydrophobicContact CZ-CD2 3.91Å; F142-A667 HydrophobicContact CE1-CB 4.41Å; F142-A667 HydrophobicContact CZ-CB 4.2Å; F142-V668 HydrophobicContact CD2-CG2 4.31Å; F142-V668 HydrophobicContact CE2-CG2 3.96Å; F142-A671 HydrophobicContact CE2-CB 4.45Å; F142-A671 HydrophobicContact CZ-CB 4.04Å
143	Q	95.5	Very high	93	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-58.2	-43.5	175.5	-70.2	-175.9	-24.8	0	0	112.7	Y139 L140 S141 H145 I146 I147 M614 H643 D646	Y139-Q143 HydrophobicContact CE1-CG 4.38Å; Y139-Q143 VanDerWaalsContact CZ-NE2 3.26Å; Y139-Q143 PolarHBondContact O-N 2.98Å; Y139-Q143 VanDerWaalsContact O-N 3.13Å; Y139-Q143 PolarHBondContact OH-NE2 3.39Å; L140-Q143 PolarHBondContact O-N 2.9Å; S141-Q143 VanDerWaalsContact C-N 3.35Å; S141-Q143 PolarHBondContact O-N 3.4Å; Q143-H145 VanDerWaalsContact C-N 3.32Å; Q143-H145 PolarHBondContact O-N 3.17Å; Q143-I146 PolarHBondContact O-N 3.17Å; Q143-I147 VanDerWaalsContact O-CG1 3.3Å; Q143-I147 WeakPolarHBondContact O-CG1 3.35Å; Q143-I147 PolarHBondContact O-N 3.49Å; Q143-M614 HydrophobicContact CG-CE 4.49Å; Q143-M614 HydrophobicContact CG-SD 3.6Å; Q143-M614 VanDerWaalsContact CG-SD 3.6Å; Q143-H643 PolarHBondContact OE1-ND1 3.4Å; Q143-D646 PolarHBondContact NE2-OD2 2.93Å
144	R	94.7	Very high	93.6	Very high	66 Å²	66	24.5 Å²	24.5	25%	0.249	12%	0.122	C	C	.	.	H	α-helix	trans	-59.2	-42.2	176.6	-71.1	-177.1	-69.6	-126.4	12.1	112.1	D125 L140 S141 F142 I147 F148	D125-R144 IonicContact OD1-NH1 2.72Å; D125-R144 PolarHBondContact OD1-NH1 3.47Å; D125-R144 IonicContact OD2-CZ 2.82Å; D125-R144 VanDerWaalsContact OD2-CZ 3.26Å; D125-R144 IonicContact OD2-NH1 3.04Å; D125-R144 PolarHBondContact OD2-NH1 2.59Å; D125-R144 IonicContact OD2-NH2 3.96Å; D125-R144 PolarHBondContact OD2-NH2 3.02Å; L140-R144 WeakPolarHBondContact O-CG 3.4Å; L140-R144 PolarHBondContact O-N 2.98Å; L140-R144 VanDerWaalsContact O-N 3.09Å; S141-R144 PolarHBondContact O-N 3.2Å; F142-R144 VanDerWaalsContact C-N 3.34Å; F142-R144 PolarHBondContact O-N 3.21Å; R144-I147 WeakPolarHBondContact O-CB 3.04Å; R144-I147 PolarHBondContact O-N 2.95Å; R144-F148 WeakPolarHBondContact O-CD2 3.35Å; R144-F148 PolarHBondContact O-N 2.96Å
145	H	94.4	Very high	94.1	Very high	21 Å²	21	27.2 Å²	27.2	10%	0.097	13%	0.133	C	C	.	.	H	α-helix	trans	-65.6	-38.8	177	-71.6	81.8	0	0	0	112.3	S141 F142 Q143 F148 L149 H213 H214	S141-H145 PolarHBondContact O-N 3.44Å; S141-H145 VanDerWaalsContact O-N 3.14Å; S141-H145 PolarHBondContact O-ND1 3.45Å; F142-H145 PolarHBondContact O-N 2.88Å; Q143-H145 VanDerWaalsContact C-N 3.32Å; Q143-H145 PolarHBondContact O-N 3.17Å; H145-F148 PolarHBondContact O-N 3.32Å; H145-L149 WeakPolarHBondContact O-CB 3.25Å; H145-L149 PolarHBondContact O-N 3.46Å; H145-H213 AromaticContact CD2-ND1 3.57Å; H145-H213 AromaticContact NE2-CE1 3.68Å; H145-H213 AromaticContact NE2-ND1 2.98Å; H145-H213 PolarHBondContact NE2-ND1 2.83Å; H145-H214 HydrophobicContact CB-CB 4.19Å; H145-H214 AromaticContact CE1-ND1 3.68Å; H145-H214 AromaticContact CG-ND1 3.98Å; H145-H214 AromaticContact ND1-CG 3.99Å; H145-H214 AromaticContact ND1-ND1 3.39Å; H145-H214 PolarHBondContact ND1-ND1 3.44Å
146	I	95.6	Very high	94.4	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-65	-40.4	172.7	-68.1	-179.2	0	0	0	111.3	F142 Q143 L149 L150 M211 M614 L615 F618 I639	F142-I146 HydrophobicContact CD1-CD1 3.85Å; F142-I146 HydrophobicContact CE1-CD1 3.31Å; F142-I146 HydrophobicContact CE1-CG1 4.34Å; F142-I146 HydrophobicContact CE2-CD1 4.31Å; F142-I146 HydrophobicContact CZ-CD1 3.59Å; F142-I146 HydrophobicContact CZ-CG1 4.39Å; F142-I146 PolarHBondContact O-N 3.28Å; Q143-I146 PolarHBondContact O-N 3.17Å; I146-L149 PolarHBondContact O-N 3.01Å; I146-L150 HydrophobicContact CG2-CD1 3.97Å; I146-L150 HydrophobicContact CG2-CG 4.3Å; I146-L150 WeakPolarHBondContact O-CB 3.31Å; I146-L150 PolarHBondContact O-N 3.47Å; I146-M211 HydrophobicContact CG1-CE 4.22Å; I146-M614 HydrophobicContact CD1-CE 4.27Å; I146-L615 HydrophobicContact CD1-CD2 4.28Å; I146-F618 HydrophobicContact CG2-CD2 3.69Å; I146-F618 HydrophobicContact CG2-CE2 3.94Å; I146-F618 HydrophobicContact CG2-CG 4.37Å; I146-I639 HydrophobicContact CG2-CD1 4.17Å; I146-I639 HydrophobicContact CG2-CG1 4.01Å
147	I	96.8	Very high	94.6	Very high	19 Å²	19	28.3 Å²	28.3	10%	0.097	14%	0.138	C	C	.	.	H	α-helix	trans	-58	-51.3	175.4	-71	160.3	0	0	0	110	Q143 R144 L149 L150 V151 L636 I639 L640 H643	Q143-I147 VanDerWaalsContact O-CG1 3.3Å; Q143-I147 WeakPolarHBondContact O-CG1 3.35Å; Q143-I147 PolarHBondContact O-N 3.49Å; R144-I147 WeakPolarHBondContact O-CB 3.04Å; R144-I147 PolarHBondContact O-N 2.95Å; I147-L149 VanDerWaalsContact C-N 3.32Å; I147-L149 PolarHBondContact O-N 3.39Å; I147-L150 PolarHBondContact O-N 3.14Å; I147-L150 VanDerWaalsContact O-N 3.17Å; I147-V151 HydrophobicContact CG2-CG2 4.46Å; I147-V151 WeakPolarHBondContact O-CG2 3.3Å; I147-V151 PolarHBondContact O-N 3.37Å; I147-L636 HydrophobicContact CG2-CD1 4.26Å; I147-I639 HydrophobicContact CB-CG2 4.48Å; I147-I639 HydrophobicContact CG1-CB 4.3Å; I147-I639 HydrophobicContact CG1-CG1 3.85Å; I147-I639 HydrophobicContact CG1-CG2 3.65Å; I147-L640 HydrophobicContact CD1-CD2 4.18Å; I147-L640 HydrophobicContact CG1-CD2 4.34Å; I147-L640 HydrophobicContact CG2-CD2 3.79Å; I147-H643 HydrophobicContact CD1-CB 3.8Å
148	F	96.6	Very high	94.8	Very high	130 Å²	130	30 Å²	30	57%	0.57	15%	0.147	S	C	*	.	H	α-helix	trans	-59.8	-42.6	178.5	-75	-64.9	0	0	0	112.3	R144 H145 V151 V152 F210	R144-F148 WeakPolarHBondContact O-CD2 3.35Å; R144-F148 PolarHBondContact O-N 2.96Å; H145-F148 PolarHBondContact O-N 3.32Å; F148-V151 PolarHBondContact O-N 2.81Å; F148-V152 PolarHBondContact O-N 3.24Å; F148-F210 HydrophobicContact CB-CD1 4.36Å; F148-F210 HydrophobicContact CB-CE1 3.65Å; F148-F210 HydrophobicContact CB-CZ 4.28Å
149	L	96.1	Very high	95	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-59.3	-46.9	174.3	175.2	64.6	0	0	0	111.6	H145 I146 I147 V151 V152 V153 L206 T207 F210 F618	H145-L149 WeakPolarHBondContact O-CB 3.25Å; H145-L149 PolarHBondContact O-N 3.46Å; I146-L149 PolarHBondContact O-N 3.01Å; I147-L149 VanDerWaalsContact C-N 3.32Å; I147-L149 PolarHBondContact O-N 3.39Å; L149-V151 VanDerWaalsContact C-N 3.34Å; L149-V151 PolarHBondContact O-N 3.1Å; L149-V152 PolarHBondContact O-N 2.95Å; L149-V153 HydrophobicContact CD1-CG2 4.31Å; L149-V153 WeakPolarHBondContact O-CG2 3.47Å; L149-V153 PolarHBondContact O-N 2.85Å; L149-L206 HydrophobicContact CD1-CB 3.9Å; L149-T207 HydrophobicContact CD2-CG2 4Å; L149-F210 HydrophobicContact CB-CD2 4.22Å; L149-F210 HydrophobicContact CB-CG 4.2Å; L149-F210 HydrophobicContact CD1-CD2 3.81Å; L149-F210 HydrophobicContact CD1-CE2 4.34Å; L149-F210 HydrophobicContact CD1-CG 4.46Å; L149-F618 HydrophobicContact CD2-CE2 4.02Å; L149-F618 HydrophobicContact CD2-CZ 3.72Å
150	L	96.4	Very high	95.1	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-68.7	-28.8	179.8	-79.6	178	0	0	0	113.4	I146 I147 S154 F618 I621 M622 L636 I639	I146-L150 HydrophobicContact CG2-CD1 3.97Å; I146-L150 HydrophobicContact CG2-CG 4.3Å; I146-L150 WeakPolarHBondContact O-CB 3.31Å; I146-L150 PolarHBondContact O-N 3.47Å; I147-L150 PolarHBondContact O-N 3.14Å; I147-L150 VanDerWaalsContact O-N 3.17Å; L150-S154 WeakPolarHBondContact O-CB 3.39Å; L150-S154 PolarHBondContact O-N 3.15Å; L150-S154 PolarHBondContact O-OG 2.93Å; L150-F618 HydrophobicContact CD1-CD2 4.16Å; L150-F618 HydrophobicContact CD2-CD2 4.23Å; L150-F618 HydrophobicContact CD2-CE2 4.14Å; L150-F618 HydrophobicContact CG-CD2 4.23Å; L150-F618 HydrophobicContact CG-CE2 4.18Å; L150-I621 HydrophobicContact CD1-CD1 4.41Å; L150-I621 HydrophobicContact CD2-CG2 3.65Å; L150-M622 HydrophobicContact CD2-SD 4.49Å; L150-L636 HydrophobicContact CB-CD1 4.22Å; L150-I639 HydrophobicContact CD1-CB 4.1Å; L150-I639 HydrophobicContact CD1-CG2 3.64Å
151	V	97.5	Very high	95.1	Very high	70 Å²	70	34.9 Å²	34.9	42%	0.424	18%	0.18	S	C	.	.	H	α-helix	trans	-61.7	-48.4	170.6	169.2	0	0	0	0	110.1	I147 F148 L149 S154 F155 L636	I147-V151 HydrophobicContact CG2-CG2 4.46Å; I147-V151 WeakPolarHBondContact O-CG2 3.3Å; I147-V151 PolarHBondContact O-N 3.37Å; F148-V151 PolarHBondContact O-N 2.81Å; L149-V151 VanDerWaalsContact C-N 3.34Å; L149-V151 PolarHBondContact O-N 3.1Å; V151-S154 PolarHBondContact O-N 3.39Å; V151-F155 WeakPolarHBondContact O-CB 3.38Å; V151-F155 PolarHBondContact O-N 3.4Å; V151-L636 HydrophobicContact CG2-CD1 3.67Å; V151-L636 HydrophobicContact CG2-CD2 3.93Å; V151-L636 HydrophobicContact CG2-CG 4.48Å
152	V	96.8	Very high	95.1	Very high	51 Å²	51	35.6 Å²	35.6	31%	0.309	18%	0.183	S	C	.	.	H	α-helix	trans	-63.8	-47.3	178.5	178.2	0	0	0	0	110.8	F148 L149 S154 F155 L156 L206 F210	F148-V152 PolarHBondContact O-N 3.24Å; L149-V152 PolarHBondContact O-N 2.95Å; V152-S154 PolarHBondContact O-N 3.47Å; V152-F155 PolarHBondContact O-N 2.77Å; V152-L156 HydrophobicContact CG1-CD1 4.04Å; V152-L156 HydrophobicContact CG1-CG 4.48Å; V152-L156 WeakPolarHBondContact O-CG 3.2Å; V152-L156 PolarHBondContact O-N 3.18Å; V152-L206 HydrophobicContact CG1-CD1 3.84Å; V152-F210 HydrophobicContact CG2-CZ 4.5Å
153	V	95.5	Very high	95	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-60.2	-44.7	177.1	165.6	0	0	0	0	111.5	L149 F155 L156 S157 Y203 M622 A632	L149-V153 HydrophobicContact CD1-CG2 4.31Å; L149-V153 WeakPolarHBondContact O-CG2 3.47Å; L149-V153 PolarHBondContact O-N 2.85Å; V153-F155 VanDerWaalsContact C-N 3.34Å; V153-F155 PolarHBondContact O-N 3Å; V153-L156 PolarHBondContact O-N 2.93Å; V153-S157 VanDerWaalsContact O-CB 3.3Å; V153-S157 WeakPolarHBondContact O-CB 3.35Å; V153-S157 PolarHBondContact O-N 2.69Å; V153-S157 PolarHBondContact O-OG 2.7Å; V153-Y203 HydrophobicContact CB-CE2 4.46Å; V153-Y203 HydrophobicContact CG1-CD2 4.33Å; V153-Y203 HydrophobicContact CG1-CE2 3.64Å; V153-Y203 HydrophobicContact CG2-CD1 4.24Å; V153-Y203 HydrophobicContact CG2-CD2 4.35Å; V153-Y203 HydrophobicContact CG2-CE1 4.16Å; V153-Y203 HydrophobicContact CG2-CE2 4.28Å; V153-Y203 HydrophobicContact CG2-CG 4.34Å; V153-Y203 PolarHBondContact O-OH 2.96Å; V153-Y203 VanDerWaalsContact O-OH 3.12Å; V153-M622 HydrophobicContact CG1-SD 4.44Å; V153-M622 HydrophobicContact CG2-CE 4.4Å; V153-M622 HydrophobicContact CG2-SD 4.25Å; V153-A632 HydrophobicContact CG1-CB 4.45Å
154	S	95.9	Very high	94.8	Very high	7 Å²	7	39.8 Å²	39.8	5%	0.049	21%	0.21	C	C	.	.	H	α-helix	trans	-63.4	-40.6	179.1	-61.1	0	0	0	0	111.9	L150 V151 V152 L158 A632	L150-S154 WeakPolarHBondContact O-CB 3.39Å; L150-S154 PolarHBondContact O-N 3.15Å; L150-S154 PolarHBondContact O-OG 2.93Å; V151-S154 PolarHBondContact O-N 3.39Å; V152-S154 PolarHBondContact O-N 3.47Å; S154-L158 WeakPolarHBondContact O-CB 3.49Å; S154-L158 WeakPolarHBondContact O-CG 3.48Å; S154-L158 PolarHBondContact O-N 3.27Å; S154-A632 VanDerWaalsContact OG-C 3.32Å; S154-A632 PolarHBondContact OG-O 3.09Å
155	F	96.2	Very high	94.5	Very high	132 Å²	132	36.7 Å²	36.7	58%	0.579	20%	0.198	S	C	*	.	H	α-helix	trans	-61.8	-48.7	175.1	178.6	-97.6	0	0	0	111.5	V151 V152 V153 L158 C159	V151-F155 WeakPolarHBondContact O-CB 3.38Å; V151-F155 PolarHBondContact O-N 3.4Å; V152-F155 PolarHBondContact O-N 2.77Å; V153-F155 VanDerWaalsContact C-N 3.34Å; V153-F155 PolarHBondContact O-N 3Å; F155-L158 PolarHBondContact O-N 2.83Å; F155-C159 HydrophobicContact CE2-CB 4.45Å; F155-C159 VanDerWaalsContact CE2-SG 3.55Å; F155-C159 HydrophobicContact CZ-CB 4.42Å; F155-C159 VanDerWaalsContact O-CB 3.22Å; F155-C159 WeakPolarHBondContact O-CB 3.45Å; F155-C159 PolarHBondContact O-N 3.11Å; F155-C159 PolarHBondContact O-SG 2.63Å
156	L	95.2	Very high	94.2	Very high	34 Å²	34	39.4 Å²	39.4	18%	0.178	21%	0.213	C	C	.	.	H	α-helix	trans	-63.2	-43.6	178.7	-68.2	176.6	0	0	0	112.2	V152 V153 V160 I161 F199 I202 Y203 L206	V152-L156 HydrophobicContact CG1-CD1 4.04Å; V152-L156 HydrophobicContact CG1-CG 4.48Å; V152-L156 WeakPolarHBondContact O-CG 3.2Å; V152-L156 PolarHBondContact O-N 3.18Å; V153-L156 PolarHBondContact O-N 2.93Å; L156-V160 WeakPolarHBondContact O-CB 3.33Å; L156-V160 PolarHBondContact O-N 2.85Å; L156-V160 VanDerWaalsContact O-N 3.09Å; L156-I161 PolarHBondContact O-N 2.96Å; L156-F199 HydrophobicContact CB-CD1 4.23Å; L156-F199 HydrophobicContact CB-CE1 3.92Å; L156-F199 HydrophobicContact CD1-CE1 4.43Å; L156-F199 HydrophobicContact CD2-CE1 3.95Å; L156-F199 HydrophobicContact CG-CE1 4.3Å; L156-I202 HydrophobicContact CD1-CG2 4.43Å; L156-Y203 HydrophobicContact CB-CE1 4.08Å; L156-Y203 HydrophobicContact CD1-CD1 4.49Å; L156-Y203 HydrophobicContact CD1-CE1 3.82Å; L156-L206 HydrophobicContact CD1-CD1 4.06Å
157	S	93.3	Very high	93.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.237	C	C	.	.	I	π-helix	trans	-62.2	-45.1	177	-77	0	0	0	0	112.3	V153 I161 L162 Y203 S625 P629	V153-S157 VanDerWaalsContact O-CB 3.3Å; V153-S157 WeakPolarHBondContact O-CB 3.35Å; V153-S157 PolarHBondContact O-N 2.69Å; V153-S157 PolarHBondContact O-OG 2.7Å; S157-I161 PolarHBondContact O-N 3.36Å; S157-L162 WeakPolarHBondContact O-CB 3.47Å; S157-L162 PolarHBondContact O-N 3.29Å; S157-Y203 PolarHBondContact N-OH 2.81Å; S157-Y203 PolarHBondContact OG-OH 3.04Å; S157-S625 PolarHBondContact OG-O 3.18Å; S157-P629 WeakPolarHBondContact O-CB 3.48Å
158	L	93.6	Very high	93.1	Very high	65 Å²	65	42.3 Å²	42.3	34%	0.34	24%	0.236	S	C	.	.	I	π-helix	trans	-79.9	-38.2	-177.3	-69.1	179.9	0	0	0	114	S154 F155 L162 P163 P633	S154-L158 WeakPolarHBondContact O-CB 3.49Å; S154-L158 WeakPolarHBondContact O-CG 3.48Å; S154-L158 PolarHBondContact O-N 3.27Å; F155-L158 PolarHBondContact O-N 2.83Å; L158-L162 HydrophobicContact CD2-CD2 3.94Å; L158-P163 VanDerWaalsContact O-CD 3.28Å; L158-P163 WeakPolarHBondContact O-CD 3.43Å; L158-P633 HydrophobicContact CD1-CB 4.08Å; L158-P633 HydrophobicContact CD1-CG 4.03Å; L158-P633 HydrophobicContact CD2-CG 4.15Å; L158-P633 HydrophobicContact CG-CG 4.37Å
159	C	94.1	Very high	92.3	Very high	72 Å²	72	41 Å²	41	49%	0.486	24%	0.235	S	C	.	.	I	π-helix	trans	-86.8	-23.6	-174.3	-64.6	0	0	0	0	113.3	F155	F155-C159 HydrophobicContact CE2-CB 4.45Å; F155-C159 VanDerWaalsContact CE2-SG 3.55Å; F155-C159 HydrophobicContact CZ-CB 4.42Å; F155-C159 VanDerWaalsContact O-CB 3.22Å; F155-C159 WeakPolarHBondContact O-CB 3.45Å; F155-C159 PolarHBondContact O-N 3.11Å; F155-C159 PolarHBondContact O-SG 2.63Å
160	V	93.6	Very high	91.2	Very high	47 Å²	47	44.6 Å²	44.6	29%	0.285	25%	0.254	S	S	.	.	I	π-helix	trans	-118.2	-57.3	-176.5	-172.8	0	0	0	0	111.8	L156 P163 V164 L195 F199	L156-V160 WeakPolarHBondContact O-CB 3.33Å; L156-V160 PolarHBondContact O-N 2.85Å; L156-V160 VanDerWaalsContact O-N 3.09Å; V160-P163 WeakPolarHBondContact O-CD 3.36Å; V160-V164 VanDerWaalsContact O-CG2 3.25Å; V160-V164 WeakPolarHBondContact O-CG2 3.29Å; V160-V164 PolarHBondContact O-N 3.48Å; V160-L195 HydrophobicContact CG1-CD2 4.01Å; V160-F199 HydrophobicContact CB-CE1 4.13Å; V160-F199 HydrophobicContact CB-CZ 3.9Å; V160-F199 HydrophobicContact CG1-CE1 4.22Å; V160-F199 HydrophobicContact CG1-CE2 3.96Å; V160-F199 HydrophobicContact CG1-CZ 3.53Å; V160-F199 HydrophobicContact CG2-CE1 4.38Å; V160-F199 HydrophobicContact CG2-CZ 4.11Å
161	I	92.8	Very high	89.9	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	26%	0.26	C	S	.	.	I	π-helix	trans	-70.4	-44	-171.4	-52.1	-179	0	0	0	111.5	L156 S157 V164 N165 F199 I626 P629	L156-I161 PolarHBondContact O-N 2.96Å; S157-I161 PolarHBondContact O-N 3.36Å; I161-V164 PolarHBondContact O-N 2.9Å; I161-N165 PolarHBondContact O-N 2.76Å; I161-F199 HydrophobicContact CD1-CB 4.22Å; I161-F199 HydrophobicContact CD1-CD1 4.12Å; I161-F199 HydrophobicContact CD1-CG 4.33Å; I161-F199 HydrophobicContact CG1-CD1 4.22Å; I161-F199 HydrophobicContact CG1-CG 4.45Å; I161-I626 HydrophobicContact CD1-CB 4.48Å; I161-I626 HydrophobicContact CD1-CG1 4.09Å; I161-P629 HydrophobicContact CB-CG 3.93Å; I161-P629 HydrophobicContact CG2-CG 3.54Å
162	L	91.9	Very high	88.4	Confident	31 Å²	31	48.5 Å²	48.5	16%	0.162	27%	0.272	C	S	.	.	H	α-helix	trans	-62.2	-48.9	-178.4	176.7	67.2	0	0	0	113.3	S157 L158 V164 N165 L166 T181 P629 I630	S157-L162 WeakPolarHBondContact O-CB 3.47Å; S157-L162 PolarHBondContact O-N 3.29Å; L158-L162 HydrophobicContact CD2-CD2 3.94Å; L162-V164 PolarHBondContact O-N 2.79Å; L162-N165 PolarHBondContact O-N 3.34Å; L162-L166 HydrophobicContact CD1-CD1 4.22Å; L162-L166 HydrophobicContact CD1-CG 4.28Å; L162-L166 HydrophobicContact CG-CD1 4.1Å; L162-L166 WeakPolarHBondContact O-CG 3.45Å; L162-L166 PolarHBondContact O-N 3.07Å; L162-T181 HydrophobicContact CD1-CG2 4.31Å; L162-P629 HydrophobicContact CB-CB 3.99Å; L162-P629 HydrophobicContact CB-CG 4.31Å; L162-I630 HydrophobicContact CD1-CG1 4.39Å
163	P	92.8	Very high	86.9	Confident	66 Å²	66	54.5 Å²	54.5	43%	0.429	29%	0.294	S	S	.	.	H	α-helix	trans	-57.4	-37.5	174	-28	35.4	0	0	0	113.2	L158 V160 L166 S167	L158-P163 VanDerWaalsContact O-CD 3.28Å; L158-P163 WeakPolarHBondContact O-CD 3.43Å; V160-P163 WeakPolarHBondContact O-CD 3.36Å; P163-L166 PolarHBondContact O-N 3.27Å; P163-S167 PolarHBondContact O-N 3Å
164	V	91.1	Very high	85.8	Confident	23 Å²	23	59.4 Å²	59.4	14%	0.139	32%	0.32	C	S	.	.	H	α-helix	trans	-66.5	-44.5	177.7	170.7	0	0	0	0	110.7	V160 I161 L162 L166 S167 L186 L192 L195	V160-V164 VanDerWaalsContact O-CG2 3.25Å; V160-V164 WeakPolarHBondContact O-CG2 3.29Å; V160-V164 PolarHBondContact O-N 3.48Å; I161-V164 PolarHBondContact O-N 2.9Å; L162-V164 PolarHBondContact O-N 2.79Å; V164-L166 VanDerWaalsContact C-N 3.32Å; V164-L166 PolarHBondContact O-N 2.95Å; V164-S167 WeakPolarHBondContact O-CB 3.43Å; V164-S167 PolarHBondContact O-N 3.48Å; V164-S167 VanDerWaalsContact O-N 3.17Å; V164-S167 PolarHBondContact O-OG 3.24Å; V164-L186 HydrophobicContact CG1-CD1 4.48Å; V164-L186 WeakPolarHBondContact O-CD2 3.43Å; V164-L192 HydrophobicContact CG1-CB 3.99Å; V164-L192 HydrophobicContact CG1-CD1 4.28Å; V164-L192 HydrophobicContact CG1-CD2 4.2Å; V164-L192 HydrophobicContact CG1-CG 4.38Å; V164-L195 HydrophobicContact CB-CD2 4.14Å; V164-L195 HydrophobicContact CG1-CD2 4.04Å; V164-L195 HydrophobicContact CG2-CD2 3.58Å
165	N	88.9	Confident	84.5	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-60.9	-40.9	174.4	-71.8	-12.6	0	0	0	112.5	I161 L162 S167 G168 R180 T181 I183 N185 H196 P629	I161-N165 PolarHBondContact O-N 2.76Å; L162-N165 PolarHBondContact O-N 3.34Å; N165-S167 PolarHBondContact O-N 2.84Å; N165-G168 PolarHBondContact O-N 2.86Å; N165-R180 CarbonylContact C-O 3.46Å; N165-T181 PolarHBondContact ND2-O 3.02Å; N165-T181 VanDerWaalsContact ND2-O 3.13Å; N165-I183 PolarHBondContact ND2-N 3.46Å; N165-N185 PolarHBondContact O-ND2 3.24Å; N165-H196 PolarHBondContact OD1-CE1 3.12Å; N165-H196 PolarHBondContact OD1-NE2 3.43Å; N165-P629 WeakPolarHBondContact ND2-CD 3.37Å
166	L	88	Confident	83.3	Confident	78 Å²	78	65.1 Å²	65.1	41%	0.408	35%	0.351	S	S	.	.	H	α-helix	trans	-68.3	-22.8	178.3	-72.1	171.9	0	0	0	113.5	L162 P163 V164 G168 R180 T181	L162-L166 HydrophobicContact CD1-CD1 4.22Å; L162-L166 HydrophobicContact CD1-CG 4.28Å; L162-L166 HydrophobicContact CG-CD1 4.1Å; L162-L166 WeakPolarHBondContact O-CG 3.45Å; L162-L166 PolarHBondContact O-N 3.07Å; P163-L166 PolarHBondContact O-N 3.27Å; V164-L166 VanDerWaalsContact C-N 3.32Å; V164-L166 PolarHBondContact O-N 2.95Å; L166-G168 PolarHBondContact O-N 3.24Å; L166-R180 HydrophobicContact CD2-CB 4.41Å; L166-T181 HydrophobicContact CD2-CG2 4.18Å
167	S	87.3	Confident	82.3	Confident	74 Å²	74	65.5 Å²	65.5	52%	0.517	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-16.4	176.4	76.6	0	0	0	0	113.7	P163 V164 N165	P163-S167 PolarHBondContact O-N 3Å; V164-S167 WeakPolarHBondContact O-CB 3.43Å; V164-S167 PolarHBondContact O-N 3.48Å; V164-S167 VanDerWaalsContact O-N 3.17Å; V164-S167 PolarHBondContact O-OG 3.24Å; N165-S167 PolarHBondContact O-N 2.84Å
168	G	82	Confident	81.7	Confident	7 Å²	7	65.8 Å²	65.8	7%	0.072	36%	0.357	C	S	.	.			trans	-67.3	154.2	175	0	0	0	0	0	113.2	N165 L166 N185	N165-G168 PolarHBondContact O-N 2.86Å; L166-G168 PolarHBondContact O-N 3.24Å; G168-N185 VanDerWaalsContact C-ND2 3.3Å; G168-N185 CarbonylContact C-O 3.51Å; G168-N185 WeakPolarHBondContact CA-O 3.38Å; G168-N185 PolarHBondContact O-ND2 3.46Å
169	D	78.7	Confident	80.8	Confident	101 Å²	101	62.8 Å²	62.8	54%	0.54	34%	0.343	S	S	.	.			trans	-125.5	10.8	-174.2	64.8	-18.6	0	0	0	113.3	N185 Q187	D169-N185 PolarHBondContact N-O 2.89Å; D169-Q187 VanDerWaalsContact OD1-CG 3.27Å; D169-Q187 WeakPolarHBondContact OD1-CG 3.38Å; D169-Q187 PolarHBondContact OD1-NE2 3.39Å; D169-Q187 PolarHBondContact OD2-NE2 2.77Å; D169-Q187 VanDerWaalsContact OD2-NE2 3.08Å
170	L	73	Confident	80.2	Confident	77 Å²	77	62 Å²	62	40%	0.403	33%	0.329	S	S	.	.	S	Bend	trans	-74.9	-29.1	-176.2	-166.6	70.3	0	0	0	113.4	N185 Q187	L170-N185 VanDerWaalsContact CB-O 3.28Å; L170-N185 WeakPolarHBondContact CB-O 3.47Å; L170-N185 PolarHBondContact N-O 2.85Å; L170-Q187 HydrophobicContact CB-CG 4.48Å; L170-Q187 HydrophobicContact CD1-CG 4.35Å
171	L	70.2	Confident	79.8	Confident	24 Å²	24	60.2 Å²	60.2	13%	0.126	32%	0.318	C	S	.	.	S	Bend	trans	-100.3	153.7	178.2	-68.6	162.3	0	0	0	111.6	Y33 G179 R180 N185	Y33-L171 HydrophobicContact CD1-CD2 4.47Å; Y33-L171 HydrophobicContact CE1-CD2 3.61Å; L171-G179 WeakPolarHBondContact CD1-O 3.48Å; L171-R180 HydrophobicContact CB-CG 4.32Å; L171-N185 WeakPolarHBondContact CB-OD1 3.5Å; L171-N185 HydrophobicContact CD1-CB 4Å; L171-N185 PolarHBondContact N-OD1 3.48Å; L171-N185 VanDerWaalsContact N-OD1 3.17Å
172	D	65.3	Low	79.5	Confident	128 Å²	128	60.5 Å²	60.5	68%	0.684	32%	0.32	S	S	*	.			trans	-50.4	141.7	178.4	-77.5	-38.3	0	0	0	112.4	D174 R180	D172-D174 PolarHBondContact O-N 3.41Å; D172-R180 WeakPolarHBondContact O-CD 3.44Å
173	K	66.1	Low	79	Confident	178 Å²	178	59.3 Å²	59.3	77%	0.774	31%	0.314	S	S	*	.			trans	-71.8	13.3	-175.5	-67.5	-176.1	-177.9	175.1	0	114.4	R180	K173-R180 PolarHBondContact O-NH1 3.47Å
174	D	71.9	Confident	78.3	Confident	102 Å²	102	56.6 Å²	56.6	55%	0.545	30%	0.297	S	S	.	.			trans	-64.6	125	176.1	-72.4	-21	0	0	0	110.2	D172 Y176 S177 R180	D172-D174 PolarHBondContact O-N 3.41Å; D174-Y176 PolarHBondContact O-N 2.91Å; D174-S177 PolarHBondContact O-N 3.07Å; D174-R180 VanDerWaalsContact O-CD 3.25Å; D174-R180 WeakPolarHBondContact O-CD 3.48Å; D174-R180 PolarHBondContact O-NH1 2.66Å
175	P	68.8	Low	77.9	Confident	97 Å²	97	55.5 Å²	55.5	63%	0.63	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-15.6	179.5	25.5	-32.4	0	0	0	112.8
176	Y	70.7	Confident	77.5	Confident	163 Å²	163	55.5 Å²	55.5	64%	0.639	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-3	179.8	-59.4	-72	0	0	0	113.8	T46 F47 D174 F178	T46-Y176 HydrophobicContact CG2-CD1 3.99Å; T46-Y176 HydrophobicContact CG2-CG 4.32Å; F47-Y176 VanDerWaalsContact CA-O 3.29Å; F47-Y176 WeakPolarHBondContact CA-O 3.01Å; F47-Y176 PolarHBondContact N-O 3.28Å; D174-Y176 PolarHBondContact O-N 2.91Å; Y176-F178 PolarHBondContact O-N 3.07Å
177	S	75	Confident	76.9	Confident	42 Å²	42	54.8 Å²	54.8	29%	0.294	29%	0.285	S	S	.	.			trans	-82	113.1	177.9	-178.3	0	0	0	0	110.9	D174 G179 R180	D174-S177 PolarHBondContact O-N 3.07Å; S177-G179 PolarHBondContact O-N 3.34Å; S177-R180 PolarHBondContact O-N 3.27Å
178	F	79.8	Confident	76	Confident	5 Å²	5	55 Å²	55	2%	0.022	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-61	-34.8	179.5	176.3	-99.7	0	0	0	112.5	F47 I50 Y176 R180 T181 T182 P550 A554 V557 C628 I630	F47-F178 AromaticContact CD1-CD2 4Å; F47-F178 HydrophobicContact CD1-CD2 4Å; F47-F178 HydrophobicContact CD2-CB 4.4Å; F47-F178 AromaticContact CE1-CD2 3.65Å; F47-F178 HydrophobicContact CE1-CD2 3.65Å; F47-F178 HydrophobicContact CE1-CE2 4.13Å; F47-F178 HydrophobicContact CE2-CD2 4.21Å; F47-F178 HydrophobicContact CG-CD2 4.42Å; F47-F178 AromaticContact CZ-CD2 3.77Å; F47-F178 HydrophobicContact CZ-CD2 3.77Å; F47-F178 HydrophobicContact CZ-CE2 4.35Å; I50-F178 HydrophobicContact CD1-CD2 3.54Å; I50-F178 HydrophobicContact CD1-CE2 3.23Å; I50-F178 HydrophobicContact CD1-CZ 4.06Å; Y176-F178 PolarHBondContact O-N 3.07Å; F178-R180 PolarHBondContact O-N 2.86Å; F178-T181 PolarHBondContact O-N 3.32Å; F178-T181 PolarHBondContact O-OG1 3.06Å; F178-T182 HydrophobicContact CD1-CG2 4.27Å; F178-T182 HydrophobicContact CE1-CG2 3.81Å; F178-T182 HydrophobicContact CZ-CG2 4.44Å; F178-P550 WeakPolarHBondContact CD1-O 3.41Å; F178-P550 WeakPolarHBondContact CE1-O 3.31Å; F178-A554 HydrophobicContact CD1-CB 3.74Å; F178-A554 HydrophobicContact CD2-CB 4.44Å; F178-A554 HydrophobicContact CE1-CB 3.77Å; F178-A554 HydrophobicContact CE2-CB 4.46Å; F178-A554 HydrophobicContact CG-CB 4.07Å; F178-A554 HydrophobicContact CZ-CB 4.1Å; F178-V557 HydrophobicContact CE2-CG2 4.37Å; F178-V557 HydrophobicContact CZ-CG2 4Å; F178-C628 WeakPolarHBondContact CZ-SG 2.96Å; F178-I630 HydrophobicContact CE2-CD1 4.23Å
179	G	75.6	Confident	75.4	Confident	3 Å²	3	60.6 Å²	60.6	3%	0.031	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-60	-23.3	-174.5	0	0	0	0	0	114.4	L171 S177 T181 T182 P550	L171-G179 WeakPolarHBondContact CD1-O 3.48Å; S177-G179 PolarHBondContact O-N 3.34Å; G179-T181 PolarHBondContact O-N 2.89Å; G179-T182 PolarHBondContact O-N 3.27Å; G179-T182 PolarHBondContact O-OG1 3.31Å; G179-P550 VanDerWaalsContact CA-CB 3.41Å
180	R	80.2	Confident	75.2	Confident	56 Å²	56	58.6 Å²	58.6	21%	0.211	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-60.1	-25.1	175.2	-63.8	-174.1	69	176.7	2.2	114	N165 L166 L171 D172 K173 D174 S177 F178 T182 N185	N165-R180 CarbonylContact C-O 3.46Å; L166-R180 HydrophobicContact CD2-CB 4.41Å; L171-R180 HydrophobicContact CB-CG 4.32Å; D172-R180 WeakPolarHBondContact O-CD 3.44Å; K173-R180 PolarHBondContact O-NH1 3.47Å; D174-R180 VanDerWaalsContact O-CD 3.25Å; D174-R180 WeakPolarHBondContact O-CD 3.48Å; D174-R180 PolarHBondContact O-NH1 2.66Å; S177-R180 PolarHBondContact O-N 3.27Å; F178-R180 PolarHBondContact O-N 2.86Å; R180-T182 VanDerWaalsContact C-N 3.29Å; R180-N185 PolarHBondContact O-ND2 2.95Å
181	T	85.6	Confident	75.6	Confident	9 Å²	9	61 Å²	61	6%	0.055	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-85.2	-6.4	-179.4	67.7	0	0	0	0	112.9	F47 L162 N165 L166 F178 G179 P629 I630	F47-T181 HydrophobicContact CE2-CG2 3.97Å; F47-T181 HydrophobicContact CZ-CG2 3.91Å; L162-T181 HydrophobicContact CD1-CG2 4.31Å; N165-T181 PolarHBondContact ND2-O 3.02Å; N165-T181 VanDerWaalsContact ND2-O 3.13Å; L166-T181 HydrophobicContact CD2-CG2 4.18Å; F178-T181 PolarHBondContact O-N 3.32Å; F178-T181 PolarHBondContact O-OG1 3.06Å; G179-T181 PolarHBondContact O-N 2.89Å; T181-P629 WeakPolarHBondContact O-CD 3.33Å; T181-I630 HydrophobicContact CG2-CD1 3.75Å
182	T	86	Confident	76.2	Confident	7 Å²	7	62.6 Å²	62.6	4%	0.043	32%	0.323	C	S	.	.	S	Bend	trans	-106	162.9	-174.2	72.8	0	0	0	0	111.7	F178 G179 R180 A184 N185 T627 C628	F178-T182 HydrophobicContact CD1-CG2 4.27Å; F178-T182 HydrophobicContact CE1-CG2 3.81Å; F178-T182 HydrophobicContact CZ-CG2 4.44Å; G179-T182 PolarHBondContact O-N 3.27Å; G179-T182 PolarHBondContact O-OG1 3.31Å; R180-T182 VanDerWaalsContact C-N 3.29Å; T182-A184 PolarHBondContact O-N 3.03Å; T182-A184 WeakPolarHBondContact OG1-CB 3.36Å; T182-A184 PolarHBondContact OG1-N 3.44Å; T182-N185 PolarHBondContact O-N 3.32Å; T182-N185 VanDerWaalsContact O-N 3.08Å; T182-T627 VanDerWaalsContact CA-O 3.26Å; T182-T627 WeakPolarHBondContact CA-O 3.34Å; T182-T627 WeakPolarHBondContact CB-O 3.22Å; T182-C628 HydrophobicContact CG2-CB 4.34Å
183	I	82.7	Confident	76.9	Confident	6 Å²	6	57 Å²	57	3%	0.031	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-56.6	-20.8	175.9	-167.3	170.7	0	0	0	113.1	N165 N185 L186 H196 T627 F685 R689	N165-I183 PolarHBondContact ND2-N 3.46Å; I183-N185 PolarHBondContact O-N 2.95Å; I183-L186 HydrophobicContact CG1-CD1 4.36Å; I183-L186 PolarHBondContact O-N 3.46Å; I183-H196 HydrophobicContact CD1-CB 4.06Å; I183-T627 HydrophobicContact CG2-CG2 4.09Å; I183-T627 PolarHBondContact N-O 2.69Å; I183-F685 HydrophobicContact CD1-CD1 4.15Å; I183-F685 HydrophobicContact CD1-CE1 3.74Å; I183-F685 HydrophobicContact CG1-CE1 3.91Å; I183-F685 HydrophobicContact CG1-CZ 4.29Å; I183-F685 HydrophobicContact CG2-CD1 4.5Å; I183-F685 HydrophobicContact CG2-CE1 3.86Å; I183-F685 HydrophobicContact CG2-CE2 4.07Å; I183-F685 HydrophobicContact CG2-CZ 3.61Å; I183-R689 PolarHBondContact O-NH1 2.99Å
184	A	78.2	Confident	77.9	Confident	9 Å²	9	52.3 Å²	52.3	7%	0.074	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-63.9	-22.4	177.5	0	0	0	0	0	113.3	T182 L186 P550 R689	T182-A184 PolarHBondContact O-N 3.03Å; T182-A184 WeakPolarHBondContact OG1-CB 3.36Å; T182-A184 PolarHBondContact OG1-N 3.44Å; A184-L186 VanDerWaalsContact C-N 3.28Å; A184-L186 PolarHBondContact O-N 2.94Å; A184-P550 HydrophobicContact CB-CB 4.5Å; A184-P550 HydrophobicContact CB-CG 3.72Å; A184-R689 PolarHBondContact O-NH2 3.47Å
185	N	81.5	Confident	78.8	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-74	-16.2	179.8	-167.3	38.9	0	0	0	114.1	N165 G168 D169 L170 L171 R180 T182 I183	N165-N185 PolarHBondContact O-ND2 3.24Å; G168-N185 VanDerWaalsContact C-ND2 3.3Å; G168-N185 CarbonylContact C-O 3.51Å; G168-N185 WeakPolarHBondContact CA-O 3.38Å; G168-N185 PolarHBondContact O-ND2 3.46Å; D169-N185 PolarHBondContact N-O 2.89Å; L170-N185 VanDerWaalsContact CB-O 3.28Å; L170-N185 WeakPolarHBondContact CB-O 3.47Å; L170-N185 PolarHBondContact N-O 2.85Å; L171-N185 WeakPolarHBondContact CB-OD1 3.5Å; L171-N185 HydrophobicContact CD1-CB 4Å; L171-N185 PolarHBondContact N-OD1 3.48Å; L171-N185 VanDerWaalsContact N-OD1 3.17Å; R180-N185 PolarHBondContact O-ND2 2.95Å; T182-N185 PolarHBondContact O-N 3.32Å; T182-N185 VanDerWaalsContact O-N 3.08Å; I183-N185 PolarHBondContact O-N 2.95Å
186	L	81.2	Confident	79.7	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.226	C	C	.	.	S	Bend	trans	-79.3	142.1	179.2	-67.3	171.4	0	0	0	111.3	V164 I183 A184 L192 H196 R689	V164-L186 HydrophobicContact CG1-CD1 4.48Å; V164-L186 WeakPolarHBondContact O-CD2 3.43Å; I183-L186 HydrophobicContact CG1-CD1 4.36Å; I183-L186 PolarHBondContact O-N 3.46Å; A184-L186 VanDerWaalsContact C-N 3.28Å; A184-L186 PolarHBondContact O-N 2.94Å; L186-L192 HydrophobicContact CD2-CB 4.36Å; L186-L192 HydrophobicContact CD2-CD1 4.25Å; L186-H196 VanDerWaalsContact CD1-CE1 3.44Å; L186-H196 WeakPolarHBondContact CD1-CE1 3.46Å; L186-R689 PolarHBondContact O-NH1 3.29Å; L186-R689 VanDerWaalsContact O-NH1 3.12Å; L186-R689 PolarHBondContact O-NH2 2.7Å
187	Q	74.1	Confident	80.6	Confident	63 Å²	63	37.7 Å²	37.7	29%	0.294	20%	0.197	S	C	.	.			trans	-70.2	158.7	171.8	-61.7	-175.6	-6	0	0	111.8	D169 L170 D189	D169-Q187 VanDerWaalsContact OD1-CG 3.27Å; D169-Q187 WeakPolarHBondContact OD1-CG 3.38Å; D169-Q187 PolarHBondContact OD1-NE2 3.39Å; D169-Q187 PolarHBondContact OD2-NE2 2.77Å; D169-Q187 VanDerWaalsContact OD2-NE2 3.08Å; L170-Q187 HydrophobicContact CB-CG 4.48Å; L170-Q187 HydrophobicContact CD1-CG 4.35Å; Q187-D189 VanDerWaalsContact CB-OD1 3.26Å; Q187-D189 WeakPolarHBondContact CB-OD1 3.49Å; Q187-D189 PolarHBondContact OE1-OD1 3.42Å
188	T	70	Confident	81.3	Confident	77 Å²	77	39.7 Å²	39.7	47%	0.472	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-22.1	-174.3	45.9	0	0	0	0	114.3	R689 L690	T188-R689 HydrophobicContact CG2-CG 3.76Å; T188-L690 WeakPolarHBondContact O-CD2 3.29Å
189	D	68.1	Low	81.9	Confident	126 Å²	126	40.5 Å²	40.5	67%	0.674	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-0.3	179.7	59.7	-27.3	0	0	0	113.5	Q187	Q187-D189 VanDerWaalsContact CB-OD1 3.26Å; Q187-D189 WeakPolarHBondContact CB-OD1 3.49Å; Q187-D189 PolarHBondContact OE1-OD1 3.42Å
190	N	75.8	Confident	82.6	Confident	58 Å²	58	40.4 Å²	40.4	31%	0.31	21%	0.207	S	C	.	.			trans	-86.1	127.2	-174.4	-162.9	-26.4	0	0	0	112.4	L192 I193	N190-L192 PolarHBondContact O-N 2.92Å; N190-L192 VanDerWaalsContact OD1-CG 3.25Å; N190-L192 WeakPolarHBondContact OD1-CG 3.44Å; N190-L192 PolarHBondContact OD1-N 2.99Å; N190-L192 VanDerWaalsContact OD1-N 3.17Å; N190-I193 PolarHBondContact O-N 3.35Å
191	D	80.7	Confident	83.2	Confident	128 Å²	128	39.1 Å²	39.1	68%	0.684	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-16.7	177.9	-72.8	-34.3	0	0	0	113.5	I193 W194	D191-I193 PolarHBondContact O-N 3.15Å; D191-I193 VanDerWaalsContact O-N 3.12Å; D191-W194 WeakPolarHBondContact O-CB 3.36Å; D191-W194 PolarHBondContact O-N 3.16Å
192	L	82.7	Confident	83.6	Confident	58 Å²	58	41.7 Å²	41.7	30%	0.304	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-17.3	177.1	-66.7	174	0	0	0	114.2	V164 L186 N190 W194 L195 H196	V164-L192 HydrophobicContact CG1-CB 3.99Å; V164-L192 HydrophobicContact CG1-CD1 4.28Å; V164-L192 HydrophobicContact CG1-CD2 4.2Å; V164-L192 HydrophobicContact CG1-CG 4.38Å; L186-L192 HydrophobicContact CD2-CB 4.36Å; L186-L192 HydrophobicContact CD2-CD1 4.25Å; N190-L192 PolarHBondContact O-N 2.92Å; N190-L192 VanDerWaalsContact OD1-CG 3.25Å; N190-L192 WeakPolarHBondContact OD1-CG 3.44Å; N190-L192 PolarHBondContact OD1-N 2.99Å; N190-L192 VanDerWaalsContact OD1-N 3.17Å; L192-W194 PolarHBondContact O-N 3.36Å; L192-L195 VanDerWaalsContact O-CB 3.32Å; L192-L195 WeakPolarHBondContact O-CB 3.43Å; L192-L195 PolarHBondContact O-N 3.12Å; L192-H196 PolarHBondContact O-ND1 3.27Å; L192-H196 VanDerWaalsContact O-ND1 3.16Å
193	I	81.1	Confident	83.9	Confident	9 Å²	9	41.4 Å²	41.4	5%	0.046	22%	0.216	C	C	.	.	H	α-helix	trans	-64.3	-31.5	173.1	-64.4	174.8	0	0	0	111	N190 D191 L195 H196 L690	N190-I193 PolarHBondContact O-N 3.35Å; D191-I193 PolarHBondContact O-N 3.15Å; D191-I193 VanDerWaalsContact O-N 3.12Å; I193-L195 PolarHBondContact O-N 2.91Å; I193-H196 WeakPolarHBondContact O-CB 3.5Å; I193-H196 PolarHBondContact O-N 3.46Å; I193-H196 VanDerWaalsContact O-N 3.14Å; I193-L690 HydrophobicContact CD1-CD1 4.22Å; I193-L690 HydrophobicContact CD1-CD2 4.08Å; I193-L690 HydrophobicContact CG2-CD1 4.37Å
194	W	86.4	Confident	84.4	Confident	81 Å²	81	42.2 Å²	42.2	31%	0.307	22%	0.22	S	C	.	.	H	α-helix	trans	-59.8	-33.3	176.8	-79.7	98.4	0	0	0	113.4	D191 L192 H196 T197 I198 P695 A696 F699	D191-W194 WeakPolarHBondContact O-CB 3.36Å; D191-W194 PolarHBondContact O-N 3.16Å; L192-W194 PolarHBondContact O-N 3.36Å; W194-H196 VanDerWaalsContact C-N 3.28Å; W194-H196 PolarHBondContact O-N 3.18Å; W194-T197 PolarHBondContact O-N 2.85Å; W194-I198 WeakPolarHBondContact O-CG1 3.48Å; W194-I198 PolarHBondContact O-N 3.44Å; W194-P695 HydrophobicContact CH2-CB 4.26Å; W194-P695 WeakPolarHBondContact CH2-O 3.48Å; W194-P695 HydrophobicContact CZ2-CB 3.76Å; W194-P695 HydrophobicContact CZ2-CG 4.05Å; W194-A696 HydrophobicContact CD2-CB 4.39Å; W194-A696 HydrophobicContact CZ2-CB 4.33Å; W194-F699 HydrophobicContact CE3-CD1 4.43Å; W194-F699 HydrophobicContact CH2-CB 3.95Å; W194-F699 HydrophobicContact CH2-CG 4.41Å; W194-F699 HydrophobicContact CZ3-CB 3.77Å; W194-F699 AromaticContact CZ3-CD1 3.8Å; W194-F699 HydrophobicContact CZ3-CD1 3.8Å; W194-F699 AromaticContact CZ3-CG 3.81Å; W194-F699 HydrophobicContact CZ3-CG 3.81Å
195	L	90.1	Very high	85.1	Confident	47 Å²	47	48.8 Å²	48.8	25%	0.246	25%	0.247	C	C	.	.	H	α-helix	trans	-58.3	-43.6	177.9	-168.2	73.7	0	0	0	111	V160 V164 L192 I193 T197 I198 F199	V160-L195 HydrophobicContact CG1-CD2 4.01Å; V164-L195 HydrophobicContact CB-CD2 4.14Å; V164-L195 HydrophobicContact CG1-CD2 4.04Å; V164-L195 HydrophobicContact CG2-CD2 3.58Å; L192-L195 VanDerWaalsContact O-CB 3.32Å; L192-L195 WeakPolarHBondContact O-CB 3.43Å; L192-L195 PolarHBondContact O-N 3.12Å; I193-L195 PolarHBondContact O-N 2.91Å; L195-T197 VanDerWaalsContact C-N 3.3Å; L195-T197 PolarHBondContact O-N 2.81Å; L195-I198 PolarHBondContact O-N 2.79Å; L195-F199 HydrophobicContact CD1-CD2 4.01Å; L195-F199 HydrophobicContact CD1-CE2 3.62Å; L195-F199 HydrophobicContact CG-CD2 3.93Å; L195-F199 HydrophobicContact CG-CE2 3.91Å; L195-F199 VanDerWaalsContact O-CD2 3.25Å; L195-F199 WeakPolarHBondContact O-CD2 3.4Å; L195-F199 PolarHBondContact O-N 2.69Å
196	H	89.2	Confident	85.6	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.009	26%	0.258	C	S	.	.	H	α-helix	trans	-61.6	-40.9	179.8	-64	76.4	0	0	0	111.4	N165 I183 L186 L192 I193 W194 A200 I626	N165-H196 PolarHBondContact OD1-CE1 3.12Å; N165-H196 PolarHBondContact OD1-NE2 3.43Å; I183-H196 HydrophobicContact CD1-CB 4.06Å; L186-H196 VanDerWaalsContact CD1-CE1 3.44Å; L186-H196 WeakPolarHBondContact CD1-CE1 3.46Å; L192-H196 PolarHBondContact O-ND1 3.27Å; L192-H196 VanDerWaalsContact O-ND1 3.16Å; I193-H196 WeakPolarHBondContact O-CB 3.5Å; I193-H196 PolarHBondContact O-N 3.46Å; I193-H196 VanDerWaalsContact O-N 3.14Å; W194-H196 VanDerWaalsContact C-N 3.28Å; W194-H196 PolarHBondContact O-N 3.18Å; H196-A200 PolarHBondContact O-N 2.89Å; H196-I626 HydrophobicContact CB-CG2 3.73Å
197	T	87.7	Confident	86.2	Confident	6 Å²	6	50.9 Å²	50.9	4%	0.037	26%	0.258	C	S	.	.	H	α-helix	trans	-67	-43.3	176.7	-53.5	0	0	0	0	112.2	W194 L195 F199 A200 V201 F699 T700	W194-T197 PolarHBondContact O-N 2.85Å; L195-T197 VanDerWaalsContact C-N 3.3Å; L195-T197 PolarHBondContact O-N 2.81Å; T197-F199 VanDerWaalsContact C-N 3.34Å; T197-F199 PolarHBondContact O-N 3.4Å; T197-A200 WeakPolarHBondContact O-CB 3.2Å; T197-A200 PolarHBondContact O-N 2.95Å; T197-V201 PolarHBondContact O-N 3.43Å; T197-F699 HydrophobicContact CG2-CD1 3.44Å; T197-F699 VanDerWaalsContact CG2-CD1 3.44Å; T197-F699 HydrophobicContact CG2-CE1 3.73Å; T197-T700 HydrophobicContact CG2-CG2 3.31Å; T197-T700 WeakPolarHBondContact OG1-CG2 3.43Å
198	I	91	Very high	87	Confident	83 Å²	83	50.6 Å²	50.6	43%	0.426	26%	0.261	S	S	.	.	H	α-helix	trans	-61.6	-44.9	177.5	-67.6	166.5	0	0	0	110.4	W194 L195 A200 V201 I202	W194-I198 WeakPolarHBondContact O-CG1 3.48Å; W194-I198 PolarHBondContact O-N 3.44Å; L195-I198 PolarHBondContact O-N 2.79Å; I198-A200 VanDerWaalsContact C-N 3.3Å; I198-A200 PolarHBondContact O-N 3.32Å; I198-V201 WeakPolarHBondContact O-CB 3.44Å; I198-V201 PolarHBondContact O-N 3.42Å; I198-V201 VanDerWaalsContact O-N 3.15Å; I198-I202 HydrophobicContact CG2-CD1 4.03Å; I198-I202 WeakPolarHBondContact O-CG1 3.34Å; I198-I202 PolarHBondContact O-N 2.81Å
199	F	91.9	Very high	87.9	Confident	22 Å²	22	48.9 Å²	48.9	10%	0.096	26%	0.258	C	S	.	.	H	α-helix	trans	-64.5	-32.9	178.3	-87.6	-105.7	0	0	0	112.8	L156 V160 I161 L195 T197 V201 I202 Y203	L156-F199 HydrophobicContact CB-CD1 4.23Å; L156-F199 HydrophobicContact CB-CE1 3.92Å; L156-F199 HydrophobicContact CD1-CE1 4.43Å; L156-F199 HydrophobicContact CD2-CE1 3.95Å; L156-F199 HydrophobicContact CG-CE1 4.3Å; V160-F199 HydrophobicContact CB-CE1 4.13Å; V160-F199 HydrophobicContact CB-CZ 3.9Å; V160-F199 HydrophobicContact CG1-CE1 4.22Å; V160-F199 HydrophobicContact CG1-CE2 3.96Å; V160-F199 HydrophobicContact CG1-CZ 3.53Å; V160-F199 HydrophobicContact CG2-CE1 4.38Å; V160-F199 HydrophobicContact CG2-CZ 4.11Å; I161-F199 HydrophobicContact CD1-CB 4.22Å; I161-F199 HydrophobicContact CD1-CD1 4.12Å; I161-F199 HydrophobicContact CD1-CG 4.33Å; I161-F199 HydrophobicContact CG1-CD1 4.22Å; I161-F199 HydrophobicContact CG1-CG 4.45Å; L195-F199 HydrophobicContact CD1-CD2 4.01Å; L195-F199 HydrophobicContact CD1-CE2 3.62Å; L195-F199 HydrophobicContact CG-CD2 3.93Å; L195-F199 HydrophobicContact CG-CE2 3.91Å; L195-F199 VanDerWaalsContact O-CD2 3.25Å; L195-F199 WeakPolarHBondContact O-CD2 3.4Å; L195-F199 PolarHBondContact O-N 2.69Å; T197-F199 VanDerWaalsContact C-N 3.34Å; T197-F199 PolarHBondContact O-N 3.4Å; F199-V201 VanDerWaalsContact C-N 3.32Å; F199-V201 PolarHBondContact O-N 2.93Å; F199-I202 WeakPolarHBondContact O-CB 3.39Å; F199-I202 PolarHBondContact O-N 3.48Å; F199-Y203 HydrophobicContact CD1-CE1 4.31Å; F199-Y203 VanDerWaalsContact O-CD1 3.29Å; F199-Y203 WeakPolarHBondContact O-CD1 3.38Å; F199-Y203 PolarHBondContact O-N 3.37Å
200	A	90.7	Very high	89.1	Confident	2 Å²	2	45.3 Å²	45.3	2%	0.017	24%	0.237	C	C	.	.	H	α-helix	trans	-61.8	-40.1	173	0	0	0	0	0	112.5	H196 T197 I198 Y203 L204 I626 L679 L682	H196-A200 PolarHBondContact O-N 2.89Å; T197-A200 WeakPolarHBondContact O-CB 3.2Å; T197-A200 PolarHBondContact O-N 2.95Å; I198-A200 VanDerWaalsContact C-N 3.3Å; I198-A200 PolarHBondContact O-N 3.32Å; A200-Y203 PolarHBondContact O-N 3.23Å; A200-L204 PolarHBondContact O-N 3.37Å; A200-L204 VanDerWaalsContact O-N 3.08Å; A200-I626 HydrophobicContact CB-CD1 3.53Å; A200-L679 HydrophobicContact CB-CD2 3.59Å; A200-L679 HydrophobicContact CB-CG 4.5Å; A200-L682 HydrophobicContact CB-CD1 3.42Å; A200-L682 VanDerWaalsContact CB-CD1 3.42Å
201	V	91.8	Very high	89.8	Confident	28 Å²	28	42.6 Å²	42.6	17%	0.17	22%	0.222	C	C	.	.	H	α-helix	trans	-67	-41.3	174.3	-179.2	0	0	0	0	111.1	T197 I198 F199 Y203 L204 F205 V703	T197-V201 PolarHBondContact O-N 3.43Å; I198-V201 WeakPolarHBondContact O-CB 3.44Å; I198-V201 PolarHBondContact O-N 3.42Å; I198-V201 VanDerWaalsContact O-N 3.15Å; F199-V201 VanDerWaalsContact C-N 3.32Å; F199-V201 PolarHBondContact O-N 2.93Å; V201-Y203 VanDerWaalsContact C-N 3.32Å; V201-Y203 PolarHBondContact O-N 2.69Å; V201-L204 WeakPolarHBondContact O-CB 3.33Å; V201-L204 PolarHBondContact O-N 2.77Å; V201-F205 HydrophobicContact CG1-CD2 3.73Å; V201-F205 HydrophobicContact CG1-CE2 3.42Å; V201-F205 VanDerWaalsContact CG1-CE2 3.42Å; V201-F205 VanDerWaalsContact O-CD2 3.22Å; V201-F205 WeakPolarHBondContact O-CD2 3.23Å; V201-F205 PolarHBondContact O-N 2.98Å; V201-V703 HydrophobicContact CG2-CG1 3.94Å; V201-V703 HydrophobicContact CG2-CG2 4.24Å
202	I	93.9	Very high	90	Very high	64 Å²	64	40.6 Å²	40.6	33%	0.328	21%	0.205	S	C	.	.	H	α-helix	trans	-59.6	-44.1	174.2	-66.6	169.6	0	0	0	110.4	L156 I198 F199 L204 F205 L206	L156-I202 HydrophobicContact CD1-CG2 4.43Å; I198-I202 HydrophobicContact CG2-CD1 4.03Å; I198-I202 WeakPolarHBondContact O-CG1 3.34Å; I198-I202 PolarHBondContact O-N 2.81Å; F199-I202 WeakPolarHBondContact O-CB 3.39Å; F199-I202 PolarHBondContact O-N 3.48Å; I202-L204 VanDerWaalsContact C-N 3.32Å; I202-L204 PolarHBondContact O-N 3.35Å; I202-F205 PolarHBondContact O-N 3.32Å; I202-L206 HydrophobicContact CG2-CD1 3.75Å; I202-L206 HydrophobicContact CG2-CG 4.13Å; I202-L206 WeakPolarHBondContact O-CB 3.43Å; I202-L206 VanDerWaalsContact O-CG 3.3Å; I202-L206 WeakPolarHBondContact O-CG 3.3Å; I202-L206 PolarHBondContact O-N 2.85Å
203	Y	93.8	Very high	90.3	Very high	1 Å²	1	43.2 Å²	43.2	0%	0.004	22%	0.215	C	C	.	.	H	α-helix	trans	-63.5	-37.3	179.4	-77.1	14.1	0	0	0	112.2	V153 L156 S157 F199 A200 V201 L206 T207 M622 S625 I626	V153-Y203 HydrophobicContact CB-CE2 4.46Å; V153-Y203 HydrophobicContact CG1-CD2 4.33Å; V153-Y203 HydrophobicContact CG1-CE2 3.64Å; V153-Y203 HydrophobicContact CG2-CD1 4.24Å; V153-Y203 HydrophobicContact CG2-CD2 4.35Å; V153-Y203 HydrophobicContact CG2-CE1 4.16Å; V153-Y203 HydrophobicContact CG2-CE2 4.28Å; V153-Y203 HydrophobicContact CG2-CG 4.34Å; V153-Y203 PolarHBondContact O-OH 2.96Å; V153-Y203 VanDerWaalsContact O-OH 3.12Å; L156-Y203 HydrophobicContact CB-CE1 4.08Å; L156-Y203 HydrophobicContact CD1-CD1 4.49Å; L156-Y203 HydrophobicContact CD1-CE1 3.82Å; S157-Y203 PolarHBondContact N-OH 2.81Å; S157-Y203 PolarHBondContact OG-OH 3.04Å; F199-Y203 HydrophobicContact CD1-CE1 4.31Å; F199-Y203 VanDerWaalsContact O-CD1 3.29Å; F199-Y203 WeakPolarHBondContact O-CD1 3.38Å; F199-Y203 PolarHBondContact O-N 3.37Å; A200-Y203 PolarHBondContact O-N 3.23Å; V201-Y203 VanDerWaalsContact C-N 3.32Å; V201-Y203 PolarHBondContact O-N 2.69Å; Y203-L206 HydrophobicContact CD1-CD1 4.46Å; Y203-T207 WeakPolarHBondContact O-CB 3.48Å; Y203-T207 PolarHBondContact O-N 3.2Å; Y203-T207 PolarHBondContact O-OG1 3.5Å; Y203-M622 HydrophobicContact CD2-CE 4.02Å; Y203-M622 HydrophobicContact CG-CE 4.3Å; Y203-S625 VanDerWaalsContact CE2-OG 3.28Å; Y203-S625 WeakPolarHBondContact CE2-OG 3.38Å; Y203-I626 HydrophobicContact CD2-CD1 3.92Å; Y203-I626 HydrophobicContact CD2-CG1 4.04Å; Y203-I626 HydrophobicContact CE2-CD1 4.14Å; Y203-I626 HydrophobicContact CE2-CG1 3.76Å
204	L	92.2	Very high	90.6	Very high	23 Å²	23	42.8 Å²	42.8	12%	0.12	21%	0.213	C	C	.	.	H	α-helix	trans	-60.5	-52.7	171.5	178.4	73	0	0	0	111.4	A200 V201 I202 L206 T207 V208 P675 I676 L679 T707	A200-L204 PolarHBondContact O-N 3.37Å; A200-L204 VanDerWaalsContact O-N 3.08Å; V201-L204 WeakPolarHBondContact O-CB 3.33Å; V201-L204 PolarHBondContact O-N 2.77Å; I202-L204 VanDerWaalsContact C-N 3.32Å; I202-L204 PolarHBondContact O-N 3.35Å; L204-L206 PolarHBondContact O-N 3.48Å; L204-T207 PolarHBondContact O-N 3.09Å; L204-V208 WeakPolarHBondContact O-CG2 3.38Å; L204-V208 PolarHBondContact O-N 3.1Å; L204-P675 HydrophobicContact CB-CB 4.28Å; L204-P675 HydrophobicContact CD1-CB 3.98Å; L204-P675 HydrophobicContact CD1-CG 3.88Å; L204-I676 HydrophobicContact CD1-CG1 4.41Å; L204-L679 HydrophobicContact CD2-CD1 4.18Å; L204-T707 HydrophobicContact CD2-CG2 3.41Å; L204-T707 VanDerWaalsContact CD2-CG2 3.41Å
205	F	92.5	Very high	90.4	Very high	146 Å²	146	38.9 Å²	38.9	64%	0.64	20%	0.198	S	C	*	.	H	α-helix	trans	-63.3	-40.9	-179.3	-77.1	-62.2	0	0	0	112.7	V201 I202 V208 G209	V201-F205 HydrophobicContact CG1-CD2 3.73Å; V201-F205 HydrophobicContact CG1-CE2 3.42Å; V201-F205 VanDerWaalsContact CG1-CE2 3.42Å; V201-F205 VanDerWaalsContact O-CD2 3.22Å; V201-F205 WeakPolarHBondContact O-CD2 3.23Å; V201-F205 PolarHBondContact O-N 2.98Å; I202-F205 PolarHBondContact O-N 3.32Å; F205-V208 PolarHBondContact O-N 2.94Å; F205-G209 PolarHBondContact O-N 3.49Å
206	L	93.8	Very high	90	Very high	44 Å²	44	41.9 Å²	41.9	23%	0.23	21%	0.211	C	C	.	.	H	α-helix	trans	-59.3	-49.8	174.3	-73.7	173.5	0	0	0	110.6	L149 V152 L156 I202 Y203 L204 V208 G209 F210	L149-L206 HydrophobicContact CD1-CB 3.9Å; V152-L206 HydrophobicContact CG1-CD1 3.84Å; L156-L206 HydrophobicContact CD1-CD1 4.06Å; I202-L206 HydrophobicContact CG2-CD1 3.75Å; I202-L206 HydrophobicContact CG2-CG 4.13Å; I202-L206 WeakPolarHBondContact O-CB 3.43Å; I202-L206 VanDerWaalsContact O-CG 3.3Å; I202-L206 WeakPolarHBondContact O-CG 3.3Å; I202-L206 PolarHBondContact O-N 2.85Å; Y203-L206 HydrophobicContact CD1-CD1 4.46Å; L204-L206 PolarHBondContact O-N 3.48Å; L206-V208 PolarHBondContact O-N 3.38Å; L206-G209 PolarHBondContact O-N 3.46Å; L206-G209 VanDerWaalsContact O-N 3.16Å; L206-F210 VanDerWaalsContact O-CD2 3.32Å; L206-F210 WeakPolarHBondContact O-CD2 3.38Å; L206-F210 PolarHBondContact O-N 2.86Å
207	T	92.1	Very high	89.4	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.8	-45	-178.9	-54.7	0	0	0	0	111	L149 Y203 L204 G209 F210 M211 L672 P675	L149-T207 HydrophobicContact CD2-CG2 4Å; Y203-T207 WeakPolarHBondContact O-CB 3.48Å; Y203-T207 PolarHBondContact O-N 3.2Å; Y203-T207 PolarHBondContact O-OG1 3.5Å; L204-T207 PolarHBondContact O-N 3.09Å; T207-G209 VanDerWaalsContact C-N 3.34Å; T207-G209 PolarHBondContact O-N 2.83Å; T207-F210 PolarHBondContact O-N 2.77Å; T207-M211 HydrophobicContact CG2-CG 4.22Å; T207-M211 VanDerWaalsContact O-CB 3.27Å; T207-M211 WeakPolarHBondContact O-CB 3.42Å; T207-M211 WeakPolarHBondContact O-CG 3.41Å; T207-M211 PolarHBondContact O-N 2.9Å; T207-L672 HydrophobicContact CG2-CD2 4.33Å; T207-P675 HydrophobicContact CG2-CG 4.04Å
208	V	90.9	Very high	88.9	Confident	58 Å²	58	44.2 Å²	44.2	35%	0.352	23%	0.227	S	C	.	.	H	α-helix	trans	-59.7	-43.9	174.9	171.9	0	0	0	0	111.5	L204 F205 L206 R212 L672	L204-V208 WeakPolarHBondContact O-CG2 3.38Å; L204-V208 PolarHBondContact O-N 3.1Å; F205-V208 PolarHBondContact O-N 2.94Å; L206-V208 PolarHBondContact O-N 3.38Å; V208-R212 VanDerWaalsContact O-CB 3.24Å; V208-R212 WeakPolarHBondContact O-CB 3.15Å; V208-R212 PolarHBondContact O-N 3.12Å; V208-L672 HydrophobicContact CB-CD2 4.46Å; V208-L672 HydrophobicContact CG2-CD2 3.86Å
209	G	90.4	Very high	87.9	Confident	40 Å²	40	46.5 Å²	46.5	41%	0.412	23%	0.234	S	C	.	.	H	α-helix	trans	-62.4	-49.6	178.9	0	0	0	0	0	113.1	F205 L206 T207 R212 H213	F205-G209 PolarHBondContact O-N 3.49Å; L206-G209 PolarHBondContact O-N 3.46Å; L206-G209 VanDerWaalsContact O-N 3.16Å; T207-G209 VanDerWaalsContact C-N 3.34Å; T207-G209 PolarHBondContact O-N 2.83Å; G209-R212 PolarHBondContact O-N 3.27Å; G209-H213 PolarHBondContact O-N 3.35Å
210	F	92.3	Very high	86.7	Confident	52 Å²	52	46.7 Å²	46.7	23%	0.228	23%	0.234	C	C	.	.	H	α-helix	trans	-65.4	-42	178.2	-86.2	-82.6	0	0	0	112.3	F148 L149 V152 L206 T207 R212 H213 H214	F148-F210 HydrophobicContact CB-CD1 4.36Å; F148-F210 HydrophobicContact CB-CE1 3.65Å; F148-F210 HydrophobicContact CB-CZ 4.28Å; L149-F210 HydrophobicContact CB-CD2 4.22Å; L149-F210 HydrophobicContact CB-CG 4.2Å; L149-F210 HydrophobicContact CD1-CD2 3.81Å; L149-F210 HydrophobicContact CD1-CE2 4.34Å; L149-F210 HydrophobicContact CD1-CG 4.46Å; V152-F210 HydrophobicContact CG2-CZ 4.5Å; L206-F210 VanDerWaalsContact O-CD2 3.32Å; L206-F210 WeakPolarHBondContact O-CD2 3.38Å; L206-F210 PolarHBondContact O-N 2.86Å; T207-F210 PolarHBondContact O-N 2.77Å; F210-R212 VanDerWaalsContact C-N 3.35Å; F210-H213 PolarHBondContact O-N 3.08Å; F210-H214 PolarHBondContact O-N 3.26Å
211	M	89.8	Confident	85.3	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-65	-39	176.7	-72.2	-54.3	100.3	0	0	111.7	F142 I146 T207 H214 T215 V668 A671 L672	F142-M211 HydrophobicContact CD2-SD 4.47Å; F142-M211 HydrophobicContact CE2-CE 4.32Å; F142-M211 HydrophobicContact CE2-SD 3.69Å; F142-M211 HydrophobicContact CZ-SD 4.48Å; I146-M211 HydrophobicContact CG1-CE 4.22Å; T207-M211 HydrophobicContact CG2-CG 4.22Å; T207-M211 VanDerWaalsContact O-CB 3.27Å; T207-M211 WeakPolarHBondContact O-CB 3.42Å; T207-M211 WeakPolarHBondContact O-CG 3.41Å; T207-M211 PolarHBondContact O-N 2.9Å; M211-H214 PolarHBondContact O-N 3.47Å; M211-T215 PolarHBondContact O-N 3.4Å; M211-T215 PolarHBondContact O-OG1 2.56Å; M211-V668 HydrophobicContact CB-CG1 3.96Å; M211-V668 HydrophobicContact CG-CG1 4.31Å; M211-V668 HydrophobicContact SD-CG1 4.32Å; M211-V668 HydrophobicContact SD-CG2 4.46Å; M211-A671 HydrophobicContact CG-CB 4.44Å; M211-A671 HydrophobicContact SD-CB 3.8Å; M211-L672 HydrophobicContact CB-CD2 4.05Å; M211-L672 HydrophobicContact CB-CG 4.48Å; M211-L672 HydrophobicContact CG-CD2 3.98Å; M211-L672 HydrophobicContact CG-CG 4.3Å
212	R	86.6	Confident	83.8	Confident	86 Å²	86	54.9 Å²	54.9	33%	0.325	27%	0.268	S	S	.	.	H	α-helix	trans	-62.5	-45.6	173.3	-179.8	171.7	-179.9	-175	2.4	112.8	V208 G209 F210 H214 T215 Q216 P725	V208-R212 VanDerWaalsContact O-CB 3.24Å; V208-R212 WeakPolarHBondContact O-CB 3.15Å; V208-R212 PolarHBondContact O-N 3.12Å; G209-R212 PolarHBondContact O-N 3.27Å; F210-R212 VanDerWaalsContact C-N 3.35Å; R212-H214 VanDerWaalsContact C-N 3.32Å; R212-H214 PolarHBondContact O-N 2.88Å; R212-T215 PolarHBondContact O-N 3.04Å; R212-Q216 VanDerWaalsContact O-CG 3.31Å; R212-Q216 WeakPolarHBondContact O-CG 3.39Å; R212-Q216 PolarHBondContact O-N 2.85Å; R212-P725 VanDerWaalsContact CA-CB 3.45Å; R212-P725 HydrophobicContact CB-CB 3.82Å; R212-P725 HydrophobicContact CG-CB 4.21Å
213	H	87.9	Confident	82.3	Confident	113 Å²	113	56.3 Å²	56.3	52%	0.523	27%	0.273	S	S	.	.	H	α-helix	trans	-59.3	-45.5	175.7	-177.8	-88.5	0	0	0	111.3	H145 G209 F210 T215 Q216 S217	H145-H213 AromaticContact CD2-ND1 3.57Å; H145-H213 AromaticContact NE2-CE1 3.68Å; H145-H213 AromaticContact NE2-ND1 2.98Å; H145-H213 PolarHBondContact NE2-ND1 2.83Å; G209-H213 PolarHBondContact O-N 3.35Å; F210-H213 PolarHBondContact O-N 3.08Å; H213-T215 PolarHBondContact O-N 3.09Å; H213-Q216 PolarHBondContact O-N 3.29Å; H213-S217 PolarHBondContact O-N 3.47Å; H213-S217 VanDerWaalsContact O-N 3.1Å
214	H	87.3	Confident	80.6	Confident	0 Å²	0	60 Å²	60	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-58.5	-50.4	176.5	176	62.8	0	0	0	111.7	F142 H145 F210 M211 R212 Q216 S217 I218	F142-H214 WeakPolarHBondContact CA-CE1 3.41Å; F142-H214 AromaticContact CD2-CD2 3.62Å; F142-H214 AromaticContact CD2-NE2 3.56Å; F142-H214 PolarHBondContact N-CE1 3.37Å; F142-H214 VanDerWaalsContact N-CE1 3.3Å; H145-H214 HydrophobicContact CB-CB 4.19Å; H145-H214 AromaticContact CE1-ND1 3.68Å; H145-H214 AromaticContact CG-ND1 3.98Å; H145-H214 AromaticContact ND1-CG 3.99Å; H145-H214 AromaticContact ND1-ND1 3.39Å; H145-H214 PolarHBondContact ND1-ND1 3.44Å; F210-H214 PolarHBondContact O-N 3.26Å; M211-H214 PolarHBondContact O-N 3.47Å; R212-H214 VanDerWaalsContact C-N 3.32Å; R212-H214 PolarHBondContact O-N 2.88Å; H214-Q216 VanDerWaalsContact C-N 3.28Å; H214-Q216 PolarHBondContact O-N 2.85Å; H214-S217 WeakPolarHBondContact O-CA 3.18Å; H214-S217 WeakPolarHBondContact O-CB 3.37Å; H214-S217 PolarHBondContact O-N 2.77Å; H214-S217 PolarHBondContact O-OG 3.12Å; H214-I218 PolarHBondContact O-N 3.36Å
215	T	83.3	Confident	79.3	Confident	0 Å²	0	62 Å²	62	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-64.6	-32.7	-177.8	-50.4	0	0	0	0	113	M211 R212 H213 S217 I218 F665 P725	M211-T215 PolarHBondContact O-N 3.4Å; M211-T215 PolarHBondContact O-OG1 2.56Å; R212-T215 PolarHBondContact O-N 3.04Å; H213-T215 PolarHBondContact O-N 3.09Å; T215-S217 VanDerWaalsContact C-N 3.28Å; T215-S217 PolarHBondContact O-N 2.77Å; T215-I218 PolarHBondContact O-N 3.37Å; T215-F665 HydrophobicContact CG2-CD1 3.93Å; T215-F665 HydrophobicContact CG2-CE1 3.43Å; T215-F665 VanDerWaalsContact CG2-CE1 3.43Å; T215-P725 WeakPolarHBondContact CB-O 3.32Å; T215-P725 WeakPolarHBondContact CG2-O 3.46Å
216	Q	81.6	Confident	78.4	Confident	110 Å²	110	56.4 Å²	56.4	51%	0.514	28%	0.281	S	S	.	.	H	α-helix	trans	-68.6	-26.6	172.4	-71.8	176.7	-17.8	0	0	113.1	R212 H213 H214	R212-Q216 VanDerWaalsContact O-CG 3.31Å; R212-Q216 WeakPolarHBondContact O-CG 3.39Å; R212-Q216 PolarHBondContact O-N 2.85Å; H213-Q216 PolarHBondContact O-N 3.29Å; H214-Q216 VanDerWaalsContact C-N 3.28Å; H214-Q216 PolarHBondContact O-N 2.85Å
217	S	76.8	Confident	77.6	Confident	54 Å²	54	57 Å²	57	38%	0.378	28%	0.281	S	S	.	.	H	α-helix	trans	-78	-19.8	177.9	77.6	0	0	0	0	113.8	H213 H214 T215 K219	H213-S217 PolarHBondContact O-N 3.47Å; H213-S217 VanDerWaalsContact O-N 3.1Å; H214-S217 WeakPolarHBondContact O-CA 3.18Å; H214-S217 WeakPolarHBondContact O-CB 3.37Å; H214-S217 PolarHBondContact O-N 2.77Å; H214-S217 PolarHBondContact O-OG 3.12Å; T215-S217 VanDerWaalsContact C-N 3.28Å; T215-S217 PolarHBondContact O-N 2.77Å; S217-K219 PolarHBondContact O-N 3.39Å
218	I	76.4	Confident	77.3	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.01	30%	0.296	C	S	.	.			trans	-72.4	117.2	178.7	-65.2	175.9	0	0	0	109.1	H214 T215 Y220 H664	H214-I218 PolarHBondContact O-N 3.36Å; T215-I218 PolarHBondContact O-N 3.37Å; I218-Y220 HydrophobicContact CG2-CD2 3.43Å; I218-Y220 VanDerWaalsContact CG2-CD2 3.43Å; I218-Y220 HydrophobicContact CG2-CE2 3.33Å; I218-H664 HydrophobicContact CD1-CB 4.41Å
219	K	70.5	Confident	77.3	Confident	132 Å²	132	58.4 Å²	58.4	57%	0.574	28%	0.28	S	S	*	.			trans	-113.6	115.4	172.7	-65.6	-171.7	176.7	-160	0	108.6	S217 E731	S217-K219 PolarHBondContact O-N 3.39Å; K219-E731 IonicContact NZ-OE1 2.71Å; K219-E731 PolarHBondContact NZ-OE1 3.4Å; K219-E731 VanDerWaalsContact NZ-OE1 3.15Å
220	Y	67.1	Low	77.4	Confident	25 Å²	25	56.5 Å²	56.5	10%	0.098	26%	0.26	C	S	.	.			trans	-100.4	125.5	174.6	-89.2	-75.5	0	0	0	110.2	D135 H138 I218 E222 K661 H664	D135-Y220 PolarHBondContact OD1-OH 3.32Å; H138-Y220 AromaticContact CE1-CE1 3.71Å; H138-Y220 AromaticContact CE1-CE2 3.82Å; H138-Y220 AromaticContact CE1-CZ 3.55Å; H138-Y220 AromaticContact ND1-CE1 3.78Å; H138-Y220 AromaticContact ND1-CE2 3.89Å; H138-Y220 AromaticContact ND1-CZ 3.36Å; H138-Y220 PolarHBondContact ND1-OH 3.02Å; I218-Y220 HydrophobicContact CG2-CD2 3.43Å; I218-Y220 VanDerWaalsContact CG2-CD2 3.43Å; I218-Y220 HydrophobicContact CG2-CE2 3.33Å; Y220-E222 PolarHBondContact O-N 3.04Å; Y220-K661 HydrophobicContact CD2-CB 3.86Å; Y220-K661 HydrophobicContact CE1-CB 4.21Å; Y220-K661 HydrophobicContact CE2-CB 3.45Å; Y220-K661 VanDerWaalsContact CE2-CB 3.45Å; Y220-K661 HydrophobicContact CG-CB 4.38Å; Y220-H664 PolarHBondContact OH-CD2 2.84Å; Y220-H664 PolarHBondContact OH-NE2 3.09Å
221	K	60.9	Low	77.4	Confident	166 Å²	166	55.1 Å²	55.1	72%	0.722	25%	0.254	S	S	*	.			trans	-82.8	106.2	168.2	-166.8	175.1	-178.4	179.8	0	108.1
222	E	60.2	Low	77.6	Confident	36 Å²	36	55.1 Å²	55.1	17%	0.168	25%	0.254	C	S	.	.			trans	-79.8	127.4	-177.8	-70.5	179.3	157.9	0	0	111.1	Y220 R227 K661 Y728 T730	Y220-E222 PolarHBondContact O-N 3.04Å; E222-R227 VanDerWaalsContact CD-CZ 3.42Å; E222-R227 VanDerWaalsContact CD-NH1 3.31Å; E222-R227 IonicContact OE1-CZ 2.53Å; E222-R227 VanDerWaalsContact OE1-CZ 3.25Å; E222-R227 IonicContact OE1-NE 3.38Å; E222-R227 IonicContact OE1-NH1 2.59Å; E222-R227 PolarHBondContact OE1-NH1 2.89Å; E222-R227 IonicContact OE1-NH2 3.33Å; E222-R227 PolarHBondContact OE1-NH2 2.88Å; E222-R227 IonicContact OE2-CZ 2.82Å; E222-R227 IonicContact OE2-NE 2.74Å; E222-R227 IonicContact OE2-NH1 3.66Å; E222-R227 PolarHBondContact OE2-NH1 3.35Å; E222-R227 IonicContact OE2-NH2 3.43Å; E222-K661 IonicContact OE1-NZ 3Å; E222-Y728 PolarHBondContact OE1-OH 3.42Å; E222-T730 VanDerWaalsContact OE2-CG2 3.31Å; E222-T730 WeakPolarHBondContact OE2-CG2 3.38Å
223	E	62.8	Low	77.8	Confident	95 Å²	95	52.3 Å²	52.3	44%	0.444	25%	0.246	S	C	.	.			trans	-75	130.9	175.5	-73.1	-176.5	-173.8	0	0	111.9	L225 V226 K658	E223-L225 PolarHBondContact O-N 2.96Å; E223-V226 HydrophobicContact CB-CG2 4.4Å; E223-K658 WeakPolarHBondContact OE1-CE 3.24Å; E223-K658 IonicContact OE1-NZ 3.56Å; E223-K658 PolarHBondContact OE1-NZ 3.36Å; E223-K658 IonicContact OE2-NZ 2.7Å; E223-K658 PolarHBondContact OE2-NZ 3.35Å
224	N	58.4	Low	77.8	Confident	77 Å²	77	48.8 Å²	48.8	41%	0.412	24%	0.24	S	C	.	.	H	α-helix	trans	-61	-31.1	-177.8	-82.5	-31.6	0	0	0	113.3	R228	N224-R228 WeakPolarHBondContact O-CD 3.38Å; N224-R228 WeakPolarHBondContact O-CG 3.35Å; N224-R228 PolarHBondContact O-N 3.13Å
225	L	63.7	Low	78	Confident	65 Å²	65	49.2 Å²	49.2	34%	0.34	24%	0.243	S	C	.	.	H	α-helix	trans	-68.2	-42.5	-175.1	-177.7	69.1	0	0	0	113	E223 R227 R228 T229 P751	E223-L225 PolarHBondContact O-N 2.96Å; L225-R227 VanDerWaalsContact C-N 3.35Å; L225-R227 PolarHBondContact O-N 3.44Å; L225-R228 PolarHBondContact O-N 2.68Å; L225-T229 PolarHBondContact O-N 2.86Å; L225-T229 PolarHBondContact O-OG1 3.29Å; L225-P751 HydrophobicContact CD1-CG 3.8Å; L225-P751 HydrophobicContact CD2-CB 3.6Å; L225-P751 HydrophobicContact CD2-CG 3.62Å; L225-P751 HydrophobicContact CG-CG 4.14Å
226	V	74.3	Confident	78.4	Confident	29 Å²	29	50.8 Å²	50.8	18%	0.176	25%	0.252	C	S	.	.	H	α-helix	trans	-63.8	-41.2	-178	-179.8	0	0	0	0	110.8	E223 R228 T229 A400 D402	E223-V226 HydrophobicContact CB-CG2 4.4Å; V226-R228 VanDerWaalsContact C-N 3.29Å; V226-R228 PolarHBondContact O-N 3.47Å; V226-T229 PolarHBondContact O-N 3.46Å; V226-A400 WeakPolarHBondContact CG1-O 3.46Å; V226-D402 HydrophobicContact CG2-CB 4.45Å
227	R	76.6	Confident	78.6	Confident	58 Å²	58	54.7 Å²	54.7	22%	0.219	26%	0.262	C	S	.	.	H	α-helix	trans	-79.7	-10.3	-179	-50.7	-167.4	102.3	173.5	24.5	113.9	E222 L225 K357 A360 F399	E222-R227 VanDerWaalsContact CD-CZ 3.42Å; E222-R227 VanDerWaalsContact CD-NH1 3.31Å; E222-R227 IonicContact OE1-CZ 2.53Å; E222-R227 VanDerWaalsContact OE1-CZ 3.25Å; E222-R227 IonicContact OE1-NE 3.38Å; E222-R227 IonicContact OE1-NH1 2.59Å; E222-R227 PolarHBondContact OE1-NH1 2.89Å; E222-R227 IonicContact OE1-NH2 3.33Å; E222-R227 PolarHBondContact OE1-NH2 2.88Å; E222-R227 IonicContact OE2-CZ 2.82Å; E222-R227 IonicContact OE2-NE 2.74Å; E222-R227 IonicContact OE2-NH1 3.66Å; E222-R227 PolarHBondContact OE2-NH1 3.35Å; E222-R227 IonicContact OE2-NH2 3.43Å; L225-R227 VanDerWaalsContact C-N 3.35Å; L225-R227 PolarHBondContact O-N 3.44Å; R227-K357 HydrophobicContact CB-CB 4.43Å; R227-K357 HydrophobicContact CB-CD 3.84Å; R227-K357 HydrophobicContact CB-CG 3.79Å; R227-A360 WeakPolarHBondContact O-CB 3.4Å; R227-F399 WeakPolarHBondContact O-CE1 3.44Å
228	R	86.8	Confident	79	Confident	87 Å²	87	58.1 Å²	58.1	33%	0.328	28%	0.277	S	S	.	.	H	α-helix	trans	-91.4	-13.2	173.7	-74.2	173.7	-166	-158.5	11.4	112.8	N224 L225 V226 F354 Q355 K357	N224-R228 WeakPolarHBondContact O-CD 3.38Å; N224-R228 WeakPolarHBondContact O-CG 3.35Å; N224-R228 PolarHBondContact O-N 3.13Å; L225-R228 PolarHBondContact O-N 2.68Å; V226-R228 VanDerWaalsContact C-N 3.29Å; V226-R228 PolarHBondContact O-N 3.47Å; R228-F354 WeakPolarHBondContact O-CD2 3.37Å; R228-F354 PolarHBondContact O-N 3.25Å; R228-Q355 WeakPolarHBondContact CD-O 3.21Å; R228-Q355 PolarHBondContact NH1-O 2.88Å; R228-K357 HydrophobicContact CG-CB 4.21Å
229	T	90.3	Very high	79.6	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	132.1	-176.6	-52.4	0	0	0	0	111.1	L225 V226 F351 V352 T353 A400 Y752	L225-T229 PolarHBondContact O-N 2.86Å; L225-T229 PolarHBondContact O-OG1 3.29Å; V226-T229 PolarHBondContact O-N 3.46Å; T229-F351 HydrophobicContact CG2-CB 4.13Å; T229-F351 HydrophobicContact CG2-CD1 4.45Å; T229-V352 CarbonylContact C-O 3.59Å; T229-V352 WeakPolarHBondContact CA-O 3.34Å; T229-V352 WeakPolarHBondContact CG2-O 3.47Å; T229-T353 WeakPolarHBondContact CG2-OG1 3.34Å; T229-T353 PolarHBondContact OG1-OG1 3.5Å; T229-A400 HydrophobicContact CG2-CB 3.81Å; T229-A400 PolarHBondContact O-N 2.81Å; T229-Y752 HydrophobicContact CG2-CD2 3.79Å; T229-Y752 HydrophobicContact CG2-CE2 3.52Å; T229-Y752 HydrophobicContact CG2-CG 4.46Å; T229-Y752 WeakPolarHBondContact OG1-CE2 3.14Å
230	L	91.8	Very high	80.5	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	136.3	173.1	-62.4	-178.4	0	0	0	110.1	I232 F351 V352 F354 A360 I363 L364 V397 T398 F399	L230-I232 HydrophobicContact CB-CG1 4.5Å; L230-F351 WeakPolarHBondContact O-CA 3.34Å; L230-V352 PolarHBondContact N-O 3Å; L230-V352 PolarHBondContact O-N 2.63Å; L230-F354 HydrophobicContact CB-CE2 4.23Å; L230-F354 HydrophobicContact CD1-CD2 4.4Å; L230-F354 HydrophobicContact CD1-CE2 3.58Å; L230-F354 HydrophobicContact CD1-CZ 4.22Å; L230-F354 HydrophobicContact CG-CD2 4.31Å; L230-F354 HydrophobicContact CG-CE2 3.78Å; L230-A360 HydrophobicContact CD1-CB 4.48Å; L230-A360 HydrophobicContact CD2-CB 4.04Å; L230-A360 HydrophobicContact CG-CB 4.07Å; L230-I363 HydrophobicContact CD1-CB 3.95Å; L230-I363 HydrophobicContact CD1-CG2 3.64Å; L230-L364 HydrophobicContact CD2-CB 4.33Å; L230-V397 HydrophobicContact CB-CG1 4.16Å; L230-V397 HydrophobicContact CD1-CG1 3.88Å; L230-V397 HydrophobicContact CD2-CG1 4.29Å; L230-V397 HydrophobicContact CG-CG1 4.34Å; L230-T398 CarbonylContact C-O 3.6Å; L230-T398 WeakPolarHBondContact CA-O 3.17Å; L230-F399 HydrophobicContact CD2-CD1 3.89Å; L230-F399 HydrophobicContact CD2-CE1 4.1Å
231	F	92.8	Very high	81.6	Confident	23 Å²	23	62.9 Å²	62.9	10%	0.101	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	121.5	168.6	178.4	-123.8	0	0	0	108.7	T233 M349 F351 T398 A400 W493	F231-T233 HydrophobicContact CD1-CG2 4.14Å; F231-T233 HydrophobicContact CE1-CG2 3.45Å; F231-T233 VanDerWaalsContact CE1-CG2 3.45Å; F231-T233 HydrophobicContact CE2-CG2 4.28Å; F231-T233 HydrophobicContact CZ-CG2 3.54Å; F231-M349 HydrophobicContact CE2-CB 4.01Å; F231-M349 HydrophobicContact CE2-SD 4.16Å; F231-M349 HydrophobicContact CZ-CB 4.39Å; F231-M349 HydrophobicContact CZ-CG 4.45Å; F231-M349 HydrophobicContact CZ-SD 3.69Å; F231-F351 HydrophobicContact CB-CD1 4.15Å; F231-F351 HydrophobicContact CB-CE1 3.97Å; F231-F351 AromaticContact CD2-CD1 3.77Å; F231-F351 HydrophobicContact CD2-CD1 3.77Å; F231-F351 AromaticContact CD2-CE1 3.27Å; F231-F351 HydrophobicContact CD2-CE1 3.27Å; F231-F351 HydrophobicContact CD2-CE2 4.23Å; F231-F351 HydrophobicContact CD2-CG 4.42Å; F231-F351 AromaticContact CD2-CZ 3.52Å; F231-F351 HydrophobicContact CD2-CZ 3.52Å; F231-F351 AromaticContact CE2-CE1 3.97Å; F231-F351 HydrophobicContact CE2-CE1 3.97Å; F231-F351 HydrophobicContact CE2-CE2 4.27Å; F231-F351 AromaticContact CE2-CZ 3.71Å; F231-F351 HydrophobicContact CE2-CZ 3.71Å; F231-F351 HydrophobicContact CG-CD1 4.38Å; F231-F351 AromaticContact CG-CE1 3.86Å; F231-F351 HydrophobicContact CG-CE1 3.86Å; F231-F351 HydrophobicContact CG-CZ 4.42Å; F231-T398 PolarHBondContact N-O 3.42Å; F231-T398 PolarHBondContact O-N 2.94Å; F231-A400 HydrophobicContact CB-CB 4.19Å; F231-W493 HydrophobicContact CE1-CE3 4.35Å; F231-W493 HydrophobicContact CE1-CZ3 4.4Å
232	I	93.5	Very high	83	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	129	-174.9	-50.6	177.8	0	0	0	108.3	L230 L235 F248 M349 A350 V352 W395 V397	L230-I232 HydrophobicContact CB-CG1 4.5Å; I232-L235 HydrophobicContact CB-CD1 3.9Å; I232-L235 HydrophobicContact CG2-CD1 3.51Å; I232-L235 HydrophobicContact CG2-CG 4.5Å; I232-F248 HydrophobicContact CD1-CE2 3.81Å; I232-F248 HydrophobicContact CD1-CZ 3.5Å; I232-M349 CarbonylContact O-C 3.56Å; I232-M349 VanDerWaalsContact O-CA 3.22Å; I232-M349 WeakPolarHBondContact O-CA 3.18Å; I232-A350 PolarHBondContact N-O 2.97Å; I232-A350 PolarHBondContact O-N 3.31Å; I232-V352 HydrophobicContact CD1-CB 4.37Å; I232-V352 HydrophobicContact CD1-CG2 3.65Å; I232-V352 HydrophobicContact CG1-CG2 4.48Å; I232-W395 HydrophobicContact CD1-CE3 4.39Å; I232-W395 HydrophobicContact CD1-CZ3 4.17Å; I232-W395 HydrophobicContact CG2-CB 4.12Å; I232-W395 HydrophobicContact CG2-CD2 3.72Å; I232-W395 HydrophobicContact CG2-CE3 3.66Å; I232-W395 HydrophobicContact CG2-CG 3.97Å; I232-W395 HydrophobicContact CG2-CZ3 4.26Å; I232-V397 HydrophobicContact CG1-CG1 4.48Å; I232-V397 HydrophobicContact CG1-CG2 4.37Å; I232-V397 HydrophobicContact CG2-CG2 4.31Å
233	T	91.6	Very high	84.5	Confident	27 Å²	27	59.6 Å²	59.6	17%	0.166	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	154.3	174.5	61.9	0	0	0	0	110.4	F231 M349 W395 T396 W493	F231-T233 HydrophobicContact CD1-CG2 4.14Å; F231-T233 HydrophobicContact CE1-CG2 3.45Å; F231-T233 VanDerWaalsContact CE1-CG2 3.45Å; F231-T233 HydrophobicContact CE2-CG2 4.28Å; F231-T233 HydrophobicContact CZ-CG2 3.54Å; T233-M349 HydrophobicContact CG2-CG 4Å; T233-M349 HydrophobicContact CG2-SD 4.11Å; T233-W395 VanDerWaalsContact O-CA 3.3Å; T233-W395 WeakPolarHBondContact O-CA 3.4Å; T233-T396 PolarHBondContact N-O 3.41Å; T233-T396 PolarHBondContact O-N 2.93Å; T233-T396 WeakPolarHBondContact OG1-CB 3.08Å; T233-T396 PolarHBondContact OG1-O 3.49Å; T233-W493 HydrophobicContact CG2-CZ3 4.45Å
234	G	88.1	Confident	85.9	Confident	38 Å²	38	55.1 Å²	55.1	39%	0.392	26%	0.263	S	S	.	.			trans	91.3	18.3	-178.5	0	0	0	0	0	114.1	G348	G234-G348 PolarHBondContact N-O 2.95Å; G234-G348 VanDerWaalsContact N-O 3.15Å
235	L	91.2	Very high	87.5	Confident	10 Å²	10	53.8 Å²	53.8	5%	0.052	26%	0.255	C	S	.	.			trans	-69.3	146.3	169.1	-71.3	87.7	0	0	0	110.1	I232 A239 V244 L262 G348 A350 W395	I232-L235 HydrophobicContact CB-CD1 3.9Å; I232-L235 HydrophobicContact CG2-CD1 3.51Å; I232-L235 HydrophobicContact CG2-CG 4.5Å; L235-A239 HydrophobicContact CB-CB 4.42Å; L235-A239 HydrophobicContact CD2-CB 4.28Å; L235-V244 HydrophobicContact CD2-CG2 3.69Å; L235-L262 HydrophobicContact CD2-CD2 4.43Å; L235-G348 PolarHBondContact N-O 3.49Å; L235-G348 VanDerWaalsContact O-CA 3.26Å; L235-G348 WeakPolarHBondContact O-CA 3.38Å; L235-A350 HydrophobicContact CD1-CB 4.13Å; L235-A350 HydrophobicContact CD2-CB 4Å; L235-W395 HydrophobicContact CD2-CZ2 4.2Å; L235-W395 HydrophobicContact CG-CZ2 3.93Å
236	P	90.8	Very high	88.9	Confident	32 Å²	32	52.2 Å²	52.2	21%	0.208	25%	0.249	C	C	.	.			trans	-67.3	150	171.8	33.5	-36	0	0	0	109.5	D238 A239 L390	P236-D238 WeakPolarHBondContact CB-OD1 3.3Å; P236-D238 PolarHBondContact O-N 2.72Å; P236-A239 HydrophobicContact CG-CB 4.12Å; P236-A239 WeakPolarHBondContact O-CB 3.48Å; P236-A239 PolarHBondContact O-N 3.15Å; P236-A239 VanDerWaalsContact O-N 3.13Å; P236-L390 WeakPolarHBondContact CD-O 3.24Å; P236-L390 HydrophobicContact CG-CD2 4.41Å
237	R	85.8	Confident	89.7	Confident	192 Å²	192	50.8 Å²	50.8	73%	0.725	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-24.2	-170.1	-74.3	-173.8	-178.9	179.7	-0.2	113.2	A239 P346	R237-A239 VanDerWaalsContact C-N 3.31Å; R237-P346 HydrophobicContact CB-CG 4.05Å; R237-P346 WeakPolarHBondContact O-CB 3.49Å; R237-P346 WeakPolarHBondContact O-CG 3.35Å
238	D	86.5	Confident	90.5	Very high	126 Å²	126	48 Å²	48	67%	0.674	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.1	1.3	175.9	56.3	-31.2	0	0	0	113.7	P236 R240	P236-D238 WeakPolarHBondContact CB-OD1 3.3Å; P236-D238 PolarHBondContact O-N 2.72Å; D238-R240 PolarHBondContact O-N 3.34Å
239	A	87.9	Confident	90.7	Very high	16 Å²	16	51.3 Å²	51.3	13%	0.132	24%	0.242	C	C	.	.			trans	-60.9	129.7	178.2	0	0	0	0	0	111.7	L235 P236 R237 L262 L390	L235-A239 HydrophobicContact CB-CB 4.42Å; L235-A239 HydrophobicContact CD2-CB 4.28Å; P236-A239 HydrophobicContact CG-CB 4.12Å; P236-A239 WeakPolarHBondContact O-CB 3.48Å; P236-A239 PolarHBondContact O-N 3.15Å; P236-A239 VanDerWaalsContact O-N 3.13Å; R237-A239 VanDerWaalsContact C-N 3.31Å; A239-L262 WeakPolarHBondContact O-CD1 3.31Å; A239-L390 HydrophobicContact CB-CD2 3.94Å
240	R	89.7	Confident	90.8	Very high	177 Å²	177	55.3 Å²	55.3	67%	0.668	26%	0.264	S	S	*	.			trans	-100.1	158.4	174.1	-57.6	-174.6	-177	-179.6	0.6	111.4	D238 E242 T243 V244	D238-R240 PolarHBondContact O-N 3.34Å; R240-E242 VanDerWaalsContact C-N 3.27Å; R240-E242 WeakPolarHBondContact CB-OE2 3.27Å; R240-E242 PolarHBondContact O-N 3.32Å; R240-T243 PolarHBondContact O-N 3.31Å; R240-V244 PolarHBondContact O-N 3.35Å
241	K	89.7	Confident	90.7	Very high	67 Å²	67	55.4 Å²	55.4	29%	0.291	27%	0.265	S	S	.	.	H	α-helix	trans	-57.5	-44.7	179.9	-179.8	174.1	175.6	151.4	0	110.7	T243 V244 E245 D259 V260 L262	K241-T243 VanDerWaalsContact C-N 3.33Å; K241-T243 PolarHBondContact O-N 3.43Å; K241-V244 PolarHBondContact O-N 3.23Å; K241-E245 WeakPolarHBondContact CE-OE1 3.38Å; K241-E245 WeakPolarHBondContact O-CG 3.34Å; K241-E245 PolarHBondContact O-N 2.96Å; K241-D259 IonicContact NZ-OD1 2.74Å; K241-D259 PolarHBondContact NZ-OD1 3.31Å; K241-V260 VanDerWaalsContact CD-O 3.29Å; K241-V260 WeakPolarHBondContact CD-O 3.4Å; K241-V260 WeakPolarHBondContact CE-O 3.35Å; K241-V260 HydrophobicContact CG-CB 3.96Å; K241-V260 HydrophobicContact CG-CG1 4.13Å; K241-V260 PolarHBondContact NZ-O 3.03Å; K241-L262 HydrophobicContact CB-CD1 4.46Å
242	E	91.3	Very high	90.7	Very high	116 Å²	116	54.4 Å²	54.4	54%	0.542	26%	0.26	S	S	.	.	H	α-helix	trans	-65.4	-36.7	-176.1	-55.8	75.1	-160.4	0	0	111.9	R240 S246	R240-E242 VanDerWaalsContact C-N 3.27Å; R240-E242 WeakPolarHBondContact CB-OE2 3.27Å; R240-E242 PolarHBondContact O-N 3.32Å; E242-S246 VanDerWaalsContact O-CB 3.32Å; E242-S246 WeakPolarHBondContact O-CB 3.4Å; E242-S246 PolarHBondContact O-N 3.47Å; E242-S246 PolarHBondContact O-OG 3.5Å
243	T	91.6	Very high	90.4	Very high	17 Å²	17	59.5 Å²	59.5	10%	0.104	29%	0.294	C	S	.	.	H	α-helix	trans	-66.7	-40.6	177.5	-46.8	0	0	0	0	111.1	R240 K241 S246 H247 H386 L390	R240-T243 PolarHBondContact O-N 3.31Å; K241-T243 VanDerWaalsContact C-N 3.33Å; K241-T243 PolarHBondContact O-N 3.43Å; T243-S246 PolarHBondContact O-N 3.22Å; T243-H247 PolarHBondContact O-N 3.08Å; T243-H386 HydrophobicContact CG2-CB 4.1Å; T243-L390 HydrophobicContact CG2-CD1 4.14Å; T243-L390 HydrophobicContact CG2-CD2 3.97Å; T243-L390 HydrophobicContact CG2-CG 3.99Å
244	V	91.8	Very high	90.3	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-68.8	-42.8	177.7	177.9	0	0	0	0	111	L235 R240 K241 S246 H247 F248 V260 V352 L390	L235-V244 HydrophobicContact CD2-CG2 3.69Å; R240-V244 PolarHBondContact O-N 3.35Å; K241-V244 PolarHBondContact O-N 3.23Å; V244-S246 VanDerWaalsContact C-N 3.35Å; V244-S246 PolarHBondContact O-N 3.47Å; V244-H247 WeakPolarHBondContact O-CB 3.45Å; V244-H247 PolarHBondContact O-N 3.08Å; V244-F248 HydrophobicContact CG1-CD2 4.02Å; V244-F248 HydrophobicContact CG1-CE2 3.81Å; V244-F248 VanDerWaalsContact O-CD2 3.26Å; V244-F248 WeakPolarHBondContact O-CD2 3.5Å; V244-F248 PolarHBondContact O-N 3.18Å; V244-V260 HydrophobicContact CB-CG1 4.16Å; V244-V260 HydrophobicContact CG1-CG1 3.94Å; V244-V260 HydrophobicContact CG1-CG2 4.42Å; V244-V352 HydrophobicContact CG1-CG2 4.3Å; V244-L390 HydrophobicContact CG2-CD2 4.18Å
245	E	92.4	Very high	90.3	Very high	50 Å²	50	62.1 Å²	62.1	23%	0.234	30%	0.302	C	S	.	.	H	α-helix	trans	-60.8	-43.9	174.4	-73.4	178.7	-176.5	0	0	112	K241 H247 F248 R249 V260	K241-E245 WeakPolarHBondContact CE-OE1 3.38Å; K241-E245 WeakPolarHBondContact O-CG 3.34Å; K241-E245 PolarHBondContact O-N 2.96Å; E245-H247 VanDerWaalsContact C-N 3.33Å; E245-H247 PolarHBondContact O-N 3.46Å; E245-F248 PolarHBondContact O-N 3.49Å; E245-R249 WeakPolarHBondContact O-CB 3.46Å; E245-R249 PolarHBondContact O-N 3.09Å; E245-V260 HydrophobicContact CG-CB 4.09Å; E245-V260 HydrophobicContact CG-CG2 3.5Å
246	S	91.9	Very high	90.3	Very high	31 Å²	31	66.8 Å²	66.8	22%	0.217	32%	0.324	C	S	.	.	H	α-helix	trans	-64.4	-38.8	178.6	-57.1	0	0	0	0	111.5	E242 T243 V244 F248 R249 D250	E242-S246 VanDerWaalsContact O-CB 3.32Å; E242-S246 WeakPolarHBondContact O-CB 3.4Å; E242-S246 PolarHBondContact O-N 3.47Å; E242-S246 PolarHBondContact O-OG 3.5Å; T243-S246 PolarHBondContact O-N 3.22Å; V244-S246 VanDerWaalsContact C-N 3.35Å; V244-S246 PolarHBondContact O-N 3.47Å; S246-F248 PolarHBondContact O-N 3.5Å; S246-R249 PolarHBondContact O-N 3.36Å; S246-D250 WeakPolarHBondContact O-CB 3.17Å; S246-D250 PolarHBondContact O-N 3.3Å
247	H	92.6	Very high	90.3	Very high	0 Å²	0	67 Å²	67	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-56.7	-50.3	173.1	171	61.5	0	0	0	112.6	T243 V244 E245 R249 D250 A251 S384 H386 L390 W395	T243-H247 PolarHBondContact O-N 3.08Å; V244-H247 WeakPolarHBondContact O-CB 3.45Å; V244-H247 PolarHBondContact O-N 3.08Å; E245-H247 VanDerWaalsContact C-N 3.33Å; E245-H247 PolarHBondContact O-N 3.46Å; H247-R249 VanDerWaalsContact C-N 3.35Å; H247-D250 PolarHBondContact O-N 3.33Å; H247-A251 VanDerWaalsContact O-CB 3.28Å; H247-A251 WeakPolarHBondContact O-CB 3.46Å; H247-A251 PolarHBondContact O-N 3.4Å; H247-S384 WeakPolarHBondContact ND1-CB 3.34Å; H247-S384 PolarHBondContact ND1-OG 3.04Å; H247-H386 HydrophobicContact CB-CB 4.36Å; H247-L390 HydrophobicContact CB-CD1 3.55Å; H247-W395 AromaticContact CD2-CH2 3.76Å; H247-W395 AromaticContact CD2-CZ3 3.71Å; H247-W395 AromaticContact NE2-CZ3 3.89Å
248	F	92.9	Very high	90.4	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-67.9	-35.3	-179.4	-78.2	-68.2	0	0	0	112.6	I232 V244 E245 S246 Y252 V257 V352 F354 I363 W395	I232-F248 HydrophobicContact CD1-CE2 3.81Å; I232-F248 HydrophobicContact CD1-CZ 3.5Å; V244-F248 HydrophobicContact CG1-CD2 4.02Å; V244-F248 HydrophobicContact CG1-CE2 3.81Å; V244-F248 VanDerWaalsContact O-CD2 3.26Å; V244-F248 WeakPolarHBondContact O-CD2 3.5Å; V244-F248 PolarHBondContact O-N 3.18Å; E245-F248 PolarHBondContact O-N 3.49Å; S246-F248 PolarHBondContact O-N 3.5Å; F248-Y252 AromaticContact CD1-CD2 3.77Å; F248-Y252 HydrophobicContact CD1-CD2 3.77Å; F248-Y252 HydrophobicContact CD1-CE2 4.1Å; F248-Y252 HydrophobicContact CE1-CD2 4.35Å; F248-Y252 HydrophobicContact CE1-CE2 4.24Å; F248-Y252 CarbonylContact O-C 3.58Å; F248-Y252 WeakPolarHBondContact O-CA 3.37Å; F248-Y252 WeakPolarHBondContact O-CB 3.36Å; F248-Y252 PolarHBondContact O-N 3.3Å; F248-V257 HydrophobicContact CB-CG2 3.63Å; F248-V257 HydrophobicContact CG-CG2 4.3Å; F248-V352 HydrophobicContact CD2-CG1 4.14Å; F248-V352 HydrophobicContact CE2-CB 4.46Å; F248-V352 HydrophobicContact CE2-CG1 4.09Å; F248-V352 HydrophobicContact CE2-CG2 3.95Å; F248-F354 HydrophobicContact CD1-CE1 4.21Å; F248-F354 AromaticContact CD1-CZ 3.98Å; F248-F354 HydrophobicContact CD1-CZ 3.98Å; F248-F354 HydrophobicContact CE1-CZ 4.07Å; F248-F354 HydrophobicContact CG-CE1 4.44Å; F248-F354 HydrophobicContact CG-CZ 4.36Å; F248-F354 HydrophobicContact CZ-CZ 4.49Å; F248-I363 HydrophobicContact CD1-CD1 4.07Å; F248-I363 HydrophobicContact CE1-CD1 4.22Å; F248-I363 HydrophobicContact CE1-CG2 3.99Å; F248-W395 HydrophobicContact CE2-CZ3 4.2Å; F248-W395 AromaticContact CZ-CZ3 3.93Å; F248-W395 HydrophobicContact CZ-CZ3 3.93Å
249	R	91.3	Very high	90.6	Very high	155 Å²	155	57.5 Å²	57.5	59%	0.585	29%	0.291	S	S	*	.	H	α-helix	trans	-64.3	-41.1	175.7	-167.5	-178.6	-61.8	146.5	4.3	112.1	E245 S246 H247	E245-R249 WeakPolarHBondContact O-CB 3.46Å; E245-R249 PolarHBondContact O-N 3.09Å; S246-R249 PolarHBondContact O-N 3.36Å; H247-R249 VanDerWaalsContact C-N 3.35Å
250	D	91.6	Very high	90.7	Very high	84 Å²	84	56.7 Å²	56.7	45%	0.449	29%	0.285	S	S	.	.	H	α-helix	trans	-76.4	-46.4	-179.2	-75.6	4.6	0	0	0	112.3	S246 H247 S385	S246-D250 WeakPolarHBondContact O-CB 3.17Å; S246-D250 PolarHBondContact O-N 3.3Å; H247-D250 PolarHBondContact O-N 3.33Å; D250-S385 PolarHBondContact OD2-OG 3.35Å
251	A	89.8	Confident	90.7	Very high	2 Å²	2	50.6 Å²	50.6	2%	0.017	26%	0.264	C	S	.	.	H	α-helix	trans	-77.9	-28.3	-177.1	0	0	0	0	0	112.9	H247 Q382	H247-A251 VanDerWaalsContact O-CB 3.28Å; H247-A251 WeakPolarHBondContact O-CB 3.46Å; H247-A251 PolarHBondContact O-N 3.4Å; A251-Q382 HydrophobicContact CB-CB 4.16Å; A251-Q382 PolarHBondContact O-OE1 3.23Å
252	Y	92.1	Very high	90.7	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.008	26%	0.255	C	S	.	.			trans	-135.6	69	-174.6	-55	-83.5	0	0	0	111	F248 T254 C255 Y362 I363 D366 F367 Q382	F248-Y252 AromaticContact CD1-CD2 3.77Å; F248-Y252 HydrophobicContact CD1-CD2 3.77Å; F248-Y252 HydrophobicContact CD1-CE2 4.1Å; F248-Y252 HydrophobicContact CE1-CD2 4.35Å; F248-Y252 HydrophobicContact CE1-CE2 4.24Å; F248-Y252 CarbonylContact O-C 3.58Å; F248-Y252 WeakPolarHBondContact O-CA 3.37Å; F248-Y252 WeakPolarHBondContact O-CB 3.36Å; F248-Y252 PolarHBondContact O-N 3.3Å; Y252-T254 PolarHBondContact O-N 2.81Å; Y252-C255 WeakPolarHBondContact O-CB 3.32Å; Y252-C255 PolarHBondContact O-N 2.84Å; Y252-Y362 HydrophobicContact CD1-CD1 4.15Å; Y252-Y362 AromaticContact CD1-CE1 3.75Å; Y252-Y362 HydrophobicContact CD1-CE1 3.75Å; Y252-Y362 HydrophobicContact CE1-CE1 4.19Å; Y252-I363 HydrophobicContact CD1-CG1 3.83Å; Y252-I363 HydrophobicContact CD2-CD1 4.34Å; Y252-I363 HydrophobicContact CD2-CG1 4.17Å; Y252-I363 HydrophobicContact CE1-CG1 3.94Å; Y252-I363 HydrophobicContact CE2-CG1 4.29Å; Y252-I363 HydrophobicContact CE2-CG2 4.36Å; Y252-I363 HydrophobicContact CG-CD1 4.26Å; Y252-I363 HydrophobicContact CG-CG1 3.93Å; Y252-D366 HydrophobicContact CE1-CB 4.4Å; Y252-D366 PolarHBondContact OH-OD2 2.98Å; Y252-F367 HydrophobicContact CE2-CE2 4.31Å; Y252-F367 WeakPolarHBondContact OH-CE2 3.35Å; Y252-Q382 HydrophobicContact CE1-CB 4.17Å; Y252-Q382 HydrophobicContact CE1-CG 3.98Å
253	P	88.6	Confident	90.7	Very high	108 Å²	108	43.3 Å²	43.3	70%	0.701	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-19.1	-173.3	25.1	-35.3	0	0	0	114	C255	P253-C255 VanDerWaalsContact C-N 3.34Å
254	T	88.6	Confident	90.6	Very high	110 Å²	110	46 Å²	46	68%	0.675	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-5.5	175.5	55.7	0	0	0	0	113.7	Y252	Y252-T254 PolarHBondContact O-N 2.81Å
255	C	89.3	Confident	90.5	Very high	10 Å²	10	48.1 Å²	48.1	7%	0.068	25%	0.252	C	S	.	.	S	Bend	trans	-111	112.7	-175	-63.2	0	0	0	0	110.3	Y252 P253 F354 M359 I363	Y252-C255 WeakPolarHBondContact O-CB 3.32Å; Y252-C255 PolarHBondContact O-N 2.84Å; P253-C255 VanDerWaalsContact C-N 3.34Å; C255-F354 HydrophobicContact CB-CD1 4.35Å; C255-M359 HydrophobicContact CB-CB 4.03Å; C255-M359 HydrophobicContact CB-CG 4.22Å; C255-M359 HydrophobicContact CB-SD 4.45Å; C255-I363 HydrophobicContact CB-CD1 4.18Å
256	E	90.4	Very high	90.3	Very high	108 Å²	108	46.1 Å²	46.1	51%	0.505	24%	0.243	S	C	.	.			trans	-83.2	122.8	177.8	-168.2	179.4	176.4	0	0	110.9	F354 Q355 M359	E256-F354 WeakPolarHBondContact O-CA 3.33Å; E256-Q355 HydrophobicContact CB-CB 4.25Å; E256-Q355 PolarHBondContact O-N 3.42Å; E256-Q355 VanDerWaalsContact O-N 3.13Å; E256-Q355 VanDerWaalsContact OE2-CD 3.25Å; E256-Q355 PolarHBondContact OE2-NE2 2.88Å; E256-Q355 VanDerWaalsContact OE2-NE2 3.08Å; E256-Q355 PolarHBondContact OE2-OE1 3.32Å; E256-Q355 VanDerWaalsContact OE2-OE1 3.13Å; E256-M359 PolarHBondContact N-SD 3.15Å
257	V	90.3	Very high	90.2	Very high	36 Å²	36	46.1 Å²	46.1	22%	0.218	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	122	174.5	-178	0	0	0	0	108.8	F248 V260 V352 F354	F248-V257 HydrophobicContact CB-CG2 3.63Å; F248-V257 HydrophobicContact CG-CG2 4.3Å; V257-V260 HydrophobicContact CG1-CG2 3.67Å; V257-V352 HydrophobicContact CG1-CG1 4Å; V257-F354 HydrophobicContact CG2-CD1 4.15Å; V257-F354 HydrophobicContact CG2-CE1 3.76Å
258	V	89.1	Confident	90	Very high	92 Å²	92	51.8 Å²	51.8	56%	0.558	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	-43.6	179	176.5	0	0	0	0	110.9	T353 Q355	V258-T353 HydrophobicContact CB-CG2 4.41Å; V258-T353 PolarHBondContact N-O 2.86Å; V258-Q355 HydrophobicContact CG2-CB 4.09Å
259	D	88.8	Confident	89.9	Confident	26 Å²	26	52 Å²	52	14%	0.139	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	148.3	179.9	-172.1	33	0	0	0	111.7	K241 T353	K241-D259 IonicContact NZ-OD1 2.74Å; K241-D259 PolarHBondContact NZ-OD1 3.31Å; D259-T353 PolarHBondContact N-O 3.28Å; D259-T353 PolarHBondContact O-N 2.99Å
260	V	90.6	Very high	89.8	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	120.2	171.3	175.7	0	0	0	0	108.3	K241 V244 E245 V257 F351 V352	K241-V260 VanDerWaalsContact CD-O 3.29Å; K241-V260 WeakPolarHBondContact CD-O 3.4Å; K241-V260 WeakPolarHBondContact CE-O 3.35Å; K241-V260 HydrophobicContact CG-CB 3.96Å; K241-V260 HydrophobicContact CG-CG1 4.13Å; K241-V260 PolarHBondContact NZ-O 3.03Å; V244-V260 HydrophobicContact CB-CG1 4.16Å; V244-V260 HydrophobicContact CG1-CG1 3.94Å; V244-V260 HydrophobicContact CG1-CG2 4.42Å; E245-V260 HydrophobicContact CG-CB 4.09Å; E245-V260 HydrophobicContact CG-CG2 3.5Å; V257-V260 HydrophobicContact CG1-CG2 3.67Å; V260-F351 WeakPolarHBondContact CA-O 3.2Å; V260-V352 HydrophobicContact CG1-CG2 4.37Å; V260-V352 HydrophobicContact CG2-CG1 4.07Å; V260-V352 HydrophobicContact CG2-CG2 4.19Å
261	Q	90.3	Very high	89.7	Confident	49 Å²	49	49 Å²	49	23%	0.229	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	109.7	179.5	-173.2	60.5	32.2	0	0	110.5	A350 F351 Y752 V753	Q261-A350 CarbonylContact O-C 3.55Å; Q261-A350 WeakPolarHBondContact O-CA 3.29Å; Q261-F351 HydrophobicContact CB-CB 4.41Å; Q261-F351 PolarHBondContact N-O 2.84Å; Q261-F351 PolarHBondContact O-N 3.37Å; Q261-Y752 WeakPolarHBondContact CG-O 3.3Å; Q261-V753 HydrophobicContact CG-CG2 4.02Å
262	L	90.5	Very high	89.8	Confident	22 Å²	22	49.5 Å²	49.5	12%	0.115	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	144.1	174.3	-62.6	178.9	0	0	0	111	L235 A239 K241 Y264 A350	L235-L262 HydrophobicContact CD2-CD2 4.43Å; A239-L262 WeakPolarHBondContact O-CD1 3.31Å; K241-L262 HydrophobicContact CB-CD1 4.46Å; L262-Y264 HydrophobicContact CB-CE2 3.87Å; L262-Y264 WeakPolarHBondContact O-CD2 3.39Å; L262-Y264 WeakPolarHBondContact O-CE2 3.34Å; L262-A350 HydrophobicContact CD2-CB 3.96Å
263	C	90.2	Very high	89.6	Confident	7 Å²	7	49.8 Å²	49.8	5%	0.047	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	132.4	-179.9	-63.7	0	0	0	0	111.9	L347 M349 F351	C263-L347 HydrophobicContact CB-CB 4.38Å; C263-L347 HydrophobicContact CB-CD1 4.35Å; C263-L347 WeakPolarHBondContact O-CB 2.94Å; C263-L347 PolarHBondContact O-N 3.24Å; C263-M349 HydrophobicContact CB-CB 3.92Å; C263-M349 HydrophobicContact CB-CE 4.01Å; C263-M349 WeakPolarHBondContact CB-O 3.34Å; C263-M349 PolarHBondContact N-O 3.28Å; C263-F351 WeakPolarHBondContact SG-CE2 3.44Å
264	Y	89.1	Confident	89.6	Confident	74 Å²	74	51.2 Å²	51.2	29%	0.29	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	162.1	178.7	-57.7	-89.5	0	0	0	111.4	L262 V266 V342 P346 L347	L262-Y264 HydrophobicContact CB-CE2 3.87Å; L262-Y264 WeakPolarHBondContact O-CD2 3.39Å; L262-Y264 WeakPolarHBondContact O-CE2 3.34Å; Y264-V266 PolarHBondContact O-N 2.9Å; Y264-V342 VanDerWaalsContact CB-CG1 3.49Å; Y264-V342 VanDerWaalsContact CD1-O 3.29Å; Y264-V342 WeakPolarHBondContact CD1-O 3.09Å; Y264-V342 HydrophobicContact CG-CG1 4.15Å; Y264-P346 HydrophobicContact CD1-CB 4.3Å; Y264-P346 HydrophobicContact CE1-CB 4.25Å; Y264-L347 WeakPolarHBondContact O-CD1 3.29Å
265	N	89.6	Confident	89.6	Confident	45 Å²	45	48.8 Å²	48.8	24%	0.241	24%	0.237	C	C	.	.			trans	-72.7	93.9	175.3	-176.3	12.4	0	0	0	111.8	Q345 L347 S412	N265-Q345 HydrophobicContact CB-CB 3.95Å; N265-Q345 PolarHBondContact N-O 3.36Å; N265-Q345 VanDerWaalsContact N-O 3.07Å; N265-Q345 PolarHBondContact ND2-OE1 2.82Å; N265-L347 HydrophobicContact CB-CD2 4.14Å; N265-S412 WeakPolarHBondContact OD1-CB 3.4Å
266	V	89.1	Confident	89.6	Confident	8 Å²	8	49.3 Å²	49.3	5%	0.048	24%	0.238	C	C	.	.			trans	-101.3	6.8	-177.4	-66.2	0	0	0	0	114.1	Y264 K268 L269 I270 V342 W408 P754 L757	Y264-V266 PolarHBondContact O-N 2.9Å; V266-K268 PolarHBondContact O-N 3.47Å; V266-L269 PolarHBondContact O-N 3.3Å; V266-I270 HydrophobicContact CB-CD1 4.28Å; V266-I270 HydrophobicContact CB-CG1 4.38Å; V266-I270 HydrophobicContact CG2-CD1 3.66Å; V266-I270 HydrophobicContact CG2-CG1 4.29Å; V266-I270 WeakPolarHBondContact O-CB 3.33Å; V266-I270 VanDerWaalsContact O-CG1 3.3Å; V266-I270 WeakPolarHBondContact O-CG1 3.26Å; V266-I270 PolarHBondContact O-N 2.85Å; V266-V342 HydrophobicContact CG1-CG1 3.98Å; V266-W408 HydrophobicContact CG2-CB 4.4Å; V266-P754 HydrophobicContact CG2-CG 4.13Å; V266-L757 HydrophobicContact CG1-CD1 4.32Å
267	A	88.9	Confident	89.4	Confident	31 Å²	31	50.5 Å²	50.5	26%	0.256	24%	0.241	S	C	.	.	H	α-helix	trans	-59.6	-45.7	-171.1	0	0	0	0	0	113.1	Y271	A267-Y271 PolarHBondContact O-N 2.94Å
268	K	89.9	Confident	89.2	Confident	118 Å²	118	51.8 Å²	51.8	51%	0.513	24%	0.244	S	C	.	.	H	α-helix	trans	-68.3	-40.3	177.6	-174.5	170.2	170.7	-162.7	0	111.7	V266 Y271 L272 E338	V266-K268 PolarHBondContact O-N 3.47Å; K268-Y271 WeakPolarHBondContact O-CB 3.34Å; K268-Y271 PolarHBondContact O-N 3.33Å; K268-L272 HydrophobicContact CG-CD1 4.42Å; K268-L272 WeakPolarHBondContact O-CG 3.48Å; K268-L272 PolarHBondContact O-N 3.47Å; K268-E338 HydrophobicContact CD-CG 4.4Å; K268-E338 WeakPolarHBondContact CD-OE2 3.38Å; K268-E338 WeakPolarHBondContact CE-OE1 3.24Å; K268-E338 IonicContact NZ-OE1 2.8Å; K268-E338 PolarHBondContact NZ-OE1 2.91Å; K268-E338 IonicContact NZ-OE2 2.68Å
269	L	90.1	Very high	89.2	Confident	4 Å²	4	48 Å²	48	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-62.5	-45	177.5	-175	62.1	0	0	0	111.9	V266 Y271 L272 C273 I335 E338 E339 V342 L757	V266-L269 PolarHBondContact O-N 3.3Å; L269-Y271 VanDerWaalsContact C-N 3.3Å; L269-Y271 PolarHBondContact O-N 3.36Å; L269-L272 PolarHBondContact O-N 2.94Å; L269-C273 WeakPolarHBondContact O-CB 3.49Å; L269-C273 PolarHBondContact O-N 3.27Å; L269-C273 PolarHBondContact O-SG 3.27Å; L269-I335 HydrophobicContact CD1-CB 4.43Å; L269-I335 HydrophobicContact CD1-CG1 4.42Å; L269-I335 HydrophobicContact CD1-CG2 3.94Å; L269-E338 HydrophobicContact CD1-CB 4.35Å; L269-E339 HydrophobicContact CD1-CG 4Å; L269-E339 HydrophobicContact CD2-CG 4.04Å; L269-V342 HydrophobicContact CB-CG2 4.48Å; L269-V342 HydrophobicContact CD2-CG2 4.2Å; L269-L757 HydrophobicContact CD2-CD2 3.5Å; L269-L757 VanDerWaalsContact CD2-CD2 3.5Å
270	I	88.3	Confident	89.1	Confident	37 Å²	37	49 Å²	49	19%	0.19	23%	0.225	C	C	.	.	H	α-helix	trans	-58.4	-43.3	175	-71.9	171.8	0	0	0	110.8	V266 K274 W408 I756	V266-I270 HydrophobicContact CB-CD1 4.28Å; V266-I270 HydrophobicContact CB-CG1 4.38Å; V266-I270 HydrophobicContact CG2-CD1 3.66Å; V266-I270 HydrophobicContact CG2-CG1 4.29Å; V266-I270 WeakPolarHBondContact O-CB 3.33Å; V266-I270 VanDerWaalsContact O-CG1 3.3Å; V266-I270 WeakPolarHBondContact O-CG1 3.26Å; V266-I270 PolarHBondContact O-N 2.85Å; I270-K274 WeakPolarHBondContact O-CB 3.45Å; I270-K274 PolarHBondContact O-N 3.32Å; I270-W408 HydrophobicContact CD1-CB 3.6Å; I270-I756 HydrophobicContact CB-CD1 4.27Å; I270-I756 HydrophobicContact CG1-CD1 4.21Å; I270-I756 HydrophobicContact CG2-CD1 3.87Å
271	Y	90.4	Very high	88.9	Confident	141 Å²	141	53 Å²	53	55%	0.553	24%	0.242	S	C	*	.	H	α-helix	trans	-61.7	-49.3	177.1	171.9	-100.9	0	0	0	111.9	A267 K268 L269 C273 K274 E275	A267-Y271 PolarHBondContact O-N 2.94Å; K268-Y271 WeakPolarHBondContact O-CB 3.34Å; K268-Y271 PolarHBondContact O-N 3.33Å; L269-Y271 VanDerWaalsContact C-N 3.3Å; L269-Y271 PolarHBondContact O-N 3.36Å; Y271-C273 PolarHBondContact O-N 2.97Å; Y271-K274 WeakPolarHBondContact O-CB 3.39Å; Y271-K274 PolarHBondContact O-N 3.14Å; Y271-E275 HydrophobicContact CE1-CG 4.3Å; Y271-E275 HydrophobicContact CE2-CG 4.14Å; Y271-E275 PolarHBondContact O-N 2.97Å
272	L	91.5	Very high	88.8	Confident	11 Å²	11	50.8 Å²	50.8	6%	0.058	23%	0.232	C	C	.	.	H	α-helix	trans	-60.7	-43.4	179.1	-70.2	173.1	0	0	0	112.3	K268 L269 K274 E275 R276 L331 R334 I335 E338	K268-L272 HydrophobicContact CG-CD1 4.42Å; K268-L272 WeakPolarHBondContact O-CG 3.48Å; K268-L272 PolarHBondContact O-N 3.47Å; L269-L272 PolarHBondContact O-N 2.94Å; L272-K274 VanDerWaalsContact C-N 3.33Å; L272-K274 PolarHBondContact O-N 2.95Å; L272-E275 PolarHBondContact O-N 3.07Å; L272-R276 PolarHBondContact O-N 3.43Å; L272-L331 HydrophobicContact CD2-CD2 4.18Å; L272-R334 HydrophobicContact CD1-CB 4.11Å; L272-R334 HydrophobicContact CD2-CB 4.43Å; L272-I335 HydrophobicContact CB-CD1 4.34Å; L272-I335 HydrophobicContact CB-CG1 3.74Å; L272-I335 HydrophobicContact CD1-CG1 4.45Å; L272-E338 HydrophobicContact CD1-CB 4.37Å; L272-E338 HydrophobicContact CD1-CG 3.73Å
273	C	89	Confident	88.8	Confident	8 Å²	8	50.8 Å²	50.8	5%	0.054	23%	0.232	C	C	.	.	H	α-helix	trans	-66.9	-34.8	178.4	-64.8	0	0	0	0	112.8	L269 Y271 R276 K277 I756	L269-C273 WeakPolarHBondContact O-CB 3.49Å; L269-C273 PolarHBondContact O-N 3.27Å; L269-C273 PolarHBondContact O-SG 3.27Å; Y271-C273 PolarHBondContact O-N 2.97Å; C273-R276 WeakPolarHBondContact O-CB 3.5Å; C273-R276 PolarHBondContact O-N 3.26Å; C273-K277 PolarHBondContact O-N 3.03Å; C273-I756 HydrophobicContact CB-CB 4.47Å; C273-I756 HydrophobicContact CB-CD1 4.4Å; C273-I756 HydrophobicContact CB-CG2 3.16Å; C273-I756 WeakPolarHBondContact SG-CG2 3.3Å
274	K	87.1	Confident	88.6	Confident	138 Å²	138	54.1 Å²	54.1	60%	0.6	25%	0.252	S	S	*	.	H	α-helix	trans	-63.4	-43.9	173.9	-174.6	179.7	180	179.3	0	111.1	I270 Y271 L272 K278	I270-K274 WeakPolarHBondContact O-CB 3.45Å; I270-K274 PolarHBondContact O-N 3.32Å; Y271-K274 WeakPolarHBondContact O-CB 3.39Å; Y271-K274 PolarHBondContact O-N 3.14Å; L272-K274 VanDerWaalsContact C-N 3.33Å; L272-K274 PolarHBondContact O-N 2.95Å; K274-K278 PolarHBondContact O-N 2.95Å; K274-K278 VanDerWaalsContact O-N 3.09Å
275	E	89.2	Confident	88.5	Confident	60 Å²	60	53.6 Å²	53.6	28%	0.28	25%	0.25	S	S	.	.	H	α-helix	trans	-65	-40.5	174.5	-70.4	-60.4	119.5	0	0	111.6	Y271 L272 K277 K278 T279 L331	Y271-E275 HydrophobicContact CE1-CG 4.3Å; Y271-E275 HydrophobicContact CE2-CG 4.14Å; Y271-E275 PolarHBondContact O-N 2.97Å; L272-E275 PolarHBondContact O-N 3.07Å; E275-K277 PolarHBondContact O-N 3.32Å; E275-K278 WeakPolarHBondContact O-CB 3.26Å; E275-K278 PolarHBondContact O-N 3.35Å; E275-T279 PolarHBondContact O-N 3.26Å; E275-T279 PolarHBondContact O-OG1 3.49Å; E275-L331 HydrophobicContact CB-CD1 4.26Å; E275-L331 HydrophobicContact CB-CD2 4.3Å
276	R	90	Very high	88.4	Confident	20 Å²	20	51.9 Å²	51.9	8%	0.075	24%	0.24	C	C	.	.	H	α-helix	trans	-57	-51.4	174.9	-168.2	-160	82.1	171.5	6.3	111.4	L272 C273 K278 T279 E280 L331 I335 E763	L272-R276 PolarHBondContact O-N 3.43Å; C273-R276 WeakPolarHBondContact O-CB 3.5Å; C273-R276 PolarHBondContact O-N 3.26Å; R276-K278 VanDerWaalsContact C-N 3.28Å; R276-K278 PolarHBondContact O-N 2.9Å; R276-T279 CarbonylContact O-C 3.6Å; R276-T279 WeakPolarHBondContact O-CA 3.36Å; R276-T279 WeakPolarHBondContact O-CB 3.32Å; R276-T279 PolarHBondContact O-N 3.47Å; R276-T279 VanDerWaalsContact O-N 3.07Å; R276-E280 WeakPolarHBondContact CD-OE1 3.42Å; R276-E280 IonicContact CZ-OE1 3.25Å; R276-E280 IonicContact NE-OE1 2.92Å; R276-E280 PolarHBondContact NE-OE1 3.4Å; R276-E280 IonicContact NE-OE2 2.8Å; R276-E280 IonicContact NH2-OE1 3.29Å; R276-E280 PolarHBondContact NH2-OE1 3.1Å; R276-E280 IonicContact NH2-OE2 3.97Å; R276-E280 WeakPolarHBondContact O-CG 3.32Å; R276-E280 PolarHBondContact O-N 3.42Å; R276-L331 HydrophobicContact CB-CB 4.43Å; R276-I335 HydrophobicContact CB-CD1 3.99Å; R276-I335 HydrophobicContact CG-CD1 4.27Å; R276-E763 IonicContact CZ-OE2 3.26Å; R276-E763 VanDerWaalsContact CZ-OE2 3.29Å; R276-E763 IonicContact NH1-OE2 2.8Å; R276-E763 PolarHBondContact NH1-OE2 3.14Å; R276-E763 VanDerWaalsContact NH2-CD 3.31Å; R276-E763 IonicContact NH2-OE1 3.5Å; R276-E763 PolarHBondContact NH2-OE1 2.89Å; R276-E763 IonicContact NH2-OE2 2.88Å; R276-E763 PolarHBondContact NH2-OE2 3.36Å
277	K	86	Confident	88.4	Confident	133 Å²	133	54 Å²	54	58%	0.578	25%	0.253	S	S	*	.	H	α-helix	trans	-61.6	-36.9	179.4	-170.7	169.8	-174.2	169.3	0	112.2	C273 E275 K281	C273-K277 PolarHBondContact O-N 3.03Å; E275-K277 PolarHBondContact O-N 3.32Å; K277-K281 WeakPolarHBondContact O-CG 3.28Å; K277-K281 PolarHBondContact O-N 3.24Å; K277-K281 VanDerWaalsContact O-N 3.1Å
278	K	85.6	Confident	88.4	Confident	64 Å²	64	56.6 Å²	56.6	28%	0.278	26%	0.263	S	S	.	.	H	α-helix	trans	-63.4	-44.8	173.4	-175.2	-171.9	171.3	-161.2	0	111.1	K274 E275 R276 K281 S282 D593 N596	K274-K278 PolarHBondContact O-N 2.95Å; K274-K278 VanDerWaalsContact O-N 3.09Å; E275-K278 WeakPolarHBondContact O-CB 3.26Å; E275-K278 PolarHBondContact O-N 3.35Å; R276-K278 VanDerWaalsContact C-N 3.28Å; R276-K278 PolarHBondContact O-N 2.9Å; K278-K281 PolarHBondContact O-N 2.91Å; K278-S282 PolarHBondContact O-N 2.82Å; K278-S282 VanDerWaalsContact O-N 3.09Å; K278-S282 PolarHBondContact O-OG 3.36Å; K278-D593 WeakPolarHBondContact CE-OD1 3.48Å; K278-D593 IonicContact NZ-OD1 2.96Å; K278-D593 PolarHBondContact NZ-OD1 3.33Å; K278-D593 VanDerWaalsContact NZ-OD1 3.1Å; K278-N596 HydrophobicContact CG-CB 4.37Å
279	T	88.9	Confident	88.2	Confident	11 Å²	11	53.1 Å²	53.1	7%	0.067	25%	0.25	C	C	.	.	H	α-helix	trans	-64.5	-41.4	176.6	-75.5	0	0	0	0	112.4	E275 R276 K281 S282 L283 Y324 M327 K328	E275-T279 PolarHBondContact O-N 3.26Å; E275-T279 PolarHBondContact O-OG1 3.49Å; R276-T279 CarbonylContact O-C 3.6Å; R276-T279 WeakPolarHBondContact O-CA 3.36Å; R276-T279 WeakPolarHBondContact O-CB 3.32Å; R276-T279 PolarHBondContact O-N 3.47Å; R276-T279 VanDerWaalsContact O-N 3.07Å; T279-K281 PolarHBondContact O-N 3.47Å; T279-S282 WeakPolarHBondContact O-CB 3.39Å; T279-S282 PolarHBondContact O-N 3.37Å; T279-L283 WeakPolarHBondContact O-CB 3.37Å; T279-L283 PolarHBondContact O-N 2.9Å; T279-Y324 HydrophobicContact CG2-CD1 4.06Å; T279-Y324 WeakPolarHBondContact CG2-O 3.44Å; T279-M327 HydrophobicContact CG2-CB 4.19Å; T279-M327 HydrophobicContact CG2-CG 4.16Å; T279-K328 HydrophobicContact CG2-CB 3.89Å
280	E	87.6	Confident	88.1	Confident	49 Å²	49	55.6 Å²	55.6	23%	0.229	26%	0.261	C	S	.	.	H	α-helix	trans	-61.8	-42.5	176.1	-76.7	166.7	175.6	0	0	112.3	R276 S282 L283 T284 K328	R276-E280 WeakPolarHBondContact CD-OE1 3.42Å; R276-E280 IonicContact CZ-OE1 3.25Å; R276-E280 IonicContact NE-OE1 2.92Å; R276-E280 PolarHBondContact NE-OE1 3.4Å; R276-E280 IonicContact NE-OE2 2.8Å; R276-E280 IonicContact NH2-OE1 3.29Å; R276-E280 PolarHBondContact NH2-OE1 3.1Å; R276-E280 IonicContact NH2-OE2 3.97Å; R276-E280 WeakPolarHBondContact O-CG 3.32Å; R276-E280 PolarHBondContact O-N 3.42Å; E280-S282 VanDerWaalsContact C-N 3.34Å; E280-S282 PolarHBondContact O-N 3.02Å; E280-L283 PolarHBondContact O-N 2.99Å; E280-T284 WeakPolarHBondContact O-CB 3.3Å; E280-T284 PolarHBondContact O-N 3.29Å; E280-T284 PolarHBondContact O-OG1 2.92Å; E280-K328 HydrophobicContact CG-CD 4.1Å; E280-K328 HydrophobicContact CG-CG 4.3Å
281	K	85.9	Confident	88.2	Confident	84 Å²	84	59.5 Å²	59.5	37%	0.365	29%	0.286	S	S	.	.	H	α-helix	trans	-60	-45	173	-76.5	-178	168.1	-157.8	0	111.7	K277 K278 T279 Y285	K277-K281 WeakPolarHBondContact O-CG 3.28Å; K277-K281 PolarHBondContact O-N 3.24Å; K277-K281 VanDerWaalsContact O-N 3.1Å; K278-K281 PolarHBondContact O-N 2.91Å; T279-K281 PolarHBondContact O-N 3.47Å; K281-Y285 WeakPolarHBondContact O-CB 3.31Å; K281-Y285 PolarHBondContact O-N 3.12Å
282	S	87.9	Confident	88	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.007	29%	0.291	C	S	.	.	H	α-helix	trans	-62.9	-44.1	176.4	-65.4	0	0	0	0	112.2	K278 T279 E280 Y285 Y286 N596	K278-S282 PolarHBondContact O-N 2.82Å; K278-S282 VanDerWaalsContact O-N 3.09Å; K278-S282 PolarHBondContact O-OG 3.36Å; T279-S282 WeakPolarHBondContact O-CB 3.39Å; T279-S282 PolarHBondContact O-N 3.37Å; E280-S282 VanDerWaalsContact C-N 3.34Å; E280-S282 PolarHBondContact O-N 3.02Å; S282-Y285 WeakPolarHBondContact O-CB 3.38Å; S282-Y285 PolarHBondContact O-N 3.1Å; S282-Y286 WeakPolarHBondContact O-CD2 3.39Å; S282-Y286 PolarHBondContact O-N 3.21Å; S282-Y286 VanDerWaalsContact O-N 3.1Å; S282-N596 PolarHBondContact OG-ND2 3.46Å
283	L	89.8	Confident	87.8	Confident	22 Å²	22	63 Å²	63	12%	0.115	31%	0.311	C	S	.	.	H	α-helix	trans	-59.7	-51.5	177.3	-178.6	61.6	0	0	0	110.7	T279 E280 Y285 Y286 T287 I321 K328	T279-L283 WeakPolarHBondContact O-CB 3.37Å; T279-L283 PolarHBondContact O-N 2.9Å; E280-L283 PolarHBondContact O-N 2.99Å; L283-Y285 VanDerWaalsContact C-N 3.26Å; L283-Y285 PolarHBondContact O-N 3.38Å; L283-Y286 PolarHBondContact O-N 2.88Å; L283-Y286 VanDerWaalsContact O-N 3.12Å; L283-T287 PolarHBondContact O-N 2.87Å; L283-T287 PolarHBondContact O-OG1 2.54Å; L283-I321 HydrophobicContact CD1-CB 4.45Å; L283-I321 HydrophobicContact CD1-CG2 3.99Å; L283-K328 HydrophobicContact CD2-CD 4.34Å
284	T	87.4	Confident	87.5	Confident	77 Å²	77	65.8 Å²	65.8	47%	0.472	34%	0.34	S	S	.	.	H	α-helix	trans	-56.2	-41.4	178.3	-54.6	0	0	0	0	111.6	E280 N288	E280-T284 WeakPolarHBondContact O-CB 3.3Å; E280-T284 PolarHBondContact O-N 3.29Å; E280-T284 PolarHBondContact O-OG1 2.92Å; T284-N288 VanDerWaalsContact O-CB 3.28Å; T284-N288 WeakPolarHBondContact O-CB 3.49Å; T284-N288 PolarHBondContact O-N 3.3Å; T284-N288 PolarHBondContact O-ND2 3.13Å
285	Y	86.2	Confident	87.3	Confident	64 Å²	64	66 Å²	66	25%	0.251	34%	0.344	S	S	.	.	H	α-helix	trans	-60.6	-50	175.8	170.1	-99.1	0	0	0	112.5	K281 S282 L283 N288 L289 A591 A592	K281-Y285 WeakPolarHBondContact O-CB 3.31Å; K281-Y285 PolarHBondContact O-N 3.12Å; S282-Y285 WeakPolarHBondContact O-CB 3.38Å; S282-Y285 PolarHBondContact O-N 3.1Å; L283-Y285 VanDerWaalsContact C-N 3.26Å; L283-Y285 PolarHBondContact O-N 3.38Å; Y285-N288 PolarHBondContact O-N 3.14Å; Y285-L289 HydrophobicContact CE1-CD2 4.24Å; Y285-L289 WeakPolarHBondContact O-CB 3.31Å; Y285-L289 PolarHBondContact O-N 3.05Å; Y285-A591 HydrophobicContact CE1-CB 4.47Å; Y285-A592 HydrophobicContact CD1-CB 3.85Å; Y285-A592 HydrophobicContact CE1-CB 4.41Å
286	Y	88.8	Confident	87.1	Confident	8 Å²	8	72.1 Å²	72.1	3%	0.031	36%	0.364	C	S	.	.	H	α-helix	trans	-70.1	-35.6	-178.8	-76.4	-66.9	0	0	0	112.8	S282 L283 L289 Q290 T297 I299 A320 Y324 T590 A591 A592	S282-Y286 WeakPolarHBondContact O-CD2 3.39Å; S282-Y286 PolarHBondContact O-N 3.21Å; S282-Y286 VanDerWaalsContact O-N 3.1Å; L283-Y286 PolarHBondContact O-N 2.88Å; L283-Y286 VanDerWaalsContact O-N 3.12Å; Y286-L289 HydrophobicContact CD1-CD2 4.32Å; Y286-L289 PolarHBondContact O-N 3.25Å; Y286-Q290 PolarHBondContact O-N 3.43Å; Y286-T297 VanDerWaalsContact CD1-OG1 3.24Å; Y286-T297 WeakPolarHBondContact CD1-OG1 3.27Å; Y286-I299 HydrophobicContact CE1-CG2 4.2Å; Y286-A320 HydrophobicContact CD1-CB 3.8Å; Y286-A320 HydrophobicContact CD2-CB 3.94Å; Y286-A320 HydrophobicContact CE1-CB 4.11Å; Y286-A320 HydrophobicContact CE2-CB 4.26Å; Y286-A320 HydrophobicContact CG-CB 3.72Å; Y286-Y324 AromaticContact CD2-CD2 3.78Å; Y286-Y324 HydrophobicContact CD2-CD2 3.78Å; Y286-Y324 AromaticContact CD2-CE2 3.61Å; Y286-Y324 HydrophobicContact CD2-CE2 3.61Å; Y286-Y324 HydrophobicContact CE2-CD2 4.07Å; Y286-Y324 AromaticContact CE2-CE2 3.39Å; Y286-Y324 HydrophobicContact CE2-CE2 3.39Å; Y286-T590 WeakPolarHBondContact OH-CB 3.33Å; Y286-A591 PolarHBondContact OH-N 2.86Å; Y286-A592 HydrophobicContact CD2-CB 4.1Å; Y286-A592 HydrophobicContact CE2-CB 3.34Å; Y286-A592 PolarHBondContact OH-N 3.46Å
287	T	88.7	Confident	86.9	Confident	53 Å²	53	72.8 Å²	72.8	33%	0.325	37%	0.37	S	S	.	.	H	α-helix	trans	-61.9	-48.7	172.1	-56.9	0	0	0	0	111	L283 L289 Q290 V291	L283-T287 PolarHBondContact O-N 2.87Å; L283-T287 PolarHBondContact O-OG1 2.54Å; T287-L289 VanDerWaalsContact C-N 3.27Å; T287-L289 PolarHBondContact O-N 3.38Å; T287-Q290 PolarHBondContact O-N 3.03Å; T287-V291 WeakPolarHBondContact O-CG2 3.27Å; T287-V291 PolarHBondContact O-N 3.01Å
288	N	87.4	Confident	86.9	Confident	85 Å²	85	71.4 Å²	71.4	46%	0.455	37%	0.369	S	S	.	.	H	α-helix	trans	-62.7	-35.5	176.7	-74.1	-18.2	0	0	0	112.2	T284 Y285 K292	T284-N288 VanDerWaalsContact O-CB 3.28Å; T284-N288 WeakPolarHBondContact O-CB 3.49Å; T284-N288 PolarHBondContact O-N 3.3Å; T284-N288 PolarHBondContact O-ND2 3.13Å; Y285-N288 PolarHBondContact O-N 3.14Å; N288-K292 VanDerWaalsContact O-CG 3.32Å; N288-K292 WeakPolarHBondContact O-CG 3.47Å; N288-K292 PolarHBondContact O-N 3.16Å; N288-K292 VanDerWaalsContact O-N 3.14Å
289	L	86.8	Confident	86.9	Confident	46 Å²	46	68.8 Å²	68.8	24%	0.241	36%	0.358	C	S	.	.	H	α-helix	trans	-65.9	-45.4	176	-175.6	60.4	0	0	0	111.1	Y285 Y286 T287 V291 K292 T293 T297	Y285-L289 HydrophobicContact CE1-CD2 4.24Å; Y285-L289 WeakPolarHBondContact O-CB 3.31Å; Y285-L289 PolarHBondContact O-N 3.05Å; Y286-L289 HydrophobicContact CD1-CD2 4.32Å; Y286-L289 PolarHBondContact O-N 3.25Å; T287-L289 VanDerWaalsContact C-N 3.27Å; T287-L289 PolarHBondContact O-N 3.38Å; L289-V291 PolarHBondContact O-N 3.3Å; L289-K292 PolarHBondContact O-N 3.4Å; L289-K292 VanDerWaalsContact O-N 3.16Å; L289-T293 HydrophobicContact CD1-CG2 4.01Å; L289-T293 PolarHBondContact O-N 2.91Å; L289-T293 PolarHBondContact O-OG1 3.44Å; L289-T297 HydrophobicContact CD2-CG2 3.83Å; L289-T297 HydrophobicContact CG-CG2 4.42Å
290	Q	87.3	Confident	86.6	Confident	56 Å²	56	68.5 Å²	68.5	26%	0.262	36%	0.356	S	S	.	.	H	α-helix	trans	-61.6	-42	176.5	-172.8	-172.2	15.3	0	0	111.9	Y286 T287 K292 G294 I321	Y286-Q290 PolarHBondContact O-N 3.43Å; T287-Q290 PolarHBondContact O-N 3.03Å; Q290-K292 VanDerWaalsContact C-N 3.25Å; Q290-K292 PolarHBondContact O-N 2.91Å; Q290-G294 VanDerWaalsContact O-CA 3.27Å; Q290-G294 WeakPolarHBondContact O-CA 3.33Å; Q290-G294 PolarHBondContact O-N 2.64Å; Q290-I321 HydrophobicContact CB-CD1 4.07Å; Q290-I321 HydrophobicContact CG-CD1 4.5Å
291	V	90	Very high	86	Confident	118 Å²	118	67.4 Å²	67.4	72%	0.715	35%	0.353	S	S	*	.	H	α-helix	trans	-61.2	-36.6	176.3	171.3	0	0	0	0	111.3	T287 L289	T287-V291 WeakPolarHBondContact O-CG2 3.27Å; T287-V291 PolarHBondContact O-N 3.01Å; L289-V291 PolarHBondContact O-N 3.3Å
292	K	87.5	Confident	85.5	Confident	150 Å²	150	68.9 Å²	68.9	65%	0.652	36%	0.359	S	S	*	.	H	α-helix	trans	-77.9	-39.7	-179.5	-73.9	178.5	-179.3	-174.6	0	113.9	N288 L289 Q290	N288-K292 VanDerWaalsContact O-CG 3.32Å; N288-K292 WeakPolarHBondContact O-CG 3.47Å; N288-K292 PolarHBondContact O-N 3.16Å; N288-K292 VanDerWaalsContact O-N 3.14Å; L289-K292 PolarHBondContact O-N 3.4Å; L289-K292 VanDerWaalsContact O-N 3.16Å; Q290-K292 VanDerWaalsContact C-N 3.25Å; Q290-K292 PolarHBondContact O-N 2.91Å
293	T	86	Confident	84.4	Confident	76 Å²	76	73 Å²	73	47%	0.466	39%	0.386	S	S	.	.	H	α-helix	trans	-100.2	-15.6	-173.5	59.5	0	0	0	0	113.7	L289 Q295	L289-T293 HydrophobicContact CD1-CG2 4.01Å; L289-T293 PolarHBondContact O-N 2.91Å; L289-T293 PolarHBondContact O-OG1 3.44Å; T293-Q295 PolarHBondContact O-N 3.09Å; T293-Q295 PolarHBondContact OG1-N 3.1Å
294	G	83.4	Confident	83.2	Confident	66 Å²	66	74 Å²	74	68%	0.68	40%	0.395	S	S	*	.	S	Bend	trans	69.8	-0.4	-173.5	0	0	0	0	0	114.6	Q290	Q290-G294 VanDerWaalsContact O-CA 3.27Å; Q290-G294 WeakPolarHBondContact O-CA 3.33Å; Q290-G294 PolarHBondContact O-N 2.64Å
295	Q	83.1	Confident	82.1	Confident	144 Å²	144	70.5 Å²	70.5	67%	0.673	37%	0.373	S	S	*	.	S	Bend	trans	-109.8	140.5	-176	-71.7	-176.9	-8.1	0	0	112.1	T293	T293-Q295 PolarHBondContact O-N 3.09Å; T293-Q295 PolarHBondContact OG1-N 3.1Å
296	R	84.6	Confident	81	Confident	188 Å²	188	72.3 Å²	72.3	71%	0.709	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-76.5	128.4	172.3	-69.7	-172.8	-176.5	-177.2	0.2	110
297	T	85.1	Confident	79.9	Confident	33 Å²	33	78.7 Å²	78.7	20%	0.202	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-93.3	124.6	179.2	52.8	0	0	0	0	110.8	Y286 L289 A320	Y286-T297 VanDerWaalsContact CD1-OG1 3.24Å; Y286-T297 WeakPolarHBondContact CD1-OG1 3.27Å; L289-T297 HydrophobicContact CD2-CG2 3.83Å; L289-T297 HydrophobicContact CG-CG2 4.42Å; T297-A320 VanDerWaalsContact O-CB 3.32Å; T297-A320 WeakPolarHBondContact O-CB 3.18Å; T297-A320 PolarHBondContact O-N 2.96Å
298	L	86.4	Confident	78.7	Confident	105 Å²	105	77.9 Å²	77.9	55%	0.55	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	141	172	-63	172.5	0	0	0	110.3	W317 E318	L298-W317 HydrophobicContact CB-CB 4.19Å; L298-W317 HydrophobicContact CB-CE3 4.03Å; L298-W317 HydrophobicContact CD1-CB 4.46Å; L298-E318 CarbonylContact C-O 3.59Å; L298-E318 WeakPolarHBondContact CA-O 3.5Å
299	I	85.7	Confident	77.3	Confident	9 Å²	9	79.5 Å²	79.5	5%	0.046	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	151.2	176.9	57.7	168.9	0	0	0	111	Y286 E318 A320 Y323 Y324 T590	Y286-I299 HydrophobicContact CE1-CG2 4.2Å; I299-E318 PolarHBondContact N-O 3.02Å; I299-E318 PolarHBondContact O-N 3.3Å; I299-A320 HydrophobicContact CB-CB 4.47Å; I299-A320 HydrophobicContact CD1-CB 3.92Å; I299-A320 HydrophobicContact CG1-CB 3.92Å; I299-A320 HydrophobicContact CG2-CB 3.8Å; I299-Y323 HydrophobicContact CD1-CD1 3.75Å; I299-Y323 HydrophobicContact CD1-CE1 4.43Å; I299-Y323 HydrophobicContact CD1-CG 4.06Å; I299-Y324 HydrophobicContact CD1-CD2 4.27Å; I299-Y324 HydrophobicContact CD1-CE2 3.71Å; I299-T590 HydrophobicContact CB-CG2 4.07Å; I299-T590 HydrophobicContact CD1-CG2 4.04Å; I299-T590 HydrophobicContact CG2-CG2 4.18Å
300	N	82	Confident	75.9	Confident	4 Å²	4	81.1 Å²	81.1	2%	0.021	44%	0.439	C	S	.	.			trans	-101.1	118.2	169.2	-177	-21.1	0	0	0	109.5	K302 W317	N300-K302 VanDerWaalsContact C-N 3.26Å; N300-K302 PolarHBondContact O-N 2.91Å; N300-K302 VanDerWaalsContact OD1-CB 3.31Å; N300-K302 WeakPolarHBondContact OD1-CB 3.49Å; N300-K302 WeakPolarHBondContact OD1-CG 3.42Å; N300-K302 PolarHBondContact OD1-N 3.33Å; N300-W317 HydrophobicContact CB-CD2 4.42Å; N300-W317 HydrophobicContact CB-CE3 4.31Å; N300-W317 HydrophobicContact CB-CH2 4.39Å; N300-W317 HydrophobicContact CB-CZ2 4.49Å; N300-W317 HydrophobicContact CB-CZ3 4.31Å
301	P	76.3	Confident	74.4	Confident	26 Å²	26	87.2 Å²	87.2	17%	0.169	47%	0.468	C	S	.	.			trans	-77.9	-1.8	-175.1	30.5	-34.8	0	0	0	114.9	Y323 K589	P301-Y323 HydrophobicContact CB-CD2 4.34Å; P301-Y323 HydrophobicContact CB-CE2 3.62Å; P301-Y323 HydrophobicContact CG-CE2 4.33Å; P301-K589 WeakPolarHBondContact O-CD 3.42Å; P301-K589 PolarHBondContact O-NZ 3.36Å
302	K	75.3	Confident	73	Confident	116 Å²	116	85.9 Å²	85.9	50%	0.504	46%	0.46	S	S	.	.	S	Bend	trans	-79.5	153.4	-179.9	-62.3	-65.5	-176.8	176.3	0	112.2	N300 C304 G305 G314	N300-K302 VanDerWaalsContact C-N 3.26Å; N300-K302 PolarHBondContact O-N 2.91Å; N300-K302 VanDerWaalsContact OD1-CB 3.31Å; N300-K302 WeakPolarHBondContact OD1-CB 3.49Å; N300-K302 WeakPolarHBondContact OD1-CG 3.42Å; N300-K302 PolarHBondContact OD1-N 3.33Å; K302-C304 PolarHBondContact O-N 3.02Å; K302-G305 WeakPolarHBondContact O-CA 3.41Å; K302-G305 PolarHBondContact O-N 2.84Å; K302-G314 WeakPolarHBondContact CE-O 3.17Å
303	P	64.7	Low	71.3	Confident	86 Å²	86	87.5 Å²	87.5	56%	0.558	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	135.5	173.3	24.1	-33.3	0	0	0	110.5	G305	P303-G305 PolarHBondContact O-N 3.37Å
304	C	64.9	Low	69.9	Low	45 Å²	45	85.9 Å²	85.9	30%	0.304	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	20.9	-174	-55.5	0	0	0	0	114.7	K302 Q306 F307	K302-C304 PolarHBondContact O-N 3.02Å; C304-Q306 PolarHBondContact O-N 3.47Å; C304-F307 HydrophobicContact CB-CD2 4.23Å; C304-F307 PolarHBondContact O-N 3.14Å
305	G	62.9	Low	68.9	Low	2 Å²	2	84.1 Å²	84.1	2%	0.021	45%	0.45	C	S	.	.	G	3₁₀ helix	trans	-56.2	-24.1	-175.1	0	0	0	0	0	114.8	K302 P303 F307 C308	K302-G305 WeakPolarHBondContact O-CA 3.41Å; K302-G305 PolarHBondContact O-N 2.84Å; P303-G305 PolarHBondContact O-N 3.37Å; G305-F307 VanDerWaalsContact C-N 3.35Å; G305-C308 WeakPolarHBondContact O-CB 3.24Å; G305-C308 PolarHBondContact O-N 2.82Å
306	Q	64.9	Low	68.5	Low	102 Å²	102	84.2 Å²	84.2	48%	0.477	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-72.9	-21.6	175.2	-173.4	151.8	-5.3	0	0	114.5	C304 C308	C304-Q306 PolarHBondContact O-N 3.47Å; Q306-C308 VanDerWaalsContact C-N 3.35Å
307	F	65.3	Low	68.1	Low	142 Å²	142	80.4 Å²	80.4	62%	0.623	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-90.8	-3.1	173.3	-62.7	-74.5	0	0	0	112.5	C304 G305 C309	C304-F307 HydrophobicContact CB-CD2 4.23Å; C304-F307 PolarHBondContact O-N 3.14Å; G305-F307 VanDerWaalsContact C-N 3.35Å; F307-C309 PolarHBondContact O-N 3.4Å
308	C	63.3	Low	68.1	Low	36 Å²	36	81.6 Å²	81.6	24%	0.243	44%	0.44	C	S	.	.			trans	-85.3	97.6	176.2	-162.2	0	0	0	0	109.2	G305 Q306 C310 C315	G305-C308 WeakPolarHBondContact O-CB 3.24Å; G305-C308 PolarHBondContact O-N 2.82Å; Q306-C308 VanDerWaalsContact C-N 3.35Å; C308-C310 VanDerWaalsContact C-N 3.32Å; C308-C315 PolarHBondContact SG-SG 3.26Å
309	C	56.8	Low	68.3	Low	120 Å²	120	78 Å²	78	81%	0.811	42%	0.421	S	S	*	.			trans	-86.6	2.1	-178.9	-54.7	0	0	0	0	113.8	F307	F307-C309 PolarHBondContact O-N 3.4Å
310	C	58.3	Low	68.4	Low	80 Å²	80	77.6 Å²	77.6	54%	0.541	42%	0.419	S	S	.	.	S	Bend	trans	-122.9	137.4	-170.6	-57.5	0	0	0	0	111.6	C308 V312	C308-C310 VanDerWaalsContact C-N 3.32Å; C310-V312 HydrophobicContact CB-CG2 3.83Å; C310-V312 PolarHBondContact O-N 3.36Å
311	E	55.8	Low	68.8	Low	184 Å²	184	78.8 Å²	78.8	86%	0.86	43%	0.425	S	S	*	.			trans	-72.6	72.6	166.5	-73.5	178.8	163.7	0	0	109.9
312	V	61.3	Low	69.5	Low	89 Å²	89	80.8 Å²	80.8	54%	0.539	44%	0.439	S	S	.	.			trans	-86.1	143.4	169.1	-172.1	0	0	0	0	108.3	C310 G314 C315	C310-V312 HydrophobicContact CB-CG2 3.83Å; C310-V312 PolarHBondContact O-N 3.36Å; V312-G314 PolarHBondContact O-N 2.99Å; V312-C315 PolarHBondContact O-N 3.42Å
313	L	51.4	Low	70.3	Confident	184 Å²	184	76.9 Å²	76.9	96%	0.963	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	112.9	172.3	-141.7	91.6	0	0	0	109.4
314	G	57.4	Low	71.6	Confident	43 Å²	43	73.2 Å²	73.2	44%	0.443	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	108.6	-2.5	-175.6	0	0	0	0	0	116.7	K302 V312	K302-G314 WeakPolarHBondContact CE-O 3.17Å; V312-G314 PolarHBondContact O-N 2.99Å
315	C	61.8	Low	72.9	Confident	28 Å²	28	73.3 Å²	73.3	19%	0.189	40%	0.396	C	S	.	.			trans	-112.1	51.9	172.4	-75.4	0	0	0	0	111.7	C308 V312	C308-C315 PolarHBondContact SG-SG 3.26Å; V312-C315 PolarHBondContact O-N 3.42Å
316	E	74	Confident	74.4	Confident	147 Å²	147	79.8 Å²	79.8	69%	0.687	42%	0.42	S	S	*	.			trans	-69.4	134.4	179.5	-67.2	177	-173.7	0	0	111.3
317	W	76.4	Confident	75.7	Confident	108 Å²	108	77.7 Å²	77.7	41%	0.409	41%	0.41	S	S	.	.			trans	-89	123.3	176.8	-71.1	89	0	0	0	109.3	L298 N300	L298-W317 HydrophobicContact CB-CB 4.19Å; L298-W317 HydrophobicContact CB-CE3 4.03Å; L298-W317 HydrophobicContact CD1-CB 4.46Å; N300-W317 HydrophobicContact CB-CD2 4.42Å; N300-W317 HydrophobicContact CB-CE3 4.31Å; N300-W317 HydrophobicContact CB-CH2 4.39Å; N300-W317 HydrophobicContact CB-CZ2 4.49Å; N300-W317 HydrophobicContact CB-CZ3 4.31Å
318	E	85.9	Confident	77	Confident	58 Å²	58	73.9 Å²	73.9	27%	0.271	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	152	178.9	-67.4	-175	-154.7	0	0	110.7	L298 I299 A320 R326	L298-E318 CarbonylContact C-O 3.59Å; L298-E318 WeakPolarHBondContact CA-O 3.5Å; I299-E318 PolarHBondContact N-O 3.02Å; I299-E318 PolarHBondContact O-N 3.3Å; E318-A320 PolarHBondContact O-N 2.86Å; E318-R326 IonicContact OE1-NH2 2.93Å; E318-R326 IonicContact OE2-CZ 3.66Å; E318-R326 IonicContact OE2-NH1 2.69Å; E318-R326 IonicContact OE2-NH2 3Å; E318-R326 PolarHBondContact OE2-NH2 3.23Å
319	D	89.7	Confident	78.5	Confident	29 Å²	29	75.9 Å²	75.9	16%	0.155	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	125.1	172.4	176.3	75.9	0	0	0	110.7	I321 S322 Y323	D319-I321 PolarHBondContact O-N 3.48Å; D319-I321 PolarHBondContact OD2-N 2.84Å; D319-S322 PolarHBondContact O-N 3.01Å; D319-S322 WeakPolarHBondContact OD2-CB 3.2Å; D319-S322 PolarHBondContact OD2-N 3.01Å; D319-S322 PolarHBondContact OD2-OG 3.1Å; D319-Y323 WeakPolarHBondContact O-CB 3.24Å; D319-Y323 PolarHBondContact O-N 2.97Å
320	A	88.4	Confident	80.3	Confident	0 Å²	0	76.8 Å²	76.8	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-61.7	-42.1	-172.1	0	0	0	0	0	113	Y286 T297 I299 E318 Y323 Y324	Y286-A320 HydrophobicContact CD1-CB 3.8Å; Y286-A320 HydrophobicContact CD2-CB 3.94Å; Y286-A320 HydrophobicContact CE1-CB 4.11Å; Y286-A320 HydrophobicContact CE2-CB 4.26Å; Y286-A320 HydrophobicContact CG-CB 3.72Å; T297-A320 VanDerWaalsContact O-CB 3.32Å; T297-A320 WeakPolarHBondContact O-CB 3.18Å; T297-A320 PolarHBondContact O-N 2.96Å; I299-A320 HydrophobicContact CB-CB 4.47Å; I299-A320 HydrophobicContact CD1-CB 3.92Å; I299-A320 HydrophobicContact CG1-CB 3.92Å; I299-A320 HydrophobicContact CG2-CB 3.8Å; E318-A320 PolarHBondContact O-N 2.86Å; A320-Y323 PolarHBondContact O-N 3.47Å; A320-Y324 WeakPolarHBondContact O-CD2 3.42Å; A320-Y324 PolarHBondContact O-N 3.48Å
321	I	90.6	Very high	82	Confident	30 Å²	30	73.6 Å²	73.6	15%	0.154	37%	0.366	C	S	.	.	H	α-helix	trans	-68.1	-45.6	-177.8	-66.4	170.7	0	0	0	109.5	L283 Q290 D319 Y323 Y324 T325	L283-I321 HydrophobicContact CD1-CB 4.45Å; L283-I321 HydrophobicContact CD1-CG2 3.99Å; Q290-I321 HydrophobicContact CB-CD1 4.07Å; Q290-I321 HydrophobicContact CG-CD1 4.5Å; D319-I321 PolarHBondContact O-N 3.48Å; D319-I321 PolarHBondContact OD2-N 2.84Å; I321-Y323 PolarHBondContact O-N 3.46Å; I321-Y324 PolarHBondContact O-N 2.95Å; I321-T325 VanDerWaalsContact O-CB 3.23Å; I321-T325 WeakPolarHBondContact O-CB 3.49Å; I321-T325 PolarHBondContact O-N 3.09Å; I321-T325 PolarHBondContact O-OG1 2.88Å
322	S	91.4	Very high	83.7	Confident	67 Å²	67	68.5 Å²	68.5	47%	0.469	34%	0.344	S	S	.	.	H	α-helix	trans	-60.4	-44.4	176.3	-55.5	0	0	0	0	111.6	D319 R326	D319-S322 PolarHBondContact O-N 3.01Å; D319-S322 WeakPolarHBondContact OD2-CB 3.2Å; D319-S322 PolarHBondContact OD2-N 3.01Å; D319-S322 PolarHBondContact OD2-OG 3.1Å; S322-R326 WeakPolarHBondContact O-CB 3.46Å; S322-R326 PolarHBondContact O-N 3.08Å
323	Y	91	Very high	85.2	Confident	35 Å²	35	69.6 Å²	69.6	14%	0.137	34%	0.343	C	S	.	.	H	α-helix	trans	-60.1	-52.5	176.8	175.2	-92.8	0	0	0	112.4	I299 P301 D319 A320 I321 R326 M327	I299-Y323 HydrophobicContact CD1-CD1 3.75Å; I299-Y323 HydrophobicContact CD1-CE1 4.43Å; I299-Y323 HydrophobicContact CD1-CG 4.06Å; P301-Y323 HydrophobicContact CB-CD2 4.34Å; P301-Y323 HydrophobicContact CB-CE2 3.62Å; P301-Y323 HydrophobicContact CG-CE2 4.33Å; D319-Y323 WeakPolarHBondContact O-CB 3.24Å; D319-Y323 PolarHBondContact O-N 2.97Å; A320-Y323 PolarHBondContact O-N 3.47Å; I321-Y323 PolarHBondContact O-N 3.46Å; Y323-R326 PolarHBondContact O-N 2.95Å; Y323-M327 HydrophobicContact CE1-CE 4.38Å; Y323-M327 WeakPolarHBondContact O-CB 3.15Å; Y323-M327 PolarHBondContact O-N 2.75Å; Y323-M327 WeakPolarHBondContact OH-CE 3.47Å
324	Y	91.3	Very high	87.2	Confident	9 Å²	9	65.8 Å²	65.8	4%	0.035	32%	0.316	C	S	.	.	H	α-helix	trans	-71.4	-30	-177.7	-77.4	-65.5	0	0	0	112.6	T279 Y286 I299 A320 I321 M327 K328 T590	T279-Y324 HydrophobicContact CG2-CD1 4.06Å; T279-Y324 WeakPolarHBondContact CG2-O 3.44Å; Y286-Y324 AromaticContact CD2-CD2 3.78Å; Y286-Y324 HydrophobicContact CD2-CD2 3.78Å; Y286-Y324 AromaticContact CD2-CE2 3.61Å; Y286-Y324 HydrophobicContact CD2-CE2 3.61Å; Y286-Y324 HydrophobicContact CE2-CD2 4.07Å; Y286-Y324 AromaticContact CE2-CE2 3.39Å; Y286-Y324 HydrophobicContact CE2-CE2 3.39Å; I299-Y324 HydrophobicContact CD1-CD2 4.27Å; I299-Y324 HydrophobicContact CD1-CE2 3.71Å; A320-Y324 WeakPolarHBondContact O-CD2 3.42Å; A320-Y324 PolarHBondContact O-N 3.48Å; I321-Y324 PolarHBondContact O-N 2.95Å; Y324-M327 PolarHBondContact O-N 2.62Å; Y324-K328 WeakPolarHBondContact O-CB 3.3Å; Y324-K328 PolarHBondContact O-N 3.36Å; Y324-T590 PolarHBondContact OH-OG1 3.42Å
325	T	93.4	Very high	88.8	Confident	46 Å²	46	63.8 Å²	63.8	28%	0.282	30%	0.295	S	S	.	.	H	α-helix	trans	-63.6	-53.1	172.4	-57.6	0	0	0	0	110.1	I321 M327 K328 D329	I321-T325 VanDerWaalsContact O-CB 3.23Å; I321-T325 WeakPolarHBondContact O-CB 3.49Å; I321-T325 PolarHBondContact O-N 3.09Å; I321-T325 PolarHBondContact O-OG1 2.88Å; T325-M327 VanDerWaalsContact C-N 3.28Å; T325-M327 PolarHBondContact O-N 3.36Å; T325-K328 WeakPolarHBondContact O-CB 3.5Å; T325-K328 PolarHBondContact O-N 2.98Å; T325-K328 VanDerWaalsContact O-N 3.07Å; T325-D329 VanDerWaalsContact O-CG 3.23Å; T325-D329 PolarHBondContact O-N 2.92Å
326	R	94.4	Very high	90.2	Very high	139 Å²	139	65.2 Å²	65.2	53%	0.525	30%	0.303	S	S	.	.	H	α-helix	trans	-58.1	-39.4	176.1	-175.5	-179.6	62.9	-147.1	-4.5	112.5	E318 S322 Y323 R330	E318-R326 IonicContact OE1-NH2 2.93Å; E318-R326 IonicContact OE2-CZ 3.66Å; E318-R326 IonicContact OE2-NH1 2.69Å; E318-R326 IonicContact OE2-NH2 3Å; E318-R326 PolarHBondContact OE2-NH2 3.23Å; S322-R326 WeakPolarHBondContact O-CB 3.46Å; S322-R326 PolarHBondContact O-N 3.08Å; Y323-R326 PolarHBondContact O-N 2.95Å; R326-R330 WeakPolarHBondContact O-CB 3.32Å; R326-R330 PolarHBondContact O-N 3.38Å; R326-R330 VanDerWaalsContact O-N 3.1Å
327	M	91.6	Very high	90.9	Very high	57 Å²	57	63.4 Å²	63.4	28%	0.281	30%	0.295	S	S	.	.	H	α-helix	trans	-65.3	-43	176.1	-175.5	66.7	79.9	0	0	111.9	T279 Y323 Y324 T325 L331	T279-M327 HydrophobicContact CG2-CB 4.19Å; T279-M327 HydrophobicContact CG2-CG 4.16Å; Y323-M327 HydrophobicContact CE1-CE 4.38Å; Y323-M327 WeakPolarHBondContact O-CB 3.15Å; Y323-M327 PolarHBondContact O-N 2.75Å; Y323-M327 WeakPolarHBondContact OH-CE 3.47Å; Y324-M327 PolarHBondContact O-N 2.62Å; T325-M327 VanDerWaalsContact C-N 3.28Å; T325-M327 PolarHBondContact O-N 3.36Å; M327-L331 HydrophobicContact CG-CD1 4.09Å; M327-L331 WeakPolarHBondContact O-CB 3.39Å; M327-L331 VanDerWaalsContact O-CG 3.3Å; M327-L331 WeakPolarHBondContact O-CG 3.19Å; M327-L331 PolarHBondContact O-N 2.95Å
328	K	93.3	Very high	91.5	Very high	63 Å²	63	59.9 Å²	59.9	27%	0.274	28%	0.283	S	S	.	.	H	α-helix	trans	-60.5	-47.1	177.2	-173.4	-165.5	68.1	170.3	0	110.6	T279 E280 L283 Y324 T325 R330 L331 L332	T279-K328 HydrophobicContact CG2-CB 3.89Å; E280-K328 HydrophobicContact CG-CD 4.1Å; E280-K328 HydrophobicContact CG-CG 4.3Å; L283-K328 HydrophobicContact CD2-CD 4.34Å; Y324-K328 WeakPolarHBondContact O-CB 3.3Å; Y324-K328 PolarHBondContact O-N 3.36Å; T325-K328 WeakPolarHBondContact O-CB 3.5Å; T325-K328 PolarHBondContact O-N 2.98Å; T325-K328 VanDerWaalsContact O-N 3.07Å; K328-R330 PolarHBondContact O-N 3.35Å; K328-L331 PolarHBondContact O-N 3.47Å; K328-L331 VanDerWaalsContact O-N 3.17Å; K328-L332 PolarHBondContact O-N 3.3Å
329	D	93.5	Very high	91.5	Very high	78 Å²	78	58.7 Å²	58.7	42%	0.417	28%	0.277	S	S	.	.	H	α-helix	trans	-64.7	-43	-177.2	-59.4	-21.5	0	0	0	111	T325 L331 L332 E333	T325-D329 VanDerWaalsContact O-CG 3.23Å; T325-D329 PolarHBondContact O-N 2.92Å; D329-L331 VanDerWaalsContact C-N 3.32Å; D329-L331 PolarHBondContact O-N 3.36Å; D329-L332 WeakPolarHBondContact O-CB 3.35Å; D329-L332 PolarHBondContact O-N 3.39Å; D329-L332 VanDerWaalsContact O-N 3.17Å; D329-E333 PolarHBondContact O-N 3.44Å
330	R	95	Very high	91.3	Very high	138 Å²	138	61.8 Å²	61.8	52%	0.521	30%	0.3	S	S	.	.	H	α-helix	trans	-61.8	-37.2	173.5	-171.8	-177.2	-173.5	-175.8	6.1	113.1	R326 K328 R334	R326-R330 WeakPolarHBondContact O-CB 3.32Å; R326-R330 PolarHBondContact O-N 3.38Å; R326-R330 VanDerWaalsContact O-N 3.1Å; K328-R330 PolarHBondContact O-N 3.35Å; R330-R334 VanDerWaalsContact NH2-NH2 3.19Å; R330-R334 WeakPolarHBondContact O-CG 3.39Å; R330-R334 PolarHBondContact O-N 2.79Å
331	L	93.8	Very high	91.2	Very high	14 Å²	14	65.8 Å²	65.8	7%	0.073	32%	0.319	C	S	.	.	H	α-helix	trans	-70.1	-37.4	175.9	-74.8	168.5	0	0	0	111.1	L272 E275 R276 M327 K328 D329 R334 I335	L272-L331 HydrophobicContact CD2-CD2 4.18Å; E275-L331 HydrophobicContact CB-CD1 4.26Å; E275-L331 HydrophobicContact CB-CD2 4.3Å; R276-L331 HydrophobicContact CB-CB 4.43Å; M327-L331 HydrophobicContact CG-CD1 4.09Å; M327-L331 WeakPolarHBondContact O-CB 3.39Å; M327-L331 VanDerWaalsContact O-CG 3.3Å; M327-L331 WeakPolarHBondContact O-CG 3.19Å; M327-L331 PolarHBondContact O-N 2.95Å; K328-L331 PolarHBondContact O-N 3.47Å; K328-L331 VanDerWaalsContact O-N 3.17Å; D329-L331 VanDerWaalsContact C-N 3.32Å; D329-L331 PolarHBondContact O-N 3.36Å; L331-R334 PolarHBondContact O-N 2.95Å; L331-I335 WeakPolarHBondContact O-CB 3.39Å; L331-I335 WeakPolarHBondContact O-CD1 3.31Å; L331-I335 WeakPolarHBondContact O-CG1 3.22Å; L331-I335 PolarHBondContact O-N 3.35Å
332	L	92.6	Very high	90.9	Very high	76 Å²	76	65.1 Å²	65.1	40%	0.398	32%	0.316	S	S	.	.	H	α-helix	trans	-65.1	-44.5	177.4	-169.3	67.7	0	0	0	111.6	K328 D329 R334 I335 T336	K328-L332 PolarHBondContact O-N 3.3Å; D329-L332 WeakPolarHBondContact O-CB 3.35Å; D329-L332 PolarHBondContact O-N 3.39Å; D329-L332 VanDerWaalsContact O-N 3.17Å; L332-R334 PolarHBondContact O-N 3.01Å; L332-I335 WeakPolarHBondContact O-CB 3.5Å; L332-I335 PolarHBondContact O-N 3.44Å; L332-I335 VanDerWaalsContact O-N 3.15Å; L332-T336 PolarHBondContact O-N 3.02Å; L332-T336 PolarHBondContact O-OG1 3.45Å
333	E	93.1	Very high	90.3	Very high	113 Å²	113	68.8 Å²	68.8	53%	0.528	33%	0.326	S	S	.	.	H	α-helix	trans	-55.9	-49.9	174.2	-176.6	179.3	-154.9	0	0	111.2	D329 I335 T336 E337	D329-E333 PolarHBondContact O-N 3.44Å; E333-I335 VanDerWaalsContact C-N 3.31Å; E333-I335 PolarHBondContact O-N 3.26Å; E333-T336 WeakPolarHBondContact CA-OG1 3.47Å; E333-T336 PolarHBondContact O-N 2.79Å; E333-T336 VanDerWaalsContact O-N 3.15Å; E333-T336 PolarHBondContact O-OG1 3.06Å; E333-E337 WeakPolarHBondContact O-CG 3.41Å; E333-E337 PolarHBondContact O-N 2.74Å
334	R	93.6	Very high	89.9	Confident	104 Å²	104	73.1 Å²	73.1	39%	0.392	35%	0.351	S	S	.	.	H	α-helix	trans	-62.8	-35.3	176.2	-71.6	173.7	173.4	-166.7	-6.4	113.4	L272 R330 L331 L332 E338	L272-R334 HydrophobicContact CD1-CB 4.11Å; L272-R334 HydrophobicContact CD2-CB 4.43Å; R330-R334 VanDerWaalsContact NH2-NH2 3.19Å; R330-R334 WeakPolarHBondContact O-CG 3.39Å; R330-R334 PolarHBondContact O-N 2.79Å; L331-R334 PolarHBondContact O-N 2.95Å; L332-R334 PolarHBondContact O-N 3.01Å; R334-E338 WeakPolarHBondContact O-CB 3.4Å; R334-E338 VanDerWaalsContact O-CG 3.24Å; R334-E338 WeakPolarHBondContact O-CG 3.27Å; R334-E338 PolarHBondContact O-N 3.13Å
335	I	91.1	Very high	89.6	Confident	1 Å²	1	76.1 Å²	76.1	1%	0.005	37%	0.365	C	S	.	.	H	α-helix	trans	-64.8	-44.9	175.3	-76.1	165.1	0	0	0	109.6	L269 L272 R276 L331 L332 E333 E337 E338 E339 L760	L269-I335 HydrophobicContact CD1-CB 4.43Å; L269-I335 HydrophobicContact CD1-CG1 4.42Å; L269-I335 HydrophobicContact CD1-CG2 3.94Å; L272-I335 HydrophobicContact CB-CD1 4.34Å; L272-I335 HydrophobicContact CB-CG1 3.74Å; L272-I335 HydrophobicContact CD1-CG1 4.45Å; R276-I335 HydrophobicContact CB-CD1 3.99Å; R276-I335 HydrophobicContact CG-CD1 4.27Å; L331-I335 WeakPolarHBondContact O-CB 3.39Å; L331-I335 WeakPolarHBondContact O-CD1 3.31Å; L331-I335 WeakPolarHBondContact O-CG1 3.22Å; L331-I335 PolarHBondContact O-N 3.35Å; L332-I335 WeakPolarHBondContact O-CB 3.5Å; L332-I335 PolarHBondContact O-N 3.44Å; L332-I335 VanDerWaalsContact O-N 3.15Å; E333-I335 VanDerWaalsContact C-N 3.31Å; E333-I335 PolarHBondContact O-N 3.26Å; I335-E337 PolarHBondContact O-N 3.05Å; I335-E338 PolarHBondContact O-N 3.47Å; I335-E339 HydrophobicContact CG2-CG 4.46Å; I335-E339 WeakPolarHBondContact O-CB 3.46Å; I335-E339 WeakPolarHBondContact O-CG 3.18Å; I335-E339 PolarHBondContact O-N 3.39Å; I335-L760 HydrophobicContact CG2-CD1 4.33Å; I335-L760 HydrophobicContact CG2-CD2 4.36Å
336	T	89.3	Confident	89.4	Confident	58 Å²	58	75.7 Å²	75.7	36%	0.356	36%	0.363	S	S	.	.	H	α-helix	trans	-65	-38.6	178.4	50.2	0	0	0	0	113.1	L332 E333 C340	L332-T336 PolarHBondContact O-N 3.02Å; L332-T336 PolarHBondContact O-OG1 3.45Å; E333-T336 WeakPolarHBondContact CA-OG1 3.47Å; E333-T336 PolarHBondContact O-N 2.79Å; E333-T336 VanDerWaalsContact O-N 3.15Å; E333-T336 PolarHBondContact O-OG1 3.06Å; T336-C340 PolarHBondContact O-N 3.38Å; T336-C340 PolarHBondContact O-SG 3.44Å; T336-C340 VanDerWaalsContact O-SG 3.34Å
337	E	90.6	Very high	89.2	Confident	109 Å²	109	70.1 Å²	70.1	51%	0.509	34%	0.344	S	S	.	.	H	α-helix	trans	-62.1	-49.1	173.3	-70.9	173.2	168.6	0	0	111.4	E333 I335 E339 C340 H341	E333-E337 WeakPolarHBondContact O-CG 3.41Å; E333-E337 PolarHBondContact O-N 2.74Å; I335-E337 PolarHBondContact O-N 3.05Å; E337-E339 PolarHBondContact O-N 3.23Å; E337-C340 PolarHBondContact O-N 3.45Å; E337-H341 PolarHBondContact O-N 3.49Å
338	E	89.1	Confident	89.1	Confident	33 Å²	33	67.9 Å²	67.9	15%	0.154	34%	0.336	C	S	.	.	H	α-helix	trans	-68.3	-33.9	-178.6	-70.7	-64.5	144.6	0	0	112.7	K268 L269 L272 R334 I335 C340 H341 V342	K268-E338 HydrophobicContact CD-CG 4.4Å; K268-E338 WeakPolarHBondContact CD-OE2 3.38Å; K268-E338 WeakPolarHBondContact CE-OE1 3.24Å; K268-E338 IonicContact NZ-OE1 2.8Å; K268-E338 PolarHBondContact NZ-OE1 2.91Å; K268-E338 IonicContact NZ-OE2 2.68Å; L269-E338 HydrophobicContact CD1-CB 4.35Å; L272-E338 HydrophobicContact CD1-CB 4.37Å; L272-E338 HydrophobicContact CD1-CG 3.73Å; R334-E338 WeakPolarHBondContact O-CB 3.4Å; R334-E338 VanDerWaalsContact O-CG 3.24Å; R334-E338 WeakPolarHBondContact O-CG 3.27Å; R334-E338 PolarHBondContact O-N 3.13Å; I335-E338 PolarHBondContact O-N 3.47Å; E338-C340 VanDerWaalsContact C-N 3.28Å; E338-C340 PolarHBondContact O-N 2.81Å; E338-H341 CarbonylContact O-C 3.49Å; E338-H341 PolarHBondContact O-N 2.92Å; E338-H341 VanDerWaalsContact O-N 3.15Å; E338-V342 WeakPolarHBondContact O-CG2 3.49Å; E338-V342 PolarHBondContact O-N 3.45Å
339	E	85.6	Confident	89.1	Confident	34 Å²	34	65 Å²	65	16%	0.159	32%	0.323	C	S	.	.	H	α-helix	trans	-59.6	-38.8	175.4	-82.8	-177.6	-163	0	0	112.8	L269 I335 E337 H341 L760 R764	L269-E339 HydrophobicContact CD1-CG 4Å; L269-E339 HydrophobicContact CD2-CG 4.04Å; I335-E339 HydrophobicContact CG2-CG 4.46Å; I335-E339 WeakPolarHBondContact O-CB 3.46Å; I335-E339 WeakPolarHBondContact O-CG 3.18Å; I335-E339 PolarHBondContact O-N 3.39Å; E337-E339 PolarHBondContact O-N 3.23Å; E339-H341 VanDerWaalsContact C-N 3.33Å; E339-L760 WeakPolarHBondContact OE1-CD1 3.4Å; E339-R764 IonicContact OE1-NH2 3.41Å; E339-R764 PolarHBondContact OE1-NH2 3.23Å; E339-R764 IonicContact OE2-CZ 3.18Å; E339-R764 IonicContact OE2-NH1 2.86Å; E339-R764 PolarHBondContact OE2-NH1 2.91Å; E339-R764 IonicContact OE2-NH2 2.64Å; E339-R764 PolarHBondContact OE2-NH2 3.22Å
340	C	84.6	Confident	89	Confident	93 Å²	93	61.3 Å²	61.3	63%	0.628	30%	0.304	S	S	*	.	H	α-helix	trans	-64.6	-43	175.5	-61.8	0	0	0	0	110.3	T336 E337 E338 V342	T336-C340 PolarHBondContact O-N 3.38Å; T336-C340 PolarHBondContact O-SG 3.44Å; T336-C340 VanDerWaalsContact O-SG 3.34Å; E337-C340 PolarHBondContact O-N 3.45Å; E338-C340 VanDerWaalsContact C-N 3.28Å; E338-C340 PolarHBondContact O-N 2.81Å; C340-V342 PolarHBondContact O-N 3.37Å
341	H	86	Confident	89	Confident	85 Å²	85	55 Å²	55	39%	0.394	28%	0.28	S	S	.	.	H	α-helix	trans	-73.5	-23.1	-178.2	-172.9	-95.2	0	0	0	114	E337 E338 E339 Q343 D344 Q345	E337-H341 PolarHBondContact O-N 3.49Å; E338-H341 CarbonylContact O-C 3.49Å; E338-H341 PolarHBondContact O-N 2.92Å; E338-H341 VanDerWaalsContact O-N 3.15Å; E339-H341 VanDerWaalsContact C-N 3.33Å; H341-Q343 VanDerWaalsContact C-N 3.28Å; H341-Q343 PolarHBondContact O-N 2.97Å; H341-D344 PolarHBondContact O-N 3.31Å; H341-Q345 PolarHBondContact CE1-NE2 3.01Å
342	V	84.4	Confident	89	Confident	15 Å²	15	54.3 Å²	54.3	9%	0.091	28%	0.276	C	S	.	.	H	α-helix	trans	-63.3	-35.2	178.5	165.7	0	0	0	0	111.6	Y264 V266 L269 E338 C340 D344 Q345	Y264-V342 VanDerWaalsContact CB-CG1 3.49Å; Y264-V342 VanDerWaalsContact CD1-O 3.29Å; Y264-V342 WeakPolarHBondContact CD1-O 3.09Å; Y264-V342 HydrophobicContact CG-CG1 4.15Å; V266-V342 HydrophobicContact CG1-CG1 3.98Å; L269-V342 HydrophobicContact CB-CG2 4.48Å; L269-V342 HydrophobicContact CD2-CG2 4.2Å; E338-V342 WeakPolarHBondContact O-CG2 3.49Å; E338-V342 PolarHBondContact O-N 3.45Å; C340-V342 PolarHBondContact O-N 3.37Å; V342-D344 PolarHBondContact O-N 3.37Å; V342-Q345 PolarHBondContact O-N 3.25Å; V342-Q345 VanDerWaalsContact O-N 3.1Å
343	Q	78.6	Confident	88.9	Confident	145 Å²	145	51.4 Å²	51.4	68%	0.678	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-28.5	178.3	-63.3	-174	9.5	0	0	112.2	H341 Q345	H341-Q343 VanDerWaalsContact C-N 3.28Å; H341-Q343 PolarHBondContact O-N 2.97Å; Q343-Q345 VanDerWaalsContact C-N 3.26Å; Q343-Q345 PolarHBondContact O-N 2.99Å
344	D	83.4	Confident	88.8	Confident	125 Å²	125	46 Å²	46	67%	0.668	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-3.7	177.8	-60.3	-35.5	0	0	0	113.4	H341 V342 P346	H341-D344 PolarHBondContact O-N 3.31Å; V342-D344 PolarHBondContact O-N 3.37Å; D344-P346 VanDerWaalsContact O-CD 3.28Å; D344-P346 WeakPolarHBondContact O-CD 3.17Å
345	Q	85	Confident	88.5	Confident	73 Å²	73	45 Å²	45	34%	0.341	24%	0.236	S	C	.	.			trans	-120.5	63.1	-178.2	-60.1	-158.9	-21.7	0	0	113.8	N265 H341 V342 Q343	N265-Q345 HydrophobicContact CB-CB 3.95Å; N265-Q345 PolarHBondContact N-O 3.36Å; N265-Q345 VanDerWaalsContact N-O 3.07Å; N265-Q345 PolarHBondContact ND2-OE1 2.82Å; H341-Q345 PolarHBondContact CE1-NE2 3.01Å; V342-Q345 PolarHBondContact O-N 3.25Å; V342-Q345 VanDerWaalsContact O-N 3.1Å; Q343-Q345 VanDerWaalsContact C-N 3.26Å; Q343-Q345 PolarHBondContact O-N 2.99Å
346	P	89.4	Confident	88.3	Confident	37 Å²	37	49.7 Å²	49.7	24%	0.24	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	139.6	175.7	28.8	-33.6	0	0	0	111.6	R237 Y264 D344	R237-P346 HydrophobicContact CB-CG 4.05Å; R237-P346 WeakPolarHBondContact O-CB 3.49Å; R237-P346 WeakPolarHBondContact O-CG 3.35Å; Y264-P346 HydrophobicContact CD1-CB 4.3Å; Y264-P346 HydrophobicContact CE1-CB 4.25Å; D344-P346 VanDerWaalsContact O-CD 3.28Å; D344-P346 WeakPolarHBondContact O-CD 3.17Å
347	L	89.3	Confident	88.1	Confident	21 Å²	21	49.5 Å²	49.5	11%	0.11	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-5	-176.3	-62.9	178.6	0	0	0	114	C263 Y264 N265 M349 L411 Q414	C263-L347 HydrophobicContact CB-CB 4.38Å; C263-L347 HydrophobicContact CB-CD1 4.35Å; C263-L347 WeakPolarHBondContact O-CB 2.94Å; C263-L347 PolarHBondContact O-N 3.24Å; Y264-L347 WeakPolarHBondContact O-CD1 3.29Å; N265-L347 HydrophobicContact CB-CD2 4.14Å; L347-M349 VanDerWaalsContact C-N 3.34Å; L347-M349 HydrophobicContact CB-CE 3.72Å; L347-M349 HydrophobicContact CD1-CE 3.64Å; L347-M349 HydrophobicContact CG-CE 4.34Å; L347-L411 HydrophobicContact CD1-CB 4.01Å; L347-Q414 PolarHBondContact O-OE1 3.42Å
348	G	90.3	Very high	87.8	Confident	11 Å²	11	47.4 Å²	47.4	11%	0.113	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	68.4	32.8	-175.2	0	0	0	0	0	113.2	G234 L235	G234-G348 PolarHBondContact N-O 2.95Å; G234-G348 VanDerWaalsContact N-O 3.15Å; L235-G348 PolarHBondContact N-O 3.49Å; L235-G348 VanDerWaalsContact O-CA 3.26Å; L235-G348 WeakPolarHBondContact O-CA 3.38Å
349	M	92.4	Very high	87.9	Confident	3 Å²	3	47 Å²	47	2%	0.015	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	150.3	177.1	-51.1	-179.4	-64	0	0	110.5	F231 I232 T233 C263 L347 L411 Q414	F231-M349 HydrophobicContact CE2-CB 4.01Å; F231-M349 HydrophobicContact CE2-SD 4.16Å; F231-M349 HydrophobicContact CZ-CB 4.39Å; F231-M349 HydrophobicContact CZ-CG 4.45Å; F231-M349 HydrophobicContact CZ-SD 3.69Å; I232-M349 CarbonylContact O-C 3.56Å; I232-M349 VanDerWaalsContact O-CA 3.22Å; I232-M349 WeakPolarHBondContact O-CA 3.18Å; T233-M349 HydrophobicContact CG2-CG 4Å; T233-M349 HydrophobicContact CG2-SD 4.11Å; C263-M349 HydrophobicContact CB-CB 3.92Å; C263-M349 HydrophobicContact CB-CE 4.01Å; C263-M349 WeakPolarHBondContact CB-O 3.34Å; C263-M349 PolarHBondContact N-O 3.28Å; L347-M349 VanDerWaalsContact C-N 3.34Å; L347-M349 HydrophobicContact CB-CE 3.72Å; L347-M349 HydrophobicContact CD1-CE 3.64Å; L347-M349 HydrophobicContact CG-CE 4.34Å; M349-L411 HydrophobicContact CE-CB 3.89Å; M349-L411 HydrophobicContact CE-CD2 3.97Å; M349-L411 HydrophobicContact CE-CG 4.35Å; M349-Q414 PolarHBondContact SD-NE2 2.91Å
350	A	93.1	Very high	88	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	145.1	-179.9	0	0	0	0	0	111.7	I232 L235 Q261 L262 V352	I232-A350 PolarHBondContact N-O 2.97Å; I232-A350 PolarHBondContact O-N 3.31Å; L235-A350 HydrophobicContact CD1-CB 4.13Å; L235-A350 HydrophobicContact CD2-CB 4Å; Q261-A350 CarbonylContact O-C 3.55Å; Q261-A350 WeakPolarHBondContact O-CA 3.29Å; L262-A350 HydrophobicContact CD2-CB 3.96Å; A350-V352 HydrophobicContact CB-CG2 4.47Å
351	F	93.6	Very high	88.1	Confident	5 Å²	5	42.6 Å²	42.6	2%	0.022	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	127	162.7	-63.9	-79.3	0	0	0	108.4	T229 L230 F231 V260 Q261 C263 A400 I406 W408 Y752	T229-F351 HydrophobicContact CG2-CB 4.13Å; T229-F351 HydrophobicContact CG2-CD1 4.45Å; L230-F351 WeakPolarHBondContact O-CA 3.34Å; F231-F351 HydrophobicContact CB-CD1 4.15Å; F231-F351 HydrophobicContact CB-CE1 3.97Å; F231-F351 AromaticContact CD2-CD1 3.77Å; F231-F351 HydrophobicContact CD2-CD1 3.77Å; F231-F351 AromaticContact CD2-CE1 3.27Å; F231-F351 HydrophobicContact CD2-CE1 3.27Å; F231-F351 HydrophobicContact CD2-CE2 4.23Å; F231-F351 HydrophobicContact CD2-CG 4.42Å; F231-F351 AromaticContact CD2-CZ 3.52Å; F231-F351 HydrophobicContact CD2-CZ 3.52Å; F231-F351 AromaticContact CE2-CE1 3.97Å; F231-F351 HydrophobicContact CE2-CE1 3.97Å; F231-F351 HydrophobicContact CE2-CE2 4.27Å; F231-F351 AromaticContact CE2-CZ 3.71Å; F231-F351 HydrophobicContact CE2-CZ 3.71Å; F231-F351 HydrophobicContact CG-CD1 4.38Å; F231-F351 AromaticContact CG-CE1 3.86Å; F231-F351 HydrophobicContact CG-CE1 3.86Å; F231-F351 HydrophobicContact CG-CZ 4.42Å; V260-F351 WeakPolarHBondContact CA-O 3.2Å; Q261-F351 HydrophobicContact CB-CB 4.41Å; Q261-F351 PolarHBondContact N-O 2.84Å; Q261-F351 PolarHBondContact O-N 3.37Å; C263-F351 WeakPolarHBondContact SG-CE2 3.44Å; F351-A400 HydrophobicContact CD1-CB 3.87Å; F351-A400 HydrophobicContact CE1-CB 4.07Å; F351-I406 HydrophobicContact CE1-CD1 3.77Å; F351-I406 HydrophobicContact CE2-CD1 4.46Å; F351-I406 HydrophobicContact CZ-CD1 3.58Å; F351-W408 HydrophobicContact CD2-CH2 4.32Å; F351-W408 AromaticContact CE2-CH2 3.73Å; F351-W408 HydrophobicContact CE2-CH2 3.73Å; F351-W408 AromaticContact CE2-CZ3 3.93Å; F351-W408 HydrophobicContact CE2-CZ3 3.93Å; F351-W408 HydrophobicContact CZ-CH2 4.39Å; F351-Y752 HydrophobicContact CB-CD1 4.43Å; F351-Y752 HydrophobicContact CB-CG 4.05Å; F351-Y752 AromaticContact CD1-CD1 3.6Å; F351-Y752 HydrophobicContact CD1-CD1 3.6Å; F351-Y752 HydrophobicContact CD1-CE1 4.02Å; F351-Y752 HydrophobicContact CD1-CG 4.07Å; F351-Y752 HydrophobicContact CD2-CD1 4.29Å; F351-Y752 HydrophobicContact CD2-CG 4.43Å; F351-Y752 AromaticContact CE1-CD1 3.85Å; F351-Y752 HydrophobicContact CE1-CD1 3.85Å; F351-Y752 HydrophobicContact CE1-CE1 4.15Å; F351-Y752 AromaticContact CG-CD1 3.85Å; F351-Y752 HydrophobicContact CG-CD1 3.85Å; F351-Y752 AromaticContact CG-CG 3.93Å; F351-Y752 HydrophobicContact CG-CG 3.93Å; F351-Y752 HydrophobicContact CZ-CD1 4.32Å
352	V	93.1	Very high	88.2	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	114.2	179.8	-177.5	0	0	0	0	108.5	T229 L230 I232 V244 F248 V257 V260 A350 F354	T229-V352 CarbonylContact C-O 3.59Å; T229-V352 WeakPolarHBondContact CA-O 3.34Å; T229-V352 WeakPolarHBondContact CG2-O 3.47Å; L230-V352 PolarHBondContact N-O 3Å; L230-V352 PolarHBondContact O-N 2.63Å; I232-V352 HydrophobicContact CD1-CB 4.37Å; I232-V352 HydrophobicContact CD1-CG2 3.65Å; I232-V352 HydrophobicContact CG1-CG2 4.48Å; V244-V352 HydrophobicContact CG1-CG2 4.3Å; F248-V352 HydrophobicContact CD2-CG1 4.14Å; F248-V352 HydrophobicContact CE2-CB 4.46Å; F248-V352 HydrophobicContact CE2-CG1 4.09Å; F248-V352 HydrophobicContact CE2-CG2 3.95Å; V257-V352 HydrophobicContact CG1-CG1 4Å; V260-V352 HydrophobicContact CG1-CG2 4.37Å; V260-V352 HydrophobicContact CG2-CG1 4.07Å; V260-V352 HydrophobicContact CG2-CG2 4.19Å; A350-V352 HydrophobicContact CB-CG2 4.47Å; V352-F354 HydrophobicContact CB-CE2 4.12Å; V352-F354 HydrophobicContact CB-CZ 4.31Å; V352-F354 HydrophobicContact CG1-CD2 4.42Å; V352-F354 HydrophobicContact CG1-CE1 4.12Å; V352-F354 HydrophobicContact CG1-CE2 3.62Å; V352-F354 HydrophobicContact CG1-CZ 3.45Å; V352-F354 VanDerWaalsContact CG1-CZ 3.45Å
353	T	91.2	Very high	88.4	Confident	14 Å²	14	42.8 Å²	42.8	9%	0.086	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128.8	-178.5	-59.9	0	0	0	0	110	T229 V258 D259	T229-T353 WeakPolarHBondContact CG2-OG1 3.34Å; T229-T353 PolarHBondContact OG1-OG1 3.5Å; V258-T353 HydrophobicContact CB-CG2 4.41Å; V258-T353 PolarHBondContact N-O 2.86Å; D259-T353 PolarHBondContact N-O 3.28Å; D259-T353 PolarHBondContact O-N 2.99Å
354	F	90.9	Very high	88.8	Confident	1 Å²	1	37 Å²	37	0%	0.004	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	160	177.7	-60.4	-87.2	0	0	0	111.1	R228 L230 F248 C255 E256 V257 V352 E356 M359 A360 I363	R228-F354 WeakPolarHBondContact O-CD2 3.37Å; R228-F354 PolarHBondContact O-N 3.25Å; L230-F354 HydrophobicContact CB-CE2 4.23Å; L230-F354 HydrophobicContact CD1-CD2 4.4Å; L230-F354 HydrophobicContact CD1-CE2 3.58Å; L230-F354 HydrophobicContact CD1-CZ 4.22Å; L230-F354 HydrophobicContact CG-CD2 4.31Å; L230-F354 HydrophobicContact CG-CE2 3.78Å; F248-F354 HydrophobicContact CD1-CE1 4.21Å; F248-F354 AromaticContact CD1-CZ 3.98Å; F248-F354 HydrophobicContact CD1-CZ 3.98Å; F248-F354 HydrophobicContact CE1-CZ 4.07Å; F248-F354 HydrophobicContact CG-CE1 4.44Å; F248-F354 HydrophobicContact CG-CZ 4.36Å; F248-F354 HydrophobicContact CZ-CZ 4.49Å; C255-F354 HydrophobicContact CB-CD1 4.35Å; E256-F354 WeakPolarHBondContact O-CA 3.33Å; V257-F354 HydrophobicContact CG2-CD1 4.15Å; V257-F354 HydrophobicContact CG2-CE1 3.76Å; V352-F354 HydrophobicContact CB-CE2 4.12Å; V352-F354 HydrophobicContact CB-CZ 4.31Å; V352-F354 HydrophobicContact CG1-CD2 4.42Å; V352-F354 HydrophobicContact CG1-CE1 4.12Å; V352-F354 HydrophobicContact CG1-CE2 3.62Å; V352-F354 HydrophobicContact CG1-CZ 3.45Å; V352-F354 VanDerWaalsContact CG1-CZ 3.45Å; F354-E356 PolarHBondContact O-N 3.46Å; F354-M359 HydrophobicContact CB-CB 4.16Å; F354-M359 HydrophobicContact CG-CB 4.48Å; F354-A360 HydrophobicContact CD2-CB 3.92Å; F354-I363 HydrophobicContact CD1-CD1 4.03Å; F354-I363 HydrophobicContact CE1-CD1 3.28Å; F354-I363 HydrophobicContact CE2-CD1 4.03Å; F354-I363 HydrophobicContact CZ-CD1 3.29Å
355	Q	88.3	Confident	88.9	Confident	82 Å²	82	37.8 Å²	37.8	38%	0.383	19%	0.188	S	C	.	.	S	Bend	trans	-63.6	-43.7	-179.9	-170.7	-178	46.6	0	0	111.9	R228 E256 V258 M359	R228-Q355 WeakPolarHBondContact CD-O 3.21Å; R228-Q355 PolarHBondContact NH1-O 2.88Å; E256-Q355 HydrophobicContact CB-CB 4.25Å; E256-Q355 PolarHBondContact O-N 3.42Å; E256-Q355 VanDerWaalsContact O-N 3.13Å; E256-Q355 VanDerWaalsContact OE2-CD 3.25Å; E256-Q355 PolarHBondContact OE2-NE2 2.88Å; E256-Q355 VanDerWaalsContact OE2-NE2 3.08Å; E256-Q355 PolarHBondContact OE2-OE1 3.32Å; E256-Q355 VanDerWaalsContact OE2-OE1 3.13Å; V258-Q355 HydrophobicContact CG2-CB 4.09Å; Q355-M359 HydrophobicContact CB-CE 4.39Å; Q355-M359 HydrophobicContact CB-SD 4.17Å
356	E	86	Confident	89	Confident	99 Å²	99	35.4 Å²	35.4	46%	0.463	18%	0.178	S	C	.	.			trans	-122.1	152.1	-179.1	-63.5	-167.6	169.3	0	0	113.7	F354 S358 M359	F354-E356 PolarHBondContact O-N 3.46Å; E356-S358 VanDerWaalsContact C-N 3.27Å; E356-S358 VanDerWaalsContact CB-OG 3.28Å; E356-S358 WeakPolarHBondContact CB-OG 3.37Å; E356-S358 PolarHBondContact O-N 3.43Å; E356-S358 PolarHBondContact OE2-OG 3.42Å; E356-M359 HydrophobicContact CB-CE 4.17Å; E356-M359 HydrophobicContact CB-CG 4.17Å; E356-M359 HydrophobicContact CB-SD 4.13Å; E356-M359 HydrophobicContact CG-CE 4.09Å; E356-M359 WeakPolarHBondContact O-CB 3.45Å; E356-M359 PolarHBondContact O-N 2.73Å
357	K	84.8	Confident	88.7	Confident	54 Å²	54	35.2 Å²	35.2	24%	0.235	17%	0.173	C	C	.	.	H	α-helix	trans	-64.8	-33	176	169.4	-173.8	170.8	-165.3	0	112.1	R227 R228 M359 A360 T361	R227-K357 HydrophobicContact CB-CB 4.43Å; R227-K357 HydrophobicContact CB-CD 3.84Å; R227-K357 HydrophobicContact CB-CG 3.79Å; R228-K357 HydrophobicContact CG-CB 4.21Å; K357-M359 VanDerWaalsContact C-N 3.28Å; K357-M359 PolarHBondContact O-N 3.07Å; K357-A360 PolarHBondContact O-N 3.29Å; K357-T361 WeakPolarHBondContact O-CB 3.27Å; K357-T361 PolarHBondContact O-N 3.49Å; K357-T361 PolarHBondContact O-OG1 3.37Å
358	S	85.4	Confident	88.2	Confident	66 Å²	66	39.4 Å²	39.4	46%	0.462	20%	0.196	S	C	.	.	H	α-helix	trans	-55.7	-44.8	177	53.9	0	0	0	0	110.8	E356 T361 Y362	E356-S358 VanDerWaalsContact C-N 3.27Å; E356-S358 VanDerWaalsContact CB-OG 3.28Å; E356-S358 WeakPolarHBondContact CB-OG 3.37Å; E356-S358 PolarHBondContact O-N 3.43Å; E356-S358 PolarHBondContact OE2-OG 3.42Å; S358-T361 PolarHBondContact O-N 3.49Å; S358-Y362 WeakPolarHBondContact O-CB 3.41Å; S358-Y362 PolarHBondContact O-N 2.96Å
359	M	89.8	Confident	87.5	Confident	23 Å²	23	40.7 Å²	40.7	11%	0.113	21%	0.205	C	C	.	.	H	α-helix	trans	-63.9	-52	179.3	-59.5	170.7	-177.4	0	0	111.8	C255 E256 F354 Q355 E356 K357 T361 Y362 I363	C255-M359 HydrophobicContact CB-CB 4.03Å; C255-M359 HydrophobicContact CB-CG 4.22Å; C255-M359 HydrophobicContact CB-SD 4.45Å; E256-M359 PolarHBondContact N-SD 3.15Å; F354-M359 HydrophobicContact CB-CB 4.16Å; F354-M359 HydrophobicContact CG-CB 4.48Å; Q355-M359 HydrophobicContact CB-CE 4.39Å; Q355-M359 HydrophobicContact CB-SD 4.17Å; E356-M359 HydrophobicContact CB-CE 4.17Å; E356-M359 HydrophobicContact CB-CG 4.17Å; E356-M359 HydrophobicContact CB-SD 4.13Å; E356-M359 HydrophobicContact CG-CE 4.09Å; E356-M359 WeakPolarHBondContact O-CB 3.45Å; E356-M359 PolarHBondContact O-N 2.73Å; K357-M359 VanDerWaalsContact C-N 3.28Å; K357-M359 PolarHBondContact O-N 3.07Å; M359-T361 VanDerWaalsContact C-N 3.26Å; M359-T361 PolarHBondContact O-N 3.29Å; M359-Y362 WeakPolarHBondContact O-CB 3.35Å; M359-Y362 PolarHBondContact O-N 3.39Å; M359-Y362 VanDerWaalsContact O-N 3.14Å; M359-I363 WeakPolarHBondContact O-CG1 3.42Å; M359-I363 PolarHBondContact O-N 3.31Å
360	A	87.8	Confident	86.2	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-59.5	-39.4	177	0	0	0	0	0	111.7	R227 L230 F354 K357 L364 F399	R227-A360 WeakPolarHBondContact O-CB 3.4Å; L230-A360 HydrophobicContact CD1-CB 4.48Å; L230-A360 HydrophobicContact CD2-CB 4.04Å; L230-A360 HydrophobicContact CG-CB 4.07Å; F354-A360 HydrophobicContact CD2-CB 3.92Å; K357-A360 PolarHBondContact O-N 3.29Å; A360-L364 VanDerWaalsContact O-CB 3.26Å; A360-L364 WeakPolarHBondContact O-CB 3.32Å; A360-L364 PolarHBondContact O-N 3.2Å; A360-F399 HydrophobicContact CB-CE1 4.23Å
361	T	87.3	Confident	84.4	Confident	35 Å²	35	50.5 Å²	50.5	22%	0.215	26%	0.258	C	S	.	.	H	α-helix	trans	-68	-37.8	177.1	-54.6	0	0	0	0	112.1	K357 S358 M359 K365	K357-T361 WeakPolarHBondContact O-CB 3.27Å; K357-T361 PolarHBondContact O-N 3.49Å; K357-T361 PolarHBondContact O-OG1 3.37Å; S358-T361 PolarHBondContact O-N 3.49Å; M359-T361 VanDerWaalsContact C-N 3.26Å; M359-T361 PolarHBondContact O-N 3.29Å; T361-K365 HydrophobicContact CG2-CD 4.35Å; T361-K365 WeakPolarHBondContact O-CB 3.37Å; T361-K365 VanDerWaalsContact O-CG 3.29Å; T361-K365 WeakPolarHBondContact O-CG 3.34Å; T361-K365 PolarHBondContact O-N 2.89Å
362	Y	88	Confident	82.5	Confident	105 Å²	105	54 Å²	54	41%	0.412	28%	0.283	S	S	.	.	H	α-helix	trans	-62.7	-49.6	176.7	173.3	-115.6	0	0	0	111.2	Y252 S358 M359 L364 K365 D366 Q382	Y252-Y362 HydrophobicContact CD1-CD1 4.15Å; Y252-Y362 AromaticContact CD1-CE1 3.75Å; Y252-Y362 HydrophobicContact CD1-CE1 3.75Å; Y252-Y362 HydrophobicContact CE1-CE1 4.19Å; S358-Y362 WeakPolarHBondContact O-CB 3.41Å; S358-Y362 PolarHBondContact O-N 2.96Å; M359-Y362 WeakPolarHBondContact O-CB 3.35Å; M359-Y362 PolarHBondContact O-N 3.39Å; M359-Y362 VanDerWaalsContact O-N 3.14Å; Y362-L364 PolarHBondContact O-N 3.38Å; Y362-K365 WeakPolarHBondContact O-CB 3.33Å; Y362-K365 PolarHBondContact O-N 3.32Å; Y362-D366 PolarHBondContact O-N 3.4Å; Y362-Q382 PolarHBondContact OH-NE2 3Å; Y362-Q382 VanDerWaalsContact OH-NE2 3.16Å
363	I	88.9	Confident	80.1	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-61.2	-47.2	176.9	-65.9	167.9	0	0	0	110.5	L230 F248 Y252 C255 F354 M359 K365 D366 F367	L230-I363 HydrophobicContact CD1-CB 3.95Å; L230-I363 HydrophobicContact CD1-CG2 3.64Å; F248-I363 HydrophobicContact CD1-CD1 4.07Å; F248-I363 HydrophobicContact CE1-CD1 4.22Å; F248-I363 HydrophobicContact CE1-CG2 3.99Å; Y252-I363 HydrophobicContact CD1-CG1 3.83Å; Y252-I363 HydrophobicContact CD2-CD1 4.34Å; Y252-I363 HydrophobicContact CD2-CG1 4.17Å; Y252-I363 HydrophobicContact CE1-CG1 3.94Å; Y252-I363 HydrophobicContact CE2-CG1 4.29Å; Y252-I363 HydrophobicContact CE2-CG2 4.36Å; Y252-I363 HydrophobicContact CG-CD1 4.26Å; Y252-I363 HydrophobicContact CG-CG1 3.93Å; C255-I363 HydrophobicContact CB-CD1 4.18Å; F354-I363 HydrophobicContact CD1-CD1 4.03Å; F354-I363 HydrophobicContact CE1-CD1 3.28Å; F354-I363 HydrophobicContact CE2-CD1 4.03Å; F354-I363 HydrophobicContact CZ-CD1 3.29Å; M359-I363 WeakPolarHBondContact O-CG1 3.42Å; M359-I363 PolarHBondContact O-N 3.31Å; I363-K365 VanDerWaalsContact C-N 3.25Å; I363-K365 PolarHBondContact O-N 2.92Å; I363-D366 PolarHBondContact O-N 3.48Å; I363-D366 VanDerWaalsContact O-N 3.1Å; I363-F367 HydrophobicContact CG2-CD2 3.81Å; I363-F367 HydrophobicContact CG2-CE2 3.87Å; I363-F367 WeakPolarHBondContact O-CD2 3.46Å; I363-F367 PolarHBondContact O-N 3.23Å
364	L	87.6	Confident	78.2	Confident	23 Å²	23	67.4 Å²	67.4	12%	0.12	36%	0.357	C	S	.	.	H	α-helix	trans	-59.2	-37.7	177.9	-176.3	68.5	0	0	0	112.3	L230 A360 Y362 N368 V397 F399	L230-L364 HydrophobicContact CD2-CB 4.33Å; A360-L364 VanDerWaalsContact O-CB 3.26Å; A360-L364 WeakPolarHBondContact O-CB 3.32Å; A360-L364 PolarHBondContact O-N 3.2Å; Y362-L364 PolarHBondContact O-N 3.38Å; L364-N368 VanDerWaalsContact CD1-ND2 3.35Å; L364-N368 WeakPolarHBondContact CD1-ND2 3.3Å; L364-N368 WeakPolarHBondContact O-CB 3.4Å; L364-N368 PolarHBondContact O-N 2.68Å; L364-N368 VanDerWaalsContact O-N 3.17Å; L364-N368 PolarHBondContact O-ND2 3.4Å; L364-V397 HydrophobicContact CD1-CB 4.34Å; L364-V397 HydrophobicContact CD1-CG1 3.98Å; L364-V397 WeakPolarHBondContact CD1-O 3.39Å; L364-F399 HydrophobicContact CD2-CD2 3.52Å; L364-F399 HydrophobicContact CD2-CE1 4.21Å; L364-F399 HydrophobicContact CD2-CE2 3.14Å; L364-F399 HydrophobicContact CD2-CG 4.21Å; L364-F399 HydrophobicContact CD2-CZ 3.53Å
365	K	85.4	Confident	76.1	Confident	141 Å²	141	76 Å²	76	61%	0.613	40%	0.401	S	S	*	.	H	α-helix	trans	-67.5	-38.9	176	-79.4	176.6	178.9	179.4	0	112	T361 Y362 I363 N368 A369	T361-K365 HydrophobicContact CG2-CD 4.35Å; T361-K365 WeakPolarHBondContact O-CB 3.37Å; T361-K365 VanDerWaalsContact O-CG 3.29Å; T361-K365 WeakPolarHBondContact O-CG 3.34Å; T361-K365 PolarHBondContact O-N 2.89Å; Y362-K365 WeakPolarHBondContact O-CB 3.33Å; Y362-K365 PolarHBondContact O-N 3.32Å; I363-K365 VanDerWaalsContact C-N 3.25Å; I363-K365 PolarHBondContact O-N 2.92Å; K365-N368 PolarHBondContact O-N 2.8Å; K365-A369 WeakPolarHBondContact O-CB 3.41Å; K365-A369 PolarHBondContact O-N 3.16Å
366	D	86.8	Confident	73.9	Confident	24 Å²	24	79.9 Å²	79.9	13%	0.128	42%	0.42	C	S	.	.	H	α-helix	trans	-64.9	-48.2	177.9	-169.9	59.4	0	0	0	111.6	Y252 Y362 I363 N368 A369 P381 Q382	Y252-D366 HydrophobicContact CE1-CB 4.4Å; Y252-D366 PolarHBondContact OH-OD2 2.98Å; Y362-D366 PolarHBondContact O-N 3.4Å; I363-D366 PolarHBondContact O-N 3.48Å; I363-D366 VanDerWaalsContact O-N 3.1Å; D366-N368 VanDerWaalsContact C-N 3.26Å; D366-N368 PolarHBondContact O-N 3.06Å; D366-A369 WeakPolarHBondContact O-CB 3.3Å; D366-A369 PolarHBondContact O-N 3.03Å; D366-A369 VanDerWaalsContact O-N 3.11Å; D366-P381 VanDerWaalsContact OD2-CA 3.24Å; D366-P381 WeakPolarHBondContact OD2-CA 3.18Å; D366-P381 WeakPolarHBondContact OD2-CB 3.43Å; D366-Q382 WeakPolarHBondContact OD2-CG 3.43Å; D366-Q382 PolarHBondContact OD2-N 2.92Å
367	F	83.8	Confident	72.4	Confident	33 Å²	33	78.7 Å²	78.7	15%	0.145	42%	0.422	C	S	.	.	H	α-helix	trans	-63.6	-28.6	177.2	-85.4	-91.8	0	0	0	113.7	Y252 I363 P381 W395 V397	Y252-F367 HydrophobicContact CE2-CE2 4.31Å; Y252-F367 WeakPolarHBondContact OH-CE2 3.35Å; I363-F367 HydrophobicContact CG2-CD2 3.81Å; I363-F367 HydrophobicContact CG2-CE2 3.87Å; I363-F367 WeakPolarHBondContact O-CD2 3.46Å; I363-F367 PolarHBondContact O-N 3.23Å; F367-P381 HydrophobicContact CD1-CB 4Å; F367-P381 HydrophobicContact CD1-CG 4.04Å; F367-P381 HydrophobicContact CD2-CB 4.18Å; F367-P381 HydrophobicContact CE1-CB 3.91Å; F367-P381 HydrophobicContact CE1-CG 3.69Å; F367-P381 HydrophobicContact CE2-CB 4.1Å; F367-P381 HydrophobicContact CG-CB 4.15Å; F367-P381 HydrophobicContact CZ-CB 3.96Å; F367-P381 HydrophobicContact CZ-CG 4.04Å; F367-W395 HydrophobicContact CE1-CB 4.04Å; F367-W395 AromaticContact CE1-CE3 3.95Å; F367-W395 HydrophobicContact CE1-CE3 3.95Å; F367-W395 AromaticContact CZ-CE3 3.8Å; F367-W395 HydrophobicContact CZ-CE3 3.8Å; F367-W395 HydrophobicContact CZ-CZ3 4.33Å; F367-V397 HydrophobicContact CB-CB 4.24Å; F367-V397 HydrophobicContact CB-CG2 4.16Å; F367-V397 HydrophobicContact CD1-CG2 3.63Å; F367-V397 HydrophobicContact CD2-CG2 4.09Å; F367-V397 HydrophobicContact CE1-CG2 3.97Å; F367-V397 HydrophobicContact CE2-CG2 4.39Å; F367-V397 HydrophobicContact CG-CB 4.28Å; F367-V397 HydrophobicContact CG-CG2 3.69Å; F367-V397 HydrophobicContact CZ-CG2 4.34Å
368	N	78.6	Confident	71.1	Confident	109 Å²	109	84.9 Å²	84.9	58%	0.583	45%	0.448	S	S	*	.	H	α-helix	trans	-92.7	-5.3	176.4	-72	-55	0	0	0	113.7	L364 K365 D366 C370	L364-N368 VanDerWaalsContact CD1-ND2 3.35Å; L364-N368 WeakPolarHBondContact CD1-ND2 3.3Å; L364-N368 WeakPolarHBondContact O-CB 3.4Å; L364-N368 PolarHBondContact O-N 2.68Å; L364-N368 VanDerWaalsContact O-N 3.17Å; L364-N368 PolarHBondContact O-ND2 3.4Å; K365-N368 PolarHBondContact O-N 2.8Å; D366-N368 VanDerWaalsContact C-N 3.26Å; D366-N368 PolarHBondContact O-N 3.06Å; N368-C370 PolarHBondContact O-N 3.37Å; N368-C370 VanDerWaalsContact O-N 3.1Å
369	A	74.6	Confident	69.9	Low	38 Å²	38	83.2 Å²	83.2	31%	0.314	44%	0.442	S	S	.	.			trans	-71.9	107.7	-178.6	0	0	0	0	0	109.9	K365 D366 K371 G379	K365-A369 WeakPolarHBondContact O-CB 3.41Å; K365-A369 PolarHBondContact O-N 3.16Å; D366-A369 WeakPolarHBondContact O-CB 3.3Å; D366-A369 PolarHBondContact O-N 3.03Å; D366-A369 VanDerWaalsContact O-N 3.11Å; A369-K371 PolarHBondContact O-N 2.9Å; A369-K371 VanDerWaalsContact O-N 3.16Å; A369-G379 WeakPolarHBondContact O-CA 3.15Å
370	C	64.8	Low	69.1	Low	89 Å²	89	89.1 Å²	89.1	60%	0.601	47%	0.469	S	S	*	.			trans	-76.8	103	172.8	-162.2	0	0	0	0	109.6	N368	N368-C370 PolarHBondContact O-N 3.37Å; N368-C370 VanDerWaalsContact O-N 3.1Å
371	K	56	Low	68.8	Low	119 Å²	119	89.8 Å²	89.8	52%	0.517	47%	0.474	S	S	.	.			trans	-86.3	108.3	170.1	-67.5	176.1	-173.8	159	0	108.1	A369	A369-K371 PolarHBondContact O-N 2.9Å; A369-K371 VanDerWaalsContact O-N 3.16Å
372	C	52.5	Low	68.6	Low	80 Å²	80	91.5 Å²	91.5	54%	0.541	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	107.9	170.9	-64.4	0	0	0	0	108.8	C377	C372-C377 HydrophobicContact CB-CB 4.25Å; C372-C377 WeakPolarHBondContact CB-SG 3.3Å; C372-C377 WeakPolarHBondContact SG-CB 3.37Å; C372-C377 CovalentContact SG-SG 2.06Å; C372-C377 PolarHBondContact SG-SG 3.3Å
373	Q	43	Very low	68.5	Low	181 Å²	181	91.6 Å²	91.6	85%	0.846	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.9	107.6	163.6	-95.8	176.2	-19.8	0	0	107.3
374	S	52.4	Low	68.5	Low	114 Å²	114	92.7 Å²	92.7	80%	0.797	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	-175.6	-173	-169.8	0	0	0	0	113.4	Q376	S374-Q376 CarbonylContact O-C 3.42Å; S374-Q376 PolarHBondContact O-N 2.82Å
375	L	46.5	Very low	68.5	Low	180 Å²	180	95.5 Å²	95.5	94%	0.942	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	0.2	-168.2	-125	90.7	0	0	0	116.8
376	Q	42	Very low	68.5	Low	165 Å²	165	91.1 Å²	91.1	77%	0.771	50%	0.504	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.3	107.5	174.4	-75	179.3	-15.9	0	0	110.4	S374 K378	S374-Q376 CarbonylContact O-C 3.42Å; S374-Q376 PolarHBondContact O-N 2.82Å; Q376-K378 PolarHBondContact O-N 2.9Å
377	C	54.8	Low	68.4	Low	74 Å²	74	90.7 Å²	90.7	50%	0.5	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	98.3	169.2	-68.5	0	0	0	0	109.1	C372	C372-C377 HydrophobicContact CB-CB 4.25Å; C372-C377 WeakPolarHBondContact CB-SG 3.3Å; C372-C377 WeakPolarHBondContact SG-CB 3.37Å; C372-C377 CovalentContact SG-SG 2.06Å; C372-C377 PolarHBondContact SG-SG 3.3Å
378	K	56.3	Low	68.5	Low	183 Å²	183	100.3 Å²	100.3	80%	0.796	54%	0.538	S	S	*	.			trans	-138.2	119.8	165.9	-91.4	-172.1	173.6	-177.7	0	108.7	Q376	Q376-K378 PolarHBondContact O-N 2.9Å
379	G	61.8	Low	68.9	Low	32 Å²	32	100.3 Å²	100.3	33%	0.33	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-77.2	119.1	169	0	0	0	0	0	110	A369	A369-G379 WeakPolarHBondContact O-CA 3.15Å
380	E	71.5	Confident	69.6	Low	146 Å²	146	98.5 Å²	98.5	68%	0.682	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-92.5	126.8	163.3	-71.2	-171.7	164.5	0	0	108.9
381	P	82	Confident	70.6	Confident	15 Å²	15	96.5 Å²	96.5	10%	0.097	51%	0.506	C	S	.	.	P	Polyproline II helix	trans	-71.1	172.6	177.5	31.7	-35.3	0	0	0	110.8	D366 F367	D366-P381 VanDerWaalsContact OD2-CA 3.24Å; D366-P381 WeakPolarHBondContact OD2-CA 3.18Å; D366-P381 WeakPolarHBondContact OD2-CB 3.43Å; F367-P381 HydrophobicContact CD1-CB 4Å; F367-P381 HydrophobicContact CD1-CG 4.04Å; F367-P381 HydrophobicContact CD2-CB 4.18Å; F367-P381 HydrophobicContact CE1-CB 3.91Å; F367-P381 HydrophobicContact CE1-CG 3.69Å; F367-P381 HydrophobicContact CE2-CB 4.1Å; F367-P381 HydrophobicContact CG-CB 4.15Å; F367-P381 HydrophobicContact CZ-CB 3.96Å; F367-P381 HydrophobicContact CZ-CG 4.04Å
382	Q	84	Confident	72	Confident	70 Å²	70	91.5 Å²	91.5	33%	0.327	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-53.3	125	178.8	-62.9	-144.5	4.5	0	0	111.8	A251 Y252 Y362 D366	A251-Q382 HydrophobicContact CB-CB 4.16Å; A251-Q382 PolarHBondContact O-OE1 3.23Å; Y252-Q382 HydrophobicContact CE1-CB 4.17Å; Y252-Q382 HydrophobicContact CE1-CG 3.98Å; Y362-Q382 PolarHBondContact OH-NE2 3Å; Y362-Q382 VanDerWaalsContact OH-NE2 3.16Å; D366-Q382 WeakPolarHBondContact OD2-CG 3.43Å; D366-Q382 PolarHBondContact OD2-N 2.92Å
383	P	84.8	Confident	73.4	Confident	107 Å²	107	91.8 Å²	91.8	70%	0.695	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-77.2	155.2	-178	32	-35.2	0	0	0	111.4
384	S	89.5	Confident	75.4	Confident	23 Å²	23	90.5 Å²	90.5	16%	0.161	48%	0.48	C	S	.	.			trans	-140.7	169.1	174.2	68.6	0	0	0	0	110.2	H247 H386 S387	H247-S384 WeakPolarHBondContact ND1-CB 3.34Å; H247-S384 PolarHBondContact ND1-OG 3.04Å; S384-H386 PolarHBondContact O-N 3.22Å; S384-H386 PolarHBondContact OG-N 3.23Å; S384-S387 PolarHBondContact N-OG 2.88Å; S384-S387 WeakPolarHBondContact O-CB 3.29Å; S384-S387 PolarHBondContact O-N 3.22Å; S384-S387 VanDerWaalsContact O-N 3.12Å; S384-S387 PolarHBondContact O-OG 3.21Å; S384-S387 PolarHBondContact OG-N 3.11Å; S384-S387 PolarHBondContact OG-OG 3.41Å
385	S	86.6	Confident	77.2	Confident	83 Å²	83	85.9 Å²	85.9	58%	0.58	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-36.6	170	60.3	0	0	0	0	112.8	D250	D250-S385 PolarHBondContact OD2-OG 3.35Å
386	H	86.3	Confident	79.2	Confident	49 Å²	49	81.3 Å²	81.3	23%	0.227	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-0.2	-177.8	-64.1	-72.7	0	0	0	114.5	T243 H247 S384 R388 E389 L390	T243-H386 HydrophobicContact CG2-CB 4.1Å; H247-H386 HydrophobicContact CB-CB 4.36Å; S384-H386 PolarHBondContact O-N 3.22Å; S384-H386 PolarHBondContact OG-N 3.23Å; H386-R388 VanDerWaalsContact C-N 3.27Å; H386-R388 PolarHBondContact O-N 3.46Å; H386-E389 IonicContact ND1-OE2 3.1Å; H386-E389 PolarHBondContact ND1-OE2 3.37Å; H386-E389 VanDerWaalsContact ND1-OE2 3.1Å; H386-E389 PolarHBondContact O-N 3.36Å; H386-L390 HydrophobicContact CB-CD1 4.16Å; H386-L390 WeakPolarHBondContact O-CB 3.47Å; H386-L390 PolarHBondContact O-N 3.47Å
387	S	85.1	Confident	81.5	Confident	15 Å²	15	73.8 Å²	73.8	11%	0.105	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-32.2	-172.6	-75.3	0	0	0	0	113.8	S384 C391 T392	S384-S387 PolarHBondContact N-OG 2.88Å; S384-S387 WeakPolarHBondContact O-CB 3.29Å; S384-S387 PolarHBondContact O-N 3.22Å; S384-S387 VanDerWaalsContact O-N 3.12Å; S384-S387 PolarHBondContact O-OG 3.21Å; S384-S387 PolarHBondContact OG-N 3.11Å; S384-S387 PolarHBondContact OG-OG 3.41Å; S387-C391 PolarHBondContact O-N 2.97Å; S387-T392 WeakPolarHBondContact CB-OG1 3.49Å; S387-T392 PolarHBondContact O-N 3.19Å; S387-T392 VanDerWaalsContact O-N 3.16Å; S387-T392 PolarHBondContact O-OG1 2.93Å
388	R	84.9	Confident	83.1	Confident	235 Å²	235	73.5 Å²	73.5	89%	0.887	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-41.7	178	-172.8	178.6	179.9	-176.1	0	111.9	H386 C391	H386-R388 VanDerWaalsContact C-N 3.27Å; H386-R388 PolarHBondContact O-N 3.46Å; R388-C391 PolarHBondContact O-N 2.91Å
389	E	88.4	Confident	84.7	Confident	108 Å²	108	68.1 Å²	68.1	51%	0.505	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-48.6	175.7	-176.1	-176	174.9	0	0	110.3	H386 C391	H386-E389 IonicContact ND1-OE2 3.1Å; H386-E389 PolarHBondContact ND1-OE2 3.37Å; H386-E389 VanDerWaalsContact ND1-OE2 3.1Å; H386-E389 PolarHBondContact O-N 3.36Å; E389-C391 VanDerWaalsContact C-N 3.28Å; E389-C391 PolarHBondContact O-N 3.46Å
390	L	87.6	Confident	85.9	Confident	1 Å²	1	66.8 Å²	66.8	1%	0.005	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-4.3	-178	-71.3	176.5	0	0	0	114.8	P236 A239 T243 V244 H247 H386 T392 W395	P236-L390 WeakPolarHBondContact CD-O 3.24Å; P236-L390 HydrophobicContact CG-CD2 4.41Å; A239-L390 HydrophobicContact CB-CD2 3.94Å; T243-L390 HydrophobicContact CG2-CD1 4.14Å; T243-L390 HydrophobicContact CG2-CD2 3.97Å; T243-L390 HydrophobicContact CG2-CG 3.99Å; V244-L390 HydrophobicContact CG2-CD2 4.18Å; H247-L390 HydrophobicContact CB-CD1 3.55Å; H386-L390 HydrophobicContact CB-CD1 4.16Å; H386-L390 WeakPolarHBondContact O-CB 3.47Å; H386-L390 PolarHBondContact O-N 3.47Å; L390-T392 HydrophobicContact CB-CG2 4.07Å; L390-T392 PolarHBondContact O-N 3.41Å; L390-W395 HydrophobicContact CB-CH2 4.46Å; L390-W395 HydrophobicContact CB-CZ2 3.72Å; L390-W395 HydrophobicContact CD1-CH2 4.02Å; L390-W395 HydrophobicContact CD1-CZ2 3.99Å; L390-W395 HydrophobicContact CD2-CZ2 4.35Å; L390-W395 HydrophobicContact CG-CZ2 4.25Å; L390-W395 PolarHBondContact O-NE1 3.41Å
391	C	86.9	Confident	86.6	Confident	46 Å²	46	60.3 Å²	60.3	31%	0.311	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	44.2	-176.8	-67.6	0	0	0	0	113.2	S387 R388 E389 S393 K394	S387-C391 PolarHBondContact O-N 2.97Å; R388-C391 PolarHBondContact O-N 2.91Å; E389-C391 VanDerWaalsContact C-N 3.28Å; E389-C391 PolarHBondContact O-N 3.46Å; C391-S393 PolarHBondContact O-N 3.17Å; C391-K394 HydrophobicContact CB-CD 4.39Å; C391-K394 WeakPolarHBondContact O-CB 3.49Å; C391-K394 PolarHBondContact O-N 3.37Å
392	T	85	Confident	86.8	Confident	14 Å²	14	60.5 Å²	60.5	9%	0.086	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-51.7	-28.3	-173	49.5	0	0	0	0	114.7	S387 L390 K394 W395	S387-T392 WeakPolarHBondContact CB-OG1 3.49Å; S387-T392 PolarHBondContact O-N 3.19Å; S387-T392 VanDerWaalsContact O-N 3.16Å; S387-T392 PolarHBondContact O-OG1 2.93Å; L390-T392 HydrophobicContact CB-CG2 4.07Å; L390-T392 PolarHBondContact O-N 3.41Å; T392-K394 PolarHBondContact O-N 2.95Å; T392-W395 HydrophobicContact CG2-CD2 4.37Å; T392-W395 HydrophobicContact CG2-CE3 4.41Å; T392-W395 HydrophobicContact CG2-CH2 4.25Å; T392-W395 HydrophobicContact CG2-CZ2 4.2Å; T392-W395 HydrophobicContact CG2-CZ3 4.33Å; T392-W395 WeakPolarHBondContact O-CB 3.31Å; T392-W395 PolarHBondContact O-N 3.47Å; T392-W395 VanDerWaalsContact O-N 3.17Å
393	S	82.3	Confident	86.8	Confident	87 Å²	87	58.4 Å²	58.4	61%	0.608	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-64.6	-16.7	175.4	68.8	0	0	0	0	114.7	C391	C391-S393 PolarHBondContact O-N 3.17Å
394	K	85.3	Confident	86.6	Confident	154 Å²	154	57.1 Å²	57.1	67%	0.67	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-97.7	-4.4	178.6	-65.2	-178.3	-178.3	171.9	0	112.6	C391 T392	C391-K394 HydrophobicContact CB-CD 4.39Å; C391-K394 WeakPolarHBondContact O-CB 3.49Å; C391-K394 PolarHBondContact O-N 3.37Å; T392-K394 PolarHBondContact O-N 2.95Å
395	W	90.1	Very high	86.4	Confident	16 Å²	16	56.1 Å²	56.1	6%	0.061	29%	0.29	C	S	.	.			trans	-71	137.6	-176	-69.7	7.4	0	0	0	110.9	I232 T233 L235 H247 F248 F367 L390 T392 V397	I232-W395 HydrophobicContact CD1-CE3 4.39Å; I232-W395 HydrophobicContact CD1-CZ3 4.17Å; I232-W395 HydrophobicContact CG2-CB 4.12Å; I232-W395 HydrophobicContact CG2-CD2 3.72Å; I232-W395 HydrophobicContact CG2-CE3 3.66Å; I232-W395 HydrophobicContact CG2-CG 3.97Å; I232-W395 HydrophobicContact CG2-CZ3 4.26Å; T233-W395 VanDerWaalsContact O-CA 3.3Å; T233-W395 WeakPolarHBondContact O-CA 3.4Å; L235-W395 HydrophobicContact CD2-CZ2 4.2Å; L235-W395 HydrophobicContact CG-CZ2 3.93Å; H247-W395 AromaticContact CD2-CH2 3.76Å; H247-W395 AromaticContact CD2-CZ3 3.71Å; H247-W395 AromaticContact NE2-CZ3 3.89Å; F248-W395 HydrophobicContact CE2-CZ3 4.2Å; F248-W395 AromaticContact CZ-CZ3 3.93Å; F248-W395 HydrophobicContact CZ-CZ3 3.93Å; F367-W395 HydrophobicContact CE1-CB 4.04Å; F367-W395 AromaticContact CE1-CE3 3.95Å; F367-W395 HydrophobicContact CE1-CE3 3.95Å; F367-W395 AromaticContact CZ-CE3 3.8Å; F367-W395 HydrophobicContact CZ-CE3 3.8Å; F367-W395 HydrophobicContact CZ-CZ3 4.33Å; L390-W395 HydrophobicContact CB-CH2 4.46Å; L390-W395 HydrophobicContact CB-CZ2 3.72Å; L390-W395 HydrophobicContact CD1-CH2 4.02Å; L390-W395 HydrophobicContact CD1-CZ2 3.99Å; L390-W395 HydrophobicContact CD2-CZ2 4.35Å; L390-W395 HydrophobicContact CG-CZ2 4.25Å; L390-W395 PolarHBondContact O-NE1 3.41Å; T392-W395 HydrophobicContact CG2-CD2 4.37Å; T392-W395 HydrophobicContact CG2-CE3 4.41Å; T392-W395 HydrophobicContact CG2-CH2 4.25Å; T392-W395 HydrophobicContact CG2-CZ2 4.2Å; T392-W395 HydrophobicContact CG2-CZ3 4.33Å; T392-W395 WeakPolarHBondContact O-CB 3.31Å; T392-W395 PolarHBondContact O-N 3.47Å; T392-W395 VanDerWaalsContact O-N 3.17Å; W395-V397 HydrophobicContact CB-CG2 4.39Å
396	T	88.4	Confident	86.5	Confident	84 Å²	84	52.6 Å²	52.6	52%	0.515	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	120.7	164.4	-54.7	0	0	0	0	107.7	T233	T233-T396 PolarHBondContact N-O 3.41Å; T233-T396 PolarHBondContact O-N 2.93Å; T233-T396 WeakPolarHBondContact OG1-CB 3.08Å; T233-T396 PolarHBondContact OG1-O 3.49Å
397	V	89.9	Confident	86.7	Confident	7 Å²	7	50.9 Å²	50.9	4%	0.042	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.8	-175.2	-175.7	0	0	0	0	109.1	L230 I232 L364 F367 W395	L230-V397 HydrophobicContact CB-CG1 4.16Å; L230-V397 HydrophobicContact CD1-CG1 3.88Å; L230-V397 HydrophobicContact CD2-CG1 4.29Å; L230-V397 HydrophobicContact CG-CG1 4.34Å; I232-V397 HydrophobicContact CG1-CG1 4.48Å; I232-V397 HydrophobicContact CG1-CG2 4.37Å; I232-V397 HydrophobicContact CG2-CG2 4.31Å; L364-V397 HydrophobicContact CD1-CB 4.34Å; L364-V397 HydrophobicContact CD1-CG1 3.98Å; L364-V397 WeakPolarHBondContact CD1-O 3.39Å; F367-V397 HydrophobicContact CB-CB 4.24Å; F367-V397 HydrophobicContact CB-CG2 4.16Å; F367-V397 HydrophobicContact CD1-CG2 3.63Å; F367-V397 HydrophobicContact CD2-CG2 4.09Å; F367-V397 HydrophobicContact CE1-CG2 3.97Å; F367-V397 HydrophobicContact CE2-CG2 4.39Å; F367-V397 HydrophobicContact CG-CB 4.28Å; F367-V397 HydrophobicContact CG-CG2 3.69Å; F367-V397 HydrophobicContact CZ-CG2 4.34Å; W395-V397 HydrophobicContact CB-CG2 4.39Å
398	T	89.6	Confident	86.8	Confident	68 Å²	68	52 Å²	52	42%	0.417	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	164	173.3	59.5	0	0	0	0	109.7	L230 F231	L230-T398 CarbonylContact C-O 3.6Å; L230-T398 WeakPolarHBondContact CA-O 3.17Å; F231-T398 PolarHBondContact N-O 3.42Å; F231-T398 PolarHBondContact O-N 2.94Å
399	F	88.4	Confident	86.9	Confident	71 Å²	71	46.5 Å²	46.5	31%	0.311	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	145	163.5	-71.7	-65.5	0	0	0	109.6	R227 L230 A360 L364	R227-F399 WeakPolarHBondContact O-CE1 3.44Å; L230-F399 HydrophobicContact CD2-CD1 3.89Å; L230-F399 HydrophobicContact CD2-CE1 4.1Å; A360-F399 HydrophobicContact CB-CE1 4.23Å; L364-F399 HydrophobicContact CD2-CD2 3.52Å; L364-F399 HydrophobicContact CD2-CE1 4.21Å; L364-F399 HydrophobicContact CD2-CE2 3.14Å; L364-F399 HydrophobicContact CD2-CG 4.21Å; L364-F399 HydrophobicContact CD2-CZ 3.53Å
400	A	88	Confident	87	Confident	3 Å²	3	42 Å²	42	3%	0.025	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-69.7	147.8	173.1	0	0	0	0	0	110.1	V226 T229 F231 F351 Y752	V226-A400 WeakPolarHBondContact CG1-O 3.46Å; T229-A400 HydrophobicContact CG2-CB 3.81Å; T229-A400 PolarHBondContact O-N 2.81Å; F231-A400 HydrophobicContact CB-CB 4.19Å; F351-A400 HydrophobicContact CD1-CB 3.87Å; F351-A400 HydrophobicContact CE1-CB 4.07Å; A400-Y752 HydrophobicContact CB-CE1 3.77Å
401	A	86.6	Confident	87.1	Confident	11 Å²	11	42.2 Å²	42.2	9%	0.091	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-72.9	171.8	167.4	0	0	0	0	0	110.3	I406 T494 E660 Y752	A401-I406 HydrophobicContact CB-CG1 4.15Å; A401-T494 HydrophobicContact CB-CG2 4.05Å; A401-E660 WeakPolarHBondContact CB-OE1 3.11Å; A401-Y752 VanDerWaalsContact O-CE1 3.25Å; A401-Y752 WeakPolarHBondContact O-CE1 3.28Å; A401-Y752 PolarHBondContact O-OH 3.34Å
402	D	84.3	Confident	87.1	Confident	19 Å²	19	41.9 Å²	41.9	10%	0.102	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-62.1	138.2	170.3	-172.4	-81.7	0	0	0	110.9	V226 E404 D405 I406 K658	V226-D402 HydrophobicContact CG2-CB 4.45Å; D402-E404 PolarHBondContact O-N 2.99Å; D402-E404 VanDerWaalsContact O-N 3.11Å; D402-E404 WeakPolarHBondContact OD1-CB 3.41Å; D402-E404 PolarHBondContact OD1-N 3.31Å; D402-D405 HydrophobicContact CB-CB 4.16Å; D402-D405 WeakPolarHBondContact O-CA 3.5Å; D402-D405 WeakPolarHBondContact O-CB 3.1Å; D402-D405 PolarHBondContact O-N 2.89Å; D402-I406 PolarHBondContact O-N 3.07Å; D402-K658 IonicContact OD1-NZ 3.43Å; D402-K658 WeakPolarHBondContact OD2-CE 3.49Å; D402-K658 IonicContact OD2-NZ 3.62Å; D402-K658 PolarHBondContact OD2-NZ 3.03Å
403	P	84.1	Confident	87.2	Confident	26 Å²	26	43 Å²	43	17%	0.169	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-29.7	178.5	-27.5	34.5	0	0	0	115.4	P751 Y752	P403-P751 VanDerWaalsContact CB-O 3.31Å; P403-P751 WeakPolarHBondContact CB-O 3.26Å; P403-P751 HydrophobicContact CG-CB 4.12Å; P403-Y752 HydrophobicContact CG-CD1 4.12Å; P403-Y752 HydrophobicContact CG-CE1 3.8Å; P403-Y752 HydrophobicContact CG-CE2 4.3Å
404	E	81.6	Confident	87.4	Confident	80 Å²	80	41.4 Å²	41.4	37%	0.374	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-23.5	175.9	-61.1	-161.6	147	0	0	113.3	D402 K495 R755	D402-E404 PolarHBondContact O-N 2.99Å; D402-E404 VanDerWaalsContact O-N 3.11Å; D402-E404 WeakPolarHBondContact OD1-CB 3.41Å; D402-E404 PolarHBondContact OD1-N 3.31Å; E404-K495 WeakPolarHBondContact O-CE 3.44Å; E404-K495 PolarHBondContact O-NZ 2.81Å; E404-R755 IonicContact OE1-CZ 2.9Å; E404-R755 IonicContact OE1-NH1 3.01Å; E404-R755 PolarHBondContact OE1-NH1 3.37Å; E404-R755 IonicContact OE1-NH2 3.6Å; E404-R755 PolarHBondContact OE1-NH2 3.09Å
405	D	86	Confident	87.4	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-24.3	178.3	-170	49.6	0	0	0	112.3	D402 C407 T494 K495 S496	D402-D405 HydrophobicContact CB-CB 4.16Å; D402-D405 WeakPolarHBondContact O-CA 3.5Å; D402-D405 WeakPolarHBondContact O-CB 3.1Å; D402-D405 PolarHBondContact O-N 2.89Å; D405-C407 PolarHBondContact O-N 3.26Å; D405-T494 CarbonylContact O-C 3.56Å; D405-T494 WeakPolarHBondContact O-CA 3.13Å; D405-T494 WeakPolarHBondContact OD2-CB 3.49Å; D405-K495 WeakPolarHBondContact O-CG 3.26Å; D405-K495 PolarHBondContact O-N 3.49Å; D405-K495 WeakPolarHBondContact OD1-CB 3.28Å; D405-K495 PolarHBondContact OD1-N 3.19Å; D405-S496 WeakPolarHBondContact OD1-CB 3.2Å; D405-S496 PolarHBondContact OD1-N 3.36Å; D405-S496 PolarHBondContact OD1-OG 3.28Å; D405-S496 WeakPolarHBondContact OD2-CB 3.35Å; D405-S496 PolarHBondContact OD2-OG 3.39Å
406	I	88.8	Confident	87.2	Confident	10 Å²	10	42.9 Å²	42.9	5%	0.051	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-69.8	123.3	-178.9	-62.7	166.8	0	0	0	111.4	F351 A401 D402 W408 L411 Y752	F351-I406 HydrophobicContact CE1-CD1 3.77Å; F351-I406 HydrophobicContact CE2-CD1 4.46Å; F351-I406 HydrophobicContact CZ-CD1 3.58Å; A401-I406 HydrophobicContact CB-CG1 4.15Å; D402-I406 PolarHBondContact O-N 3.07Å; I406-W408 HydrophobicContact CB-CZ2 4.34Å; I406-W408 HydrophobicContact CD1-CZ2 4.21Å; I406-W408 HydrophobicContact CG2-CD2 3.89Å; I406-W408 HydrophobicContact CG2-CE3 4.3Å; I406-W408 HydrophobicContact CG2-CG 4.23Å; I406-W408 HydrophobicContact CG2-CH2 4.48Å; I406-W408 HydrophobicContact CG2-CZ2 4.09Å; I406-W408 VanDerWaalsContact O-CD1 3.26Å; I406-W408 PolarHBondContact O-N 2.91Å; I406-L411 HydrophobicContact CG2-CD1 4.07Å; I406-L411 HydrophobicContact CG2-CD2 4.48Å; I406-L411 HydrophobicContact CG2-CG 4.47Å; I406-Y752 HydrophobicContact CD1-CD1 3.84Å; I406-Y752 HydrophobicContact CD1-CE1 3.84Å
407	C	88.6	Confident	87.2	Confident	12 Å²	12	48.6 Å²	48.6	8%	0.081	25%	0.25	C	S	.	.			trans	-85.5	78.1	172.3	-76.2	0	0	0	0	111.1	D405 K409 N410 L411 W493 K495	D405-C407 PolarHBondContact O-N 3.26Å; C407-K409 PolarHBondContact O-N 3.38Å; C407-N410 HydrophobicContact CB-CB 4.19Å; C407-N410 PolarHBondContact O-N 3.34Å; C407-L411 PolarHBondContact O-N 3.4Å; C407-W493 WeakPolarHBondContact CA-O 3.42Å; C407-W493 WeakPolarHBondContact CB-O 3.31Å; C407-W493 PolarHBondContact N-O 3.34Å; C407-K495 WeakPolarHBondContact SG-CG 3.35Å
408	W	88.1	Confident	87.3	Confident	40 Å²	40	51.8 Å²	51.8	15%	0.152	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-33	-178.5	-61.2	95.1	0	0	0	115.2	V266 I270 F351 I406 N410 L411 Y752 P754	V266-W408 HydrophobicContact CG2-CB 4.4Å; I270-W408 HydrophobicContact CD1-CB 3.6Å; F351-W408 HydrophobicContact CD2-CH2 4.32Å; F351-W408 AromaticContact CE2-CH2 3.73Å; F351-W408 HydrophobicContact CE2-CH2 3.73Å; F351-W408 AromaticContact CE2-CZ3 3.93Å; F351-W408 HydrophobicContact CE2-CZ3 3.93Å; F351-W408 HydrophobicContact CZ-CH2 4.39Å; I406-W408 HydrophobicContact CB-CZ2 4.34Å; I406-W408 HydrophobicContact CD1-CZ2 4.21Å; I406-W408 HydrophobicContact CG2-CD2 3.89Å; I406-W408 HydrophobicContact CG2-CE3 4.3Å; I406-W408 HydrophobicContact CG2-CG 4.23Å; I406-W408 HydrophobicContact CG2-CH2 4.48Å; I406-W408 HydrophobicContact CG2-CZ2 4.09Å; I406-W408 VanDerWaalsContact O-CD1 3.26Å; I406-W408 PolarHBondContact O-N 2.91Å; W408-N410 VanDerWaalsContact C-N 3.29Å; W408-N410 PolarHBondContact O-N 3.22Å; W408-L411 HydrophobicContact CD2-CD1 4.24Å; W408-L411 HydrophobicContact CE3-CD1 3.49Å; W408-L411 VanDerWaalsContact CE3-CD1 3.49Å; W408-L411 HydrophobicContact CZ3-CD1 3.95Å; W408-Y752 VanDerWaalsContact CH2-O 3.27Å; W408-Y752 WeakPolarHBondContact CH2-O 3.41Å; W408-P754 HydrophobicContact CD2-CB 4.45Å; W408-P754 HydrophobicContact CD2-CG 3.79Å; W408-P754 HydrophobicContact CE3-CG 3.68Å; W408-P754 HydrophobicContact CG-CB 4.49Å; W408-P754 HydrophobicContact CG-CG 4.19Å; W408-P754 HydrophobicContact CZ3-CG 4.2Å
409	K	87.8	Confident	87.4	Confident	119 Å²	119	54.8 Å²	54.8	52%	0.517	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-27	176.7	55.5	163.6	-169.7	177.9	0	114.1	C407	C407-K409 PolarHBondContact O-N 3.38Å
410	N	90.4	Very high	87.5	Confident	12 Å²	12	56.8 Å²	56.8	6%	0.064	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-13.6	-172.1	-67.3	-6.8	0	0	0	112.2	C407 W408 S412 I413 H492	C407-N410 HydrophobicContact CB-CB 4.19Å; C407-N410 PolarHBondContact O-N 3.34Å; W408-N410 VanDerWaalsContact C-N 3.29Å; W408-N410 PolarHBondContact O-N 3.22Å; N410-S412 PolarHBondContact O-N 2.95Å; N410-I413 PolarHBondContact O-N 3.43Å; N410-H492 WeakPolarHBondContact CB-O 3.39Å; N410-H492 PolarHBondContact ND2-O 2.96Å
411	L	89	Confident	87.7	Confident	6 Å²	6	59.7 Å²	59.7	3%	0.031	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-24.9	-178.9	-75.1	177.6	0	0	0	113.7	L347 M349 I406 C407 W408 I413 Q414 W493	L347-L411 HydrophobicContact CD1-CB 4.01Å; M349-L411 HydrophobicContact CE-CB 3.89Å; M349-L411 HydrophobicContact CE-CD2 3.97Å; M349-L411 HydrophobicContact CE-CG 4.35Å; I406-L411 HydrophobicContact CG2-CD1 4.07Å; I406-L411 HydrophobicContact CG2-CD2 4.48Å; I406-L411 HydrophobicContact CG2-CG 4.47Å; C407-L411 PolarHBondContact O-N 3.4Å; W408-L411 HydrophobicContact CD2-CD1 4.24Å; W408-L411 HydrophobicContact CE3-CD1 3.49Å; W408-L411 VanDerWaalsContact CE3-CD1 3.49Å; W408-L411 HydrophobicContact CZ3-CD1 3.95Å; L411-I413 VanDerWaalsContact C-N 3.33Å; L411-Q414 WeakPolarHBondContact O-CG 3.29Å; L411-Q414 PolarHBondContact O-NE2 2.97Å; L411-W493 HydrophobicContact CD2-CB 4.09Å; L411-W493 HydrophobicContact CD2-CG 4.06Å
412	S	87.5	Confident	87.9	Confident	40 Å²	40	63.1 Å²	63.1	28%	0.28	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-16.4	179	60.6	0	0	0	0	114.2	N265 N410	N265-S412 WeakPolarHBondContact OD1-CB 3.4Å; N410-S412 PolarHBondContact O-N 2.95Å
413	I	87.3	Confident	88.3	Confident	36 Å²	36	65.8 Å²	65.8	19%	0.185	32%	0.317	C	S	.	.			trans	-90.5	110.1	179	-57.4	174.8	0	0	0	107.9	N410 L411 W418 W493	N410-I413 PolarHBondContact O-N 3.43Å; L411-I413 VanDerWaalsContact C-N 3.33Å; I413-W418 HydrophobicContact CG2-CB 4Å; I413-W418 HydrophobicContact CG2-CG 4.45Å; I413-W493 PolarHBondContact O-NE1 2.98Å
414	Q	84.8	Confident	88.7	Confident	55 Å²	55	66.2 Å²	66.2	26%	0.257	33%	0.325	S	S	.	.			trans	-142.8	162.3	-171	-52.4	-176.1	-13.3	0	0	113	L347 M349 L411 R417 W418 W493	L347-Q414 PolarHBondContact O-OE1 3.42Å; M349-Q414 PolarHBondContact SD-NE2 2.91Å; L411-Q414 WeakPolarHBondContact O-CG 3.29Å; L411-Q414 PolarHBondContact O-NE2 2.97Å; Q414-R417 PolarHBondContact O-N 3.33Å; Q414-W418 PolarHBondContact O-N 2.97Å; Q414-W493 HydrophobicContact CB-CZ2 4.35Å; Q414-W493 HydrophobicContact CG-CZ2 3.9Å
415	G	85.8	Confident	89.1	Confident	56 Å²	56	63.9 Å²	63.9	58%	0.577	32%	0.315	S	S	*	.	H	α-helix	trans	58.8	-135.4	167.5	0	0	0	0	0	114.2	R417 W418 W419	G415-R417 PolarHBondContact O-N 2.98Å; G415-W418 PolarHBondContact O-N 3.48Å; G415-W419 PolarHBondContact O-N 3.34Å
416	L	87.3	Confident	89.3	Confident	145 Å²	145	65.1 Å²	65.1	76%	0.759	32%	0.322	S	S	*	.	H	α-helix	trans	-58.3	-34.3	-178.1	-70.5	172	0	0	0	113.1	W419 L420	L416-W419 PolarHBondContact O-N 3.03Å; L416-L420 WeakPolarHBondContact O-CG 3.47Å; L416-L420 PolarHBondContact O-N 3.06Å
417	R	88.4	Confident	89.3	Confident	203 Å²	203	70.8 Å²	70.8	77%	0.766	35%	0.346	S	S	*	.	H	α-helix	trans	-67.4	-42.8	-178.2	-147.7	178.4	-168.6	-179.8	3.5	110.9	Q414 G415 Q421	Q414-R417 PolarHBondContact O-N 3.33Å; G415-R417 PolarHBondContact O-N 2.98Å; R417-Q421 WeakPolarHBondContact O-CB 3.46Å; R417-Q421 PolarHBondContact O-N 3.4Å; R417-Q421 VanDerWaalsContact O-N 3.14Å
418	W	90.9	Very high	89.3	Confident	75 Å²	75	74.6 Å²	74.6	28%	0.284	37%	0.369	S	S	.	.	H	α-helix	trans	-63.5	-44.8	172.6	-178.5	81.6	0	0	0	111.4	I413 Q414 G415 L420 Q421 W422 E490 H492	I413-W418 HydrophobicContact CG2-CB 4Å; I413-W418 HydrophobicContact CG2-CG 4.45Å; Q414-W418 PolarHBondContact O-N 2.97Å; G415-W418 PolarHBondContact O-N 3.48Å; W418-L420 PolarHBondContact O-N 3.47Å; W418-Q421 PolarHBondContact O-N 3.15Å; W418-W422 HydrophobicContact CH2-CG 4.31Å; W418-W422 HydrophobicContact CZ2-CG 4.43Å; W418-W422 WeakPolarHBondContact O-CB 3.48Å; W418-W422 PolarHBondContact O-N 3.24Å; W418-E490 PolarHBondContact NE1-O 3.49Å; W418-H492 AromaticContact CZ2-CE1 3.93Å
419	W	91.3	Very high	89.2	Confident	131 Å²	131	73.1 Å²	73.1	50%	0.496	36%	0.364	S	S	.	.	H	α-helix	trans	-64.1	-41.5	-178.4	-166.8	84.6	0	0	0	112.9	G415 L416 W422 L423	G415-W419 PolarHBondContact O-N 3.34Å; L416-W419 PolarHBondContact O-N 3.03Å; W419-W422 PolarHBondContact O-N 3.38Å; W419-L423 HydrophobicContact CE3-CD2 4.41Å; W419-L423 HydrophobicContact CH2-CD2 3.76Å; W419-L423 HydrophobicContact CZ3-CD2 3.67Å; W419-L423 VanDerWaalsContact O-CB 3.29Å; W419-L423 WeakPolarHBondContact O-CB 3.39Å; W419-L423 PolarHBondContact O-N 3.07Å
420	L	91.3	Very high	88.9	Confident	112 Å²	112	73.3 Å²	73.3	59%	0.586	37%	0.365	S	S	*	.	H	α-helix	trans	-64.6	-41.2	174.5	-72.5	173.7	0	0	0	112.1	L416 W418 G424	L416-L420 WeakPolarHBondContact O-CG 3.47Å; L416-L420 PolarHBondContact O-N 3.06Å; W418-L420 PolarHBondContact O-N 3.47Å; L420-G424 PolarHBondContact O-N 3.36Å
421	Q	91.4	Very high	88.4	Confident	64 Å²	64	76.3 Å²	76.3	30%	0.299	38%	0.381	S	S	.	.	H	α-helix	trans	-63.7	-47.4	176.1	179.6	169	-10	0	0	111.1	R417 W418 G424 I425 L489	R417-Q421 WeakPolarHBondContact O-CB 3.46Å; R417-Q421 PolarHBondContact O-N 3.4Å; R417-Q421 VanDerWaalsContact O-N 3.14Å; W418-Q421 PolarHBondContact O-N 3.15Å; Q421-G424 PolarHBondContact O-N 3.4Å; Q421-I425 HydrophobicContact CG-CD1 3.67Å; Q421-I425 WeakPolarHBondContact O-CB 3.13Å; Q421-I425 WeakPolarHBondContact O-CD1 3.28Å; Q421-I425 WeakPolarHBondContact O-CG1 3.41Å; Q421-I425 PolarHBondContact O-N 3.47Å; Q421-L489 PolarHBondContact NE2-O 3.15Å
422	W	91.5	Very high	87.9	Confident	83 Å²	83	77.5 Å²	77.5	31%	0.314	40%	0.395	S	S	.	.	H	α-helix	trans	-59.4	-48.4	175.4	178.1	90.6	0	0	0	111.7	W418 W419 I425 N426	W418-W422 HydrophobicContact CH2-CG 4.31Å; W418-W422 HydrophobicContact CZ2-CG 4.43Å; W418-W422 WeakPolarHBondContact O-CB 3.48Å; W418-W422 PolarHBondContact O-N 3.24Å; W419-W422 PolarHBondContact O-N 3.38Å; W422-I425 PolarHBondContact O-N 3.4Å; W422-N426 PolarHBondContact NE1-ND2 3.37Å; W422-N426 WeakPolarHBondContact O-CB 3.4Å; W422-N426 PolarHBondContact O-N 3.45Å; W422-N426 PolarHBondContact O-ND2 2.91Å
423	L	91.9	Very high	87.2	Confident	76 Å²	76	75.7 Å²	75.7	40%	0.398	38%	0.382	S	S	.	.	H	α-helix	trans	-63.1	-46.4	179.5	-178	66.6	0	0	0	111.2	W419 N426 F427	W419-L423 HydrophobicContact CE3-CD2 4.41Å; W419-L423 HydrophobicContact CH2-CD2 3.76Å; W419-L423 HydrophobicContact CZ3-CD2 3.67Å; W419-L423 VanDerWaalsContact O-CB 3.29Å; W419-L423 WeakPolarHBondContact O-CB 3.39Å; W419-L423 PolarHBondContact O-N 3.07Å; L423-N426 PolarHBondContact O-N 2.88Å; L423-F427 WeakPolarHBondContact O-CB 3.33Å; L423-F427 PolarHBondContact O-N 2.86Å
424	G	92.4	Very high	86.4	Confident	34 Å²	34	76.6 Å²	76.6	35%	0.351	38%	0.384	S	S	.	.	H	α-helix	trans	-62.4	-43.7	179.7	0	0	0	0	0	112.8	L420 Q421 T428	L420-G424 PolarHBondContact O-N 3.36Å; Q421-G424 PolarHBondContact O-N 3.4Å; G424-T428 WeakPolarHBondContact O-CB 3.44Å; G424-T428 PolarHBondContact O-N 3.13Å; G424-T428 PolarHBondContact O-OG1 2.89Å
425	I	91.8	Very high	85.5	Confident	31 Å²	31	78.4 Å²	78.4	16%	0.159	39%	0.392	C	S	.	.	H	α-helix	trans	-65.5	-49.2	177.4	-67.9	164.5	0	0	0	110.6	Q421 W422 F427 T428 L429 S486 L489 E490	Q421-I425 HydrophobicContact CG-CD1 3.67Å; Q421-I425 WeakPolarHBondContact O-CB 3.13Å; Q421-I425 WeakPolarHBondContact O-CD1 3.28Å; Q421-I425 WeakPolarHBondContact O-CG1 3.41Å; Q421-I425 PolarHBondContact O-N 3.47Å; W422-I425 PolarHBondContact O-N 3.4Å; I425-F427 PolarHBondContact O-N 3.41Å; I425-T428 PolarHBondContact O-N 3.18Å; I425-L429 VanDerWaalsContact O-CB 3.3Å; I425-L429 WeakPolarHBondContact O-CB 3.19Å; I425-L429 PolarHBondContact O-N 2.9Å; I425-S486 WeakPolarHBondContact CG2-O 3.49Å; I425-L489 HydrophobicContact CD1-CB 3.65Å; I425-E490 HydrophobicContact CD1-CG 4.06Å; I425-E490 HydrophobicContact CG2-CG 4.36Å
426	N	89.2	Confident	84.5	Confident	27 Å²	27	77.6 Å²	77.6	14%	0.144	37%	0.374	C	S	.	.	H	α-helix	trans	-67.4	-36.1	-178.5	-75.1	-79.6	0	0	0	112.2	W422 L423 L429 F430 E490 K505	W422-N426 PolarHBondContact NE1-ND2 3.37Å; W422-N426 WeakPolarHBondContact O-CB 3.4Å; W422-N426 PolarHBondContact O-N 3.45Å; W422-N426 PolarHBondContact O-ND2 2.91Å; L423-N426 PolarHBondContact O-N 2.88Å; N426-L429 PolarHBondContact O-N 3.01Å; N426-F430 WeakPolarHBondContact O-CB 3.49Å; N426-F430 PolarHBondContact O-N 3.29Å; N426-E490 PolarHBondContact ND2-OE1 3.34Å; N426-E490 PolarHBondContact OD1-OE1 3.4Å; N426-K505 PolarHBondContact ND2-NZ 2.97Å; N426-K505 PolarHBondContact OD1-NZ 3.4Å
427	F	88.8	Confident	83.2	Confident	129 Å²	129	72.6 Å²	72.6	57%	0.566	35%	0.349	S	S	*	.	H	α-helix	trans	-63.7	-46.1	173.2	179.5	-99.8	0	0	0	111.6	L423 I425 L429 F430 L431	L423-F427 WeakPolarHBondContact O-CB 3.33Å; L423-F427 PolarHBondContact O-N 2.86Å; I425-F427 PolarHBondContact O-N 3.41Å; F427-L429 VanDerWaalsContact C-N 3.34Å; F427-L429 PolarHBondContact O-N 3.43Å; F427-F430 PolarHBondContact O-N 3.23Å; F427-L431 WeakPolarHBondContact O-CB 3.48Å; F427-L431 PolarHBondContact O-N 3.37Å
428	T	87.8	Confident	81.6	Confident	92 Å²	92	62.9 Å²	62.9	56%	0.564	31%	0.313	S	S	*	.	H	α-helix	trans	-64	-40.9	177.1	-55.3	0	0	0	0	111.3	G424 I425 L431 G432	G424-T428 WeakPolarHBondContact O-CB 3.44Å; G424-T428 PolarHBondContact O-N 3.13Å; G424-T428 PolarHBondContact O-OG1 2.89Å; I425-T428 PolarHBondContact O-N 3.18Å; T428-L431 PolarHBondContact O-N 3.41Å; T428-G432 PolarHBondContact O-N 3.45Å
429	L	86.1	Confident	79.8	Confident	9 Å²	9	59.7 Å²	59.7	5%	0.047	30%	0.302	C	S	.	.	H	α-helix	trans	-62.1	-49.9	175.8	-179.7	69.4	0	0	0	110.8	I425 N426 F427 L431 G432 L433 I482 V483 S486 F509	I425-L429 VanDerWaalsContact O-CB 3.3Å; I425-L429 WeakPolarHBondContact O-CB 3.19Å; I425-L429 PolarHBondContact O-N 2.9Å; N426-L429 PolarHBondContact O-N 3.01Å; F427-L429 VanDerWaalsContact C-N 3.34Å; F427-L429 PolarHBondContact O-N 3.43Å; L429-L431 VanDerWaalsContact C-N 3.32Å; L429-L431 PolarHBondContact O-N 2.72Å; L429-G432 PolarHBondContact O-N 3.45Å; L429-L433 HydrophobicContact CD1-CD1 3.83Å; L429-L433 HydrophobicContact CD1-CD2 4.44Å; L429-L433 HydrophobicContact CD1-CG 3.97Å; L429-L433 HydrophobicContact CD2-CD1 4.33Å; L429-L433 HydrophobicContact CG-CD1 3.72Å; L429-L433 HydrophobicContact CG-CG 4.19Å; L429-L433 WeakPolarHBondContact O-CB 3.25Å; L429-L433 WeakPolarHBondContact O-CG 3.25Å; L429-L433 PolarHBondContact O-N 3.38Å; L429-I482 HydrophobicContact CD1-CG2 3.76Å; L429-V483 HydrophobicContact CD1-CG2 4.18Å; L429-S486 WeakPolarHBondContact CD2-OG 3.26Å; L429-F509 HydrophobicContact CD2-CD2 4.29Å; L429-F509 HydrophobicContact CD2-CE2 3.56Å; L429-F509 HydrophobicContact CD2-CZ 3.92Å; L429-F509 HydrophobicContact CG-CE2 4.41Å; L429-F509 HydrophobicContact CG-CZ 4.38Å
430	F	82.4	Confident	77.7	Confident	123 Å²	123	56.3 Å²	56.3	54%	0.539	30%	0.298	S	S	.	.	H	α-helix	trans	-57.7	-46.4	178.2	176.9	-98	0	0	0	111.3	N426 F427 L433 F434	N426-F430 WeakPolarHBondContact O-CB 3.49Å; N426-F430 PolarHBondContact O-N 3.29Å; F427-F430 PolarHBondContact O-N 3.23Å; F430-L433 PolarHBondContact O-N 3.35Å; F430-F434 VanDerWaalsContact O-CB 3.22Å; F430-F434 WeakPolarHBondContact O-CB 3.46Å; F430-F434 PolarHBondContact O-N 2.89Å
431	L	80	Confident	75.7	Confident	76 Å²	76	52.4 Å²	52.4	40%	0.398	28%	0.277	S	S	.	.	H	α-helix	trans	-61.9	-47.6	177.4	-167.7	67.1	0	0	0	111.6	F427 T428 L429 F434 F435	F427-L431 WeakPolarHBondContact O-CB 3.48Å; F427-L431 PolarHBondContact O-N 3.37Å; T428-L431 PolarHBondContact O-N 3.41Å; L429-L431 VanDerWaalsContact C-N 3.32Å; L429-L431 PolarHBondContact O-N 2.72Å; L431-F434 PolarHBondContact O-N 2.83Å; L431-F435 HydrophobicContact CD1-CD2 4.07Å; L431-F435 HydrophobicContact CD1-CE2 3.4Å; L431-F435 VanDerWaalsContact CD1-CE2 3.4Å; L431-F435 HydrophobicContact CD1-CZ 4.28Å; L431-F435 HydrophobicContact CD2-CE2 4.46Å; L431-F435 HydrophobicContact CG-CD2 3.98Å; L431-F435 HydrophobicContact CG-CE2 3.68Å; L431-F435 WeakPolarHBondContact O-CD2 3.45Å; L431-F435 PolarHBondContact O-N 2.8Å; L431-F435 VanDerWaalsContact O-N 3.13Å
432	G	77.3	Confident	73.8	Confident	31 Å²	31	52.8 Å²	52.8	32%	0.32	28%	0.281	S	S	.	.	H	α-helix	trans	-59.3	-49.2	177.8	0	0	0	0	0	112	T428 L429 F435 L436	T428-G432 PolarHBondContact O-N 3.45Å; L429-G432 PolarHBondContact O-N 3.45Å; G432-F435 PolarHBondContact O-N 3.33Å; G432-L436 VanDerWaalsContact O-CB 3.26Å; G432-L436 WeakPolarHBondContact O-CB 3.16Å; G432-L436 WeakPolarHBondContact O-CD1 3.12Å; G432-L436 WeakPolarHBondContact O-CG 3.28Å; G432-L436 PolarHBondContact O-N 3.09Å
433	L	73.4	Confident	71.9	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-65.4	-40.1	178.9	-65.9	177.5	0	0	0	112	L429 F430 F435 L436 T437 L479 V483 F509 M513	L429-L433 HydrophobicContact CD1-CD1 3.83Å; L429-L433 HydrophobicContact CD1-CD2 4.44Å; L429-L433 HydrophobicContact CD1-CG 3.97Å; L429-L433 HydrophobicContact CD2-CD1 4.33Å; L429-L433 HydrophobicContact CG-CD1 3.72Å; L429-L433 HydrophobicContact CG-CG 4.19Å; L429-L433 WeakPolarHBondContact O-CB 3.25Å; L429-L433 WeakPolarHBondContact O-CG 3.25Å; L429-L433 PolarHBondContact O-N 3.38Å; F430-L433 PolarHBondContact O-N 3.35Å; L433-F435 VanDerWaalsContact C-N 3.35Å; L433-F435 PolarHBondContact O-N 2.9Å; L433-L436 PolarHBondContact O-N 2.88Å; L433-T437 VanDerWaalsContact O-CG2 3.28Å; L433-T437 WeakPolarHBondContact O-CG2 3.43Å; L433-T437 PolarHBondContact O-N 2.89Å; L433-L479 HydrophobicContact CD2-CD1 3.17Å; L433-L479 HydrophobicContact CD2-CG 3.73Å; L433-V483 HydrophobicContact CD1-CG2 4.15Å; L433-V483 HydrophobicContact CD2-CG2 4.41Å; L433-F509 HydrophobicContact CD1-CB 4.35Å; L433-F509 HydrophobicContact CD1-CD1 3.24Å; L433-F509 HydrophobicContact CD1-CD2 4.09Å; L433-F509 HydrophobicContact CD1-CE1 3.34Å; L433-F509 HydrophobicContact CD1-CE2 4.19Å; L433-F509 HydrophobicContact CD1-CG 3.65Å; L433-F509 HydrophobicContact CD1-CZ 3.84Å; L433-M513 HydrophobicContact CB-CE 3.83Å
434	F	69.8	Low	69.7	Low	54 Å²	54	51 Å²	51	24%	0.237	28%	0.282	C	S	.	.	H	α-helix	trans	-56.7	-47.4	175.7	-179	-92.9	0	0	0	111.4	F430 L431 T437 S524 F528	F430-F434 VanDerWaalsContact O-CB 3.22Å; F430-F434 WeakPolarHBondContact O-CB 3.46Å; F430-F434 PolarHBondContact O-N 2.89Å; L431-F434 PolarHBondContact O-N 2.83Å; F434-T437 PolarHBondContact O-OG1 3.05Å; F434-S524 PolarHBondContact O-OG 3.44Å; F434-F528 HydrophobicContact CZ-CB 4.08Å; F434-F528 HydrophobicContact CZ-CG 4.45Å
435	F	67.3	Low	67.5	Low	94 Å²	94	50.7 Å²	50.7	41%	0.412	27%	0.273	S	S	.	.	H	α-helix	trans	-74.9	-34	178.2	-71.6	-64	0	0	0	113.9	L431 G432 L433 T437 T438 L525	L431-F435 HydrophobicContact CD1-CD2 4.07Å; L431-F435 HydrophobicContact CD1-CE2 3.4Å; L431-F435 VanDerWaalsContact CD1-CE2 3.4Å; L431-F435 HydrophobicContact CD1-CZ 4.28Å; L431-F435 HydrophobicContact CD2-CE2 4.46Å; L431-F435 HydrophobicContact CG-CD2 3.98Å; L431-F435 HydrophobicContact CG-CE2 3.68Å; L431-F435 WeakPolarHBondContact O-CD2 3.45Å; L431-F435 PolarHBondContact O-N 2.8Å; L431-F435 VanDerWaalsContact O-N 3.13Å; G432-F435 PolarHBondContact O-N 3.33Å; L433-F435 VanDerWaalsContact C-N 3.35Å; L433-F435 PolarHBondContact O-N 2.9Å; F435-T437 PolarHBondContact O-N 3.36Å; F435-T438 PolarHBondContact O-N 3.46Å; F435-L525 HydrophobicContact CD1-CD1 4.05Å
436	L	63.4	Low	65.6	Low	38 Å²	38	53.5 Å²	53.5	20%	0.199	29%	0.287	C	S	.	.	H	α-helix	trans	-67	-22.4	-179.7	-77.6	169	0	0	0	113.5	G432 L433 T438 P439 F475 I482	G432-L436 VanDerWaalsContact O-CB 3.26Å; G432-L436 WeakPolarHBondContact O-CB 3.16Å; G432-L436 WeakPolarHBondContact O-CD1 3.12Å; G432-L436 WeakPolarHBondContact O-CG 3.28Å; G432-L436 PolarHBondContact O-N 3.09Å; L433-L436 PolarHBondContact O-N 2.88Å; L436-T438 PolarHBondContact O-N 3.02Å; L436-P439 VanDerWaalsContact O-CD 3.28Å; L436-P439 WeakPolarHBondContact O-CD 3.26Å; L436-P439 WeakPolarHBondContact O-CG 3.11Å; L436-F475 HydrophobicContact CD2-CB 4.08Å; L436-F475 HydrophobicContact CD2-CD1 3.42Å; L436-F475 VanDerWaalsContact CD2-CD1 3.42Å; L436-F475 HydrophobicContact CD2-CD2 3.77Å; L436-F475 HydrophobicContact CD2-CE1 3.64Å; L436-F475 HydrophobicContact CD2-CE2 3.94Å; L436-F475 HydrophobicContact CD2-CG 3.51Å; L436-F475 HydrophobicContact CD2-CZ 3.9Å; L436-I482 HydrophobicContact CD1-CD1 3.96Å
437	T	60.2	Low	63.6	Low	40 Å²	40	56.9 Å²	56.9	25%	0.245	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-12.5	176.2	56.1	0	0	0	0	114.2	L433 F434 F435 P439 M513 L517 S524	L433-T437 VanDerWaalsContact O-CG2 3.28Å; L433-T437 WeakPolarHBondContact O-CG2 3.43Å; L433-T437 PolarHBondContact O-N 2.89Å; F434-T437 PolarHBondContact O-OG1 3.05Å; F435-T437 PolarHBondContact O-N 3.36Å; T437-P439 VanDerWaalsContact C-CD 3.41Å; T437-M513 HydrophobicContact CG2-CE 3.29Å; T437-M513 HydrophobicContact CG2-CG 4.22Å; T437-M513 HydrophobicContact CG2-SD 3.08Å; T437-M513 WeakPolarHBondContact CG2-SD 3.49Å; T437-L517 HydrophobicContact CG2-CD1 3.64Å; T437-S524 PolarHBondContact OG1-OG 3.38Å
438	T	54.8	Low	61.6	Low	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.316	C	S	.	.			trans	-121.2	39.1	-169.2	-17	0	0	0	0	116.5	F435 L436 S440 I441 I442 S524 L525	F435-T438 PolarHBondContact O-N 3.46Å; L436-T438 PolarHBondContact O-N 3.02Å; T438-S440 VanDerWaalsContact C-N 3.27Å; T438-S440 PolarHBondContact O-N 2.88Å; T438-I441 HydrophobicContact CG2-CB 3.41Å; T438-I441 VanDerWaalsContact CG2-CB 3.41Å; T438-I441 HydrophobicContact CG2-CG1 3.46Å; T438-I441 VanDerWaalsContact CG2-CG1 3.46Å; T438-I441 HydrophobicContact CG2-CG2 4.25Å; T438-I441 PolarHBondContact O-N 3.3Å; T438-I442 WeakPolarHBondContact O-CG1 3.21Å; T438-I442 PolarHBondContact O-N 3.24Å; T438-I442 VanDerWaalsContact O-N 3.11Å; T438-S524 PolarHBondContact OG1-OG 3.28Å; T438-L525 HydrophobicContact CG2-CB 3.52Å; T438-L525 HydrophobicContact CG2-CD1 4.24Å
439	P	52.8	Low	59.8	Low	8 Å²	8	61.2 Å²	61.2	5%	0.052	32%	0.316	C	S	.	.	H	α-helix	trans	-66.4	-31	-177.8	-13	30	0	0	0	112.4	L436 T437 L443 L471 F475	L436-P439 VanDerWaalsContact O-CD 3.28Å; L436-P439 WeakPolarHBondContact O-CD 3.26Å; L436-P439 WeakPolarHBondContact O-CG 3.11Å; T437-P439 VanDerWaalsContact C-CD 3.41Å; P439-L443 PolarHBondContact O-N 2.98Å; P439-L471 HydrophobicContact CB-CD2 3.62Å; P439-L471 HydrophobicContact CB-CG 4.06Å; P439-F475 HydrophobicContact CB-CD2 4.5Å; P439-F475 HydrophobicContact CG-CD2 3.94Å
440	S	47.8	Very low	58	Low	59 Å²	59	65.5 Å²	65.5	41%	0.413	34%	0.339	S	S	.	.	H	α-helix	trans	-68.5	-38.4	178	56.4	0	0	0	0	113.1	T438 S444	T438-S440 VanDerWaalsContact C-N 3.27Å; T438-S440 PolarHBondContact O-N 2.88Å; S440-S444 PolarHBondContact O-N 2.8Å; S440-S444 VanDerWaalsContact O-N 3.14Å
441	I	49.5	Very low	56.5	Low	30 Å²	30	64.9 Å²	64.9	15%	0.154	35%	0.345	C	S	.	.	H	α-helix	trans	-75.1	-43.3	177.7	-60.3	-93.9	0	0	0	109.9	T438 L443 S444 T445 T523 D526	T438-I441 HydrophobicContact CG2-CB 3.41Å; T438-I441 VanDerWaalsContact CG2-CB 3.41Å; T438-I441 HydrophobicContact CG2-CG1 3.46Å; T438-I441 VanDerWaalsContact CG2-CG1 3.46Å; T438-I441 HydrophobicContact CG2-CG2 4.25Å; T438-I441 PolarHBondContact O-N 3.3Å; I441-L443 PolarHBondContact O-N 3.5Å; I441-S444 VanDerWaalsContact CA-OG 3.31Å; I441-S444 WeakPolarHBondContact CA-OG 3.42Å; I441-S444 CarbonylContact O-C 3.59Å; I441-S444 WeakPolarHBondContact O-CA 3.09Å; I441-S444 PolarHBondContact O-N 3.2Å; I441-S444 PolarHBondContact O-OG 3.26Å; I441-T445 HydrophobicContact CG2-CG2 3.9Å; I441-T445 PolarHBondContact O-N 3.24Å; I441-T445 PolarHBondContact O-OG1 2.9Å; I441-T523 HydrophobicContact CD1-CG2 4.18Å; I441-T523 WeakPolarHBondContact CD1-OG1 3.38Å; I441-T523 HydrophobicContact CG1-CG2 4Å; I441-D526 HydrophobicContact CD1-CB 4.33Å
442	I	51.1	Low	54.9	Low	73 Å²	73	61.8 Å²	61.8	37%	0.374	33%	0.329	S	S	.	.	H	α-helix	trans	-51.4	-46.6	177.4	-69.9	168.6	0	0	0	110.1	T438 T445 M446 L525	T438-I442 WeakPolarHBondContact O-CG1 3.21Å; T438-I442 PolarHBondContact O-N 3.24Å; T438-I442 VanDerWaalsContact O-N 3.11Å; I442-T445 WeakPolarHBondContact CA-OG1 3.37Å; I442-T445 PolarHBondContact O-N 3.16Å; I442-T445 PolarHBondContact O-OG1 3.46Å; I442-T445 VanDerWaalsContact O-OG1 3.06Å; I442-M446 HydrophobicContact CG2-SD 4.25Å; I442-M446 WeakPolarHBondContact O-CB 3.48Å; I442-M446 WeakPolarHBondContact O-CG 3.22Å; I442-M446 PolarHBondContact O-N 3.43Å; I442-L525 HydrophobicContact CG1-CD1 4.21Å
443	L	51.1	Low	53.6	Low	60 Å²	60	68 Å²	68	31%	0.314	35%	0.348	S	S	.	.	H	α-helix	trans	-63.3	-47.4	176.2	-163	96.8	0	0	0	112.3	P439 I441 T445 M446 D447 F467 P468	P439-L443 PolarHBondContact O-N 2.98Å; I441-L443 PolarHBondContact O-N 3.5Å; L443-T445 VanDerWaalsContact C-N 3.33Å; L443-T445 PolarHBondContact O-N 2.9Å; L443-M446 PolarHBondContact O-N 3.18Å; L443-D447 PolarHBondContact O-N 3.43Å; L443-D447 VanDerWaalsContact O-N 3.09Å; L443-F467 HydrophobicContact CD1-CD1 4.29Å; L443-P468 HydrophobicContact CD1-CG 3.94Å; L443-P468 HydrophobicContact CD2-CB 3.94Å; L443-P468 HydrophobicContact CD2-CG 3.13Å; L443-P468 HydrophobicContact CG-CG 4.01Å
444	S	45.8	Very low	52.5	Low	61 Å²	61	72.7 Å²	72.7	43%	0.427	38%	0.378	S	S	.	.	H	α-helix	trans	-65.5	-32	178.8	75.9	0	0	0	0	113.6	S440 I441 K448	S440-S444 PolarHBondContact O-N 2.8Å; S440-S444 VanDerWaalsContact O-N 3.14Å; I441-S444 VanDerWaalsContact CA-OG 3.31Å; I441-S444 WeakPolarHBondContact CA-OG 3.42Å; I441-S444 CarbonylContact O-C 3.59Å; I441-S444 WeakPolarHBondContact O-CA 3.09Å; I441-S444 PolarHBondContact O-N 3.2Å; I441-S444 PolarHBondContact O-OG 3.26Å; S444-K448 WeakPolarHBondContact O-CB 3.37Å; S444-K448 PolarHBondContact O-N 3.14Å
445	T	47.3	Very low	51.6	Low	27 Å²	27	74.2 Å²	74.2	17%	0.166	39%	0.388	C	S	.	.	H	α-helix	trans	-78.9	-35.8	175.5	42.9	0	0	0	0	111.8	I441 I442 L443 D447 K448 F449 F529	I441-T445 HydrophobicContact CG2-CG2 3.9Å; I441-T445 PolarHBondContact O-N 3.24Å; I441-T445 PolarHBondContact O-OG1 2.9Å; I442-T445 WeakPolarHBondContact CA-OG1 3.37Å; I442-T445 PolarHBondContact O-N 3.16Å; I442-T445 PolarHBondContact O-OG1 3.46Å; I442-T445 VanDerWaalsContact O-OG1 3.06Å; L443-T445 VanDerWaalsContact C-N 3.33Å; L443-T445 PolarHBondContact O-N 2.9Å; T445-D447 PolarHBondContact O-N 2.93Å; T445-K448 PolarHBondContact O-N 3.44Å; T445-K448 VanDerWaalsContact O-N 3.13Å; T445-F449 HydrophobicContact CG2-CE2 4.45Å; T445-F449 WeakPolarHBondContact O-CD2 3.32Å; T445-F449 PolarHBondContact O-N 3.43Å; T445-F529 HydrophobicContact CG2-CE2 4.37Å
446	M	50.6	Low	50.9	Low	90 Å²	90	75.5 Å²	75.5	44%	0.443	40%	0.395	S	S	.	.	H	α-helix	trans	-58.8	-36.9	170.3	-88.4	178.8	59.6	0	0	111.2	I442 L443	I442-M446 HydrophobicContact CG2-SD 4.25Å; I442-M446 WeakPolarHBondContact O-CB 3.48Å; I442-M446 WeakPolarHBondContact O-CG 3.22Å; I442-M446 PolarHBondContact O-N 3.43Å; L443-M446 PolarHBondContact O-N 3.18Å
447	D	47.4	Very low	50.3	Low	99 Å²	99	78.1 Å²	78.1	53%	0.529	42%	0.422	S	S	.	.	H	α-helix	trans	-69.4	-42.2	173.3	-132.9	18.4	0	0	0	111.7	L443 T445 F449 N450	L443-D447 PolarHBondContact O-N 3.43Å; L443-D447 VanDerWaalsContact O-N 3.09Å; T445-D447 PolarHBondContact O-N 2.93Å; D447-F449 PolarHBondContact O-N 3.48Å; D447-N450 PolarHBondContact O-N 2.78Å
448	K	47.7	Very low	49.9	Very low	180 Å²	180	81.4 Å²	81.4	78%	0.783	44%	0.437	S	S	*	.	H	α-helix	trans	-66.6	-30.2	178.2	-167.2	173.6	179.9	178.1	0	114.2	S444 T445	S444-K448 WeakPolarHBondContact O-CB 3.37Å; S444-K448 PolarHBondContact O-N 3.14Å; T445-K448 PolarHBondContact O-N 3.44Å; T445-K448 VanDerWaalsContact O-N 3.13Å
449	F	50.4	Low	49.7	Very low	131 Å²	131	87.6 Å²	87.6	58%	0.575	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	7.1	179.7	-73.6	-67.4	0	0	0	114.2	T445 D447 V451	T445-F449 HydrophobicContact CG2-CE2 4.45Å; T445-F449 WeakPolarHBondContact O-CD2 3.32Å; T445-F449 PolarHBondContact O-N 3.43Å; D447-F449 PolarHBondContact O-N 3.48Å; F449-V451 HydrophobicContact CB-CG2 4.08Å; F449-V451 WeakPolarHBondContact O-CG2 3.44Å; F449-V451 PolarHBondContact O-N 3.4Å
450	N	48	Very low	49.9	Very low	99 Å²	99	91.5 Å²	91.5	53%	0.529	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	21.7	171.1	-134.2	-5.6	0	0	0	114.2	D447 T452	D447-N450 PolarHBondContact O-N 2.78Å; N450-T452 PolarHBondContact O-N 3.18Å
451	V	50.3	Low	50.3	Low	110 Å²	110	92.3 Å²	92.3	67%	0.667	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-7.3	176.6	-171	0	0	0	0	110.8	F449	F449-V451 HydrophobicContact CB-CG2 4.08Å; F449-V451 WeakPolarHBondContact O-CG2 3.44Å; F449-V451 PolarHBondContact O-N 3.4Å
452	T	47.3	Very low	50.5	Low	11 Å²	11	96.4 Å²	96.4	7%	0.067	52%	0.516	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	16.5	179.6	37.7	0	0	0	0	114.7	N450 P454 I455 H456	N450-T452 PolarHBondContact O-N 3.18Å; T452-P454 VanDerWaalsContact C-N 3.26Å; T452-P454 VanDerWaalsContact O-N 3.15Å; T452-I455 HydrophobicContact CG2-CB 4.17Å; T452-I455 HydrophobicContact CG2-CD1 3.9Å; T452-I455 HydrophobicContact CG2-CG2 4.46Å; T452-I455 PolarHBondContact O-N 2.95Å; T452-H456 PolarHBondContact O-N 3.25Å
453	K	48.6	Very low	50.8	Low	162 Å²	162	97 Å²	97	70%	0.704	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-29.8	173.4	-78.4	-170.2	178.5	-177.9	0	115.3
454	P	51.4	Low	50.8	Low	100 Å²	100	97.4 Å²	97.4	65%	0.649	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-11.8	171.6	0.4	16.4	0	0	0	114.1	T452	T452-P454 VanDerWaalsContact C-N 3.26Å; T452-P454 VanDerWaalsContact O-N 3.15Å
455	I	50.8	Low	51.2	Low	86 Å²	86	101.1 Å²	101.1	44%	0.441	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-20.8	-172.5	-68.4	164.5	0	0	0	112.1	T452 A457 L458	T452-I455 HydrophobicContact CG2-CB 4.17Å; T452-I455 HydrophobicContact CG2-CD1 3.9Å; T452-I455 HydrophobicContact CG2-CG2 4.46Å; T452-I455 PolarHBondContact O-N 2.95Å; I455-A457 PolarHBondContact O-N 3.23Å; I455-A457 VanDerWaalsContact O-N 3.14Å; I455-L458 CarbonylContact O-C 3.54Å; I455-L458 PolarHBondContact O-N 3.46Å
456	H	51.5	Low	51.8	Low	121 Å²	121	105.9 Å²	105.9	56%	0.56	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	-17.4	169.6	-88.1	-60.1	0	0	0	114.1	T452 L458	T452-H456 PolarHBondContact O-N 3.25Å; H456-L458 VanDerWaalsContact C-N 3.28Å
457	A	52.8	Low	52.2	Low	93 Å²	93	106.6 Å²	106.6	77%	0.769	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-16.2	171.7	0	0	0	0	0	113.2	I455	I455-A457 PolarHBondContact O-N 3.23Å; I455-A457 VanDerWaalsContact O-N 3.14Å
458	L	51.4	Low	52.4	Low	109 Å²	109	102.8 Å²	102.8	57%	0.571	54%	0.537	S	S	*	.	S	Bend	trans	-106.8	55.7	174.6	-71.1	164.2	0	0	0	109.5	I455 H456 N460	I455-L458 CarbonylContact O-C 3.54Å; I455-L458 PolarHBondContact O-N 3.46Å; H456-L458 VanDerWaalsContact C-N 3.28Å; L458-N460 PolarHBondContact O-N 3.45Å
459	N	50.3	Low	52.7	Low	131 Å²	131	98.5 Å²	98.5	70%	0.701	53%	0.526	S	S	*	.			trans	-74.2	54.1	-178.8	-154.1	22.1	0	0	0	112.1
460	N	57.3	Low	53.2	Low	89 Å²	89	96 Å²	96	48%	0.476	52%	0.518	S	S	.	.			trans	-90.7	117.6	170.9	-94.2	-43.3	0	0	0	108.5	L458 I462 I463 S464	L458-N460 PolarHBondContact O-N 3.45Å; N460-I462 PolarHBondContact O-N 3.46Å; N460-I463 HydrophobicContact CB-CD1 4.4Å; N460-I463 HydrophobicContact CB-CG1 4.31Å; N460-I463 PolarHBondContact O-N 3.09Å; N460-S464 PolarHBondContact O-N 3.38Å
461	P	55.9	Low	53.7	Low	77 Å²	77	93.3 Å²	93.3	50%	0.5	50%	0.504	S	S	.	.	H	α-helix	trans	-57.9	-20.8	177.2	22.3	-31.8	0	0	0	112.4	Q465	P461-Q465 WeakPolarHBondContact O-CB 3.38Å; P461-Q465 PolarHBondContact O-N 3.06Å; P461-Q465 VanDerWaalsContact O-N 3.12Å
462	I	53.6	Low	54.1	Low	115 Å²	115	92.1 Å²	92.1	59%	0.59	49%	0.494	S	S	*	.	H	α-helix	trans	-61.2	-50.2	170.4	-58	170.4	0	0	0	110.3	N460 F466	N460-I462 PolarHBondContact O-N 3.46Å; I462-F466 HydrophobicContact CG2-CB 4.24Å; I462-F466 WeakPolarHBondContact O-CA 3.46Å; I462-F466 WeakPolarHBondContact O-CB 3.22Å; I462-F466 PolarHBondContact O-N 3.22Å
463	I	56.3	Low	54.8	Low	87 Å²	87	100.4 Å²	100.4	45%	0.446	52%	0.524	S	S	.	.	H	α-helix	trans	-71.9	-38.2	-174.9	-60	175.5	0	0	0	111.3	N460 F467	N460-I463 HydrophobicContact CB-CD1 4.4Å; N460-I463 HydrophobicContact CB-CG1 4.31Å; N460-I463 PolarHBondContact O-N 3.09Å; I463-F467 WeakPolarHBondContact O-CB 3.43Å
464	S	52.9	Low	55.6	Low	67 Å²	67	95.3 Å²	95.3	47%	0.469	51%	0.508	S	S	.	.	H	α-helix	trans	-76.9	-27.5	-177.4	56.4	0	0	0	0	114.4	N460 P468	N460-S464 PolarHBondContact O-N 3.38Å; S464-P468 WeakPolarHBondContact O-CG 3.34Å
465	Q	53.2	Low	56.3	Low	139 Å²	139	93.3 Å²	93.3	65%	0.65	49%	0.49	S	S	*	.	H	α-helix	trans	-107	-33.1	-178.8	-60.4	179.8	-10.4	0	0	113.8	P461 T469	P461-Q465 WeakPolarHBondContact O-CB 3.38Å; P461-Q465 PolarHBondContact O-N 3.06Å; P461-Q465 VanDerWaalsContact O-N 3.12Å; Q465-T469 PolarHBondContact O-OG1 2.94Å
466	F	59.9	Low	56.9	Low	127 Å²	127	93 Å²	93	56%	0.557	50%	0.495	S	S	*	.	H	α-helix	trans	-82	-42	-178.6	-171.7	-107.8	0	0	0	112.2	I462 T469 L470	I462-F466 HydrophobicContact CG2-CB 4.24Å; I462-F466 WeakPolarHBondContact O-CA 3.46Å; I462-F466 WeakPolarHBondContact O-CB 3.22Å; I462-F466 PolarHBondContact O-N 3.22Å; F466-T469 PolarHBondContact O-N 3.45Å; F466-L470 HydrophobicContact CD1-CB 4.43Å; F466-L470 HydrophobicContact CD1-CD1 4.34Å; F466-L470 HydrophobicContact CE1-CB 4.29Å; F466-L470 HydrophobicContact CE1-CD1 3.46Å; F466-L470 VanDerWaalsContact CE1-CD1 3.46Å; F466-L470 HydrophobicContact CE1-CG 4.47Å; F466-L470 HydrophobicContact CZ-CD1 3.65Å; F466-L470 VanDerWaalsContact O-CB 3.3Å; F466-L470 WeakPolarHBondContact O-CB 3.39Å; F466-L470 PolarHBondContact O-N 2.72Å
467	F	58.4	Low	57.6	Low	106 Å²	106	90.2 Å²	90.2	47%	0.465	49%	0.493	S	S	.	.	H	α-helix	trans	-57.4	-46.5	-178	-175.9	-100.8	0	0	0	113.2	L443 I463 T469 L470 L471	L443-F467 HydrophobicContact CD1-CD1 4.29Å; I463-F467 WeakPolarHBondContact O-CB 3.43Å; F467-T469 VanDerWaalsContact C-N 3.34Å; F467-T469 PolarHBondContact O-N 3.29Å; F467-L470 PolarHBondContact O-N 3.27Å; F467-L471 HydrophobicContact CE1-CD2 4.2Å; F467-L471 HydrophobicContact CZ-CD1 4.43Å; F467-L471 WeakPolarHBondContact O-CB 3.34Å; F467-L471 PolarHBondContact O-N 2.96Å
468	P	52	Low	58.5	Low	18 Å²	18	89.7 Å²	89.7	12%	0.117	48%	0.477	C	S	.	.	H	α-helix	trans	-68	-36.3	-179	-16.5	32.3	0	0	0	112.2	L443 S464 L472	L443-P468 HydrophobicContact CD1-CG 3.94Å; L443-P468 HydrophobicContact CD2-CB 3.94Å; L443-P468 HydrophobicContact CD2-CG 3.13Å; L443-P468 HydrophobicContact CG-CG 4.01Å; S464-P468 WeakPolarHBondContact O-CG 3.34Å; P468-L472 VanDerWaalsContact O-CB 3.27Å; P468-L472 WeakPolarHBondContact O-CB 3.3Å; P468-L472 PolarHBondContact O-N 3.46Å
469	T	54.3	Low	59.5	Low	90 Å²	90	85.3 Å²	85.3	55%	0.552	45%	0.454	S	S	*	.	H	α-helix	trans	-69.9	-44.3	179.1	-50	0	0	0	0	111	Q465 F466 F467 L472 W473	Q465-T469 PolarHBondContact O-OG1 2.94Å; F466-T469 PolarHBondContact O-N 3.45Å; F467-T469 VanDerWaalsContact C-N 3.34Å; F467-T469 PolarHBondContact O-N 3.29Å; T469-L472 PolarHBondContact O-N 2.86Å; T469-W473 WeakPolarHBondContact O-CB 3.24Å; T469-W473 PolarHBondContact O-N 3.08Å
470	L	60	Low	60.5	Low	78 Å²	78	80 Å²	80	41%	0.408	43%	0.426	S	S	.	.	H	α-helix	trans	-67.2	-38.2	174.9	-177.5	136.4	0	0	0	111.8	F466 F467 S474	F466-L470 HydrophobicContact CD1-CB 4.43Å; F466-L470 HydrophobicContact CD1-CD1 4.34Å; F466-L470 HydrophobicContact CE1-CB 4.29Å; F466-L470 HydrophobicContact CE1-CD1 3.46Å; F466-L470 VanDerWaalsContact CE1-CD1 3.46Å; F466-L470 HydrophobicContact CE1-CG 4.47Å; F466-L470 HydrophobicContact CZ-CD1 3.65Å; F466-L470 VanDerWaalsContact O-CB 3.3Å; F466-L470 WeakPolarHBondContact O-CB 3.39Å; F466-L470 PolarHBondContact O-N 2.72Å; F467-L470 PolarHBondContact O-N 3.27Å; L470-S474 WeakPolarHBondContact O-CB 3.42Å; L470-S474 PolarHBondContact O-N 3.39Å
471	L	59.5	Low	61.4	Low	43 Å²	43	78.1 Å²	78.1	23%	0.225	42%	0.42	C	S	.	.	H	α-helix	trans	-63.3	-46.6	175.6	-171.1	74.9	0	0	0	110.8	P439 F467 S474 F475	P439-L471 HydrophobicContact CB-CD2 3.62Å; P439-L471 HydrophobicContact CB-CG 4.06Å; F467-L471 HydrophobicContact CE1-CD2 4.2Å; F467-L471 HydrophobicContact CZ-CD1 4.43Å; F467-L471 WeakPolarHBondContact O-CB 3.34Å; F467-L471 PolarHBondContact O-N 2.96Å; L471-S474 PolarHBondContact O-N 3.06Å; L471-F475 HydrophobicContact CD1-CD2 4Å; L471-F475 HydrophobicContact CD1-CE2 3.24Å; L471-F475 HydrophobicContact CD1-CZ 3.59Å; L471-F475 HydrophobicContact CD2-CE2 4Å; L471-F475 HydrophobicContact CG-CD2 3.72Å; L471-F475 HydrophobicContact CG-CE2 3.33Å; L471-F475 HydrophobicContact CG-CZ 4.2Å; L471-F475 WeakPolarHBondContact O-CB 3.4Å; L471-F475 WeakPolarHBondContact O-CD2 3.38Å; L471-F475 VanDerWaalsContact O-CG 3.31Å; L471-F475 WeakPolarHBondContact O-CG 3.36Å; L471-F475 PolarHBondContact O-N 3.37Å
472	L	58.2	Low	62.6	Low	86 Å²	86	77.1 Å²	77.1	45%	0.45	41%	0.41	S	S	.	.	H	α-helix	trans	-64	-44.3	176.8	-173.5	144.6	0	0	0	111.9	P468 T469 S476	P468-L472 VanDerWaalsContact O-CB 3.27Å; P468-L472 WeakPolarHBondContact O-CB 3.3Å; P468-L472 PolarHBondContact O-N 3.46Å; T469-L472 PolarHBondContact O-N 2.86Å; L472-S476 VanDerWaalsContact O-CB 3.24Å; L472-S476 WeakPolarHBondContact O-CB 3.44Å; L472-S476 PolarHBondContact O-N 3.41Å
473	W	61.6	Low	64	Low	185 Å²	185	71.8 Å²	71.8	70%	0.701	38%	0.383	S	S	*	.	H	α-helix	trans	-64.5	-45.4	176.7	-176.7	78.8	0	0	0	112.2	T469 F475 S476 A477	T469-W473 WeakPolarHBondContact O-CB 3.24Å; T469-W473 PolarHBondContact O-N 3.08Å; W473-F475 PolarHBondContact O-N 3.13Å; W473-S476 PolarHBondContact O-N 2.82Å; W473-A477 WeakPolarHBondContact O-CB 3.35Å; W473-A477 PolarHBondContact O-N 3.37Å
474	S	65.7	Low	65.2	Low	54 Å²	54	69.9 Å²	69.9	38%	0.378	37%	0.37	S	S	.	.	H	α-helix	trans	-61	-45.4	177.5	-177.8	0	0	0	0	111.8	L470 L471 A477 L478	L470-S474 WeakPolarHBondContact O-CB 3.42Å; L470-S474 PolarHBondContact O-N 3.39Å; L471-S474 PolarHBondContact O-N 3.06Å; S474-A477 PolarHBondContact O-N 3.39Å; S474-L478 VanDerWaalsContact O-CB 3.32Å; S474-L478 WeakPolarHBondContact O-CB 3.39Å; S474-L478 PolarHBondContact O-N 3.31Å
475	F	66.8	Low	66.7	Low	59 Å²	59	73.2 Å²	73.2	26%	0.259	37%	0.374	S	S	.	.	H	α-helix	trans	-71	-37	178.8	-70.1	-40.5	0	0	0	113.4	L436 P439 L471 W473 A477 L478 L479	L436-F475 HydrophobicContact CD2-CB 4.08Å; L436-F475 HydrophobicContact CD2-CD1 3.42Å; L436-F475 VanDerWaalsContact CD2-CD1 3.42Å; L436-F475 HydrophobicContact CD2-CD2 3.77Å; L436-F475 HydrophobicContact CD2-CE1 3.64Å; L436-F475 HydrophobicContact CD2-CE2 3.94Å; L436-F475 HydrophobicContact CD2-CG 3.51Å; L436-F475 HydrophobicContact CD2-CZ 3.9Å; P439-F475 HydrophobicContact CB-CD2 4.5Å; P439-F475 HydrophobicContact CG-CD2 3.94Å; L471-F475 HydrophobicContact CD1-CD2 4Å; L471-F475 HydrophobicContact CD1-CE2 3.24Å; L471-F475 HydrophobicContact CD1-CZ 3.59Å; L471-F475 HydrophobicContact CD2-CE2 4Å; L471-F475 HydrophobicContact CG-CD2 3.72Å; L471-F475 HydrophobicContact CG-CE2 3.33Å; L471-F475 HydrophobicContact CG-CZ 4.2Å; L471-F475 WeakPolarHBondContact O-CB 3.4Å; L471-F475 WeakPolarHBondContact O-CD2 3.38Å; L471-F475 VanDerWaalsContact O-CG 3.31Å; L471-F475 WeakPolarHBondContact O-CG 3.36Å; L471-F475 PolarHBondContact O-N 3.37Å; W473-F475 PolarHBondContact O-N 3.13Å; F475-A477 VanDerWaalsContact C-N 3.3Å; F475-A477 PolarHBondContact O-N 3.27Å; F475-L478 PolarHBondContact O-N 3.06Å; F475-L479 WeakPolarHBondContact O-CB 3.2Å; F475-L479 PolarHBondContact O-N 3.4Å
476	S	63.5	Low	68.4	Low	78 Å²	78	67 Å²	67	55%	0.545	35%	0.346	S	S	.	.	H	α-helix	trans	-61.2	-40.2	172.7	-173.8	0	0	0	0	111.5	L472 W473	L472-S476 VanDerWaalsContact O-CB 3.24Å; L472-S476 WeakPolarHBondContact O-CB 3.44Å; L472-S476 PolarHBondContact O-N 3.41Å; W473-S476 PolarHBondContact O-N 2.82Å
477	A	66.8	Low	69.7	Low	63 Å²	63	61 Å²	61	52%	0.521	32%	0.319	S	S	.	.	H	α-helix	trans	-70.5	-32.4	175.2	0	0	0	0	0	113.3	W473 S474 F475 P480	W473-A477 WeakPolarHBondContact O-CB 3.35Å; W473-A477 PolarHBondContact O-N 3.37Å; S474-A477 PolarHBondContact O-N 3.39Å; F475-A477 VanDerWaalsContact C-N 3.3Å; F475-A477 PolarHBondContact O-N 3.27Å; A477-P480 WeakPolarHBondContact O-CD 3.4Å
478	L	71.6	Confident	71	Confident	83 Å²	83	58.4 Å²	58.4	44%	0.435	31%	0.31	S	S	.	.	H	α-helix	trans	-81.5	-26.3	-178.8	-166	67.6	0	0	0	112.9	S474 F475 P480 S481 I482	S474-L478 VanDerWaalsContact O-CB 3.32Å; S474-L478 WeakPolarHBondContact O-CB 3.39Å; S474-L478 PolarHBondContact O-N 3.31Å; F475-L478 PolarHBondContact O-N 3.06Å; L478-P480 VanDerWaalsContact C-CD 3.48Å; L478-S481 WeakPolarHBondContact O-CB 3.36Å; L478-S481 PolarHBondContact O-N 3.12Å; L478-I482 HydrophobicContact CB-CD1 4.44Å; L478-I482 HydrophobicContact CD2-CD1 3.9Å; L478-I482 HydrophobicContact CD2-CG1 4.37Å; L478-I482 HydrophobicContact CG-CD1 3.84Å; L478-I482 HydrophobicContact CG-CG1 3.98Å; L478-I482 WeakPolarHBondContact O-CG1 3.2Å; L478-I482 PolarHBondContact O-N 3.26Å
479	L	72.2	Confident	72.6	Confident	17 Å²	17	62.7 Å²	62.7	9%	0.089	33%	0.331	C	S	.	.	H	α-helix	trans	-47.4	-51.1	-175.9	-157.4	85.9	0	0	0	113.6	L433 F475 S481 I482 V483 L510 M513	L433-L479 HydrophobicContact CD2-CD1 3.17Å; L433-L479 HydrophobicContact CD2-CG 3.73Å; F475-L479 WeakPolarHBondContact O-CB 3.2Å; F475-L479 PolarHBondContact O-N 3.4Å; L479-S481 VanDerWaalsContact C-N 3.3Å; L479-S481 PolarHBondContact O-N 2.83Å; L479-I482 PolarHBondContact O-N 3.02Å; L479-V483 WeakPolarHBondContact O-CG2 3.39Å; L479-V483 PolarHBondContact O-N 3.13Å; L479-V483 VanDerWaalsContact O-N 3.15Å; L479-L510 HydrophobicContact CD2-CD2 4.42Å; L479-M513 HydrophobicContact CD2-CB 4.07Å; L479-M513 HydrophobicContact CD2-CG 3.82Å
480	P	70	Confident	74.2	Confident	19 Å²	19	58.4 Å²	58.4	12%	0.123	31%	0.305	C	S	.	.	H	α-helix	trans	-68.5	-33.4	-176.1	-20	36.1	0	0	0	112.5	A477 L478 V483 Y484 L510 W613	A477-P480 WeakPolarHBondContact O-CD 3.4Å; L478-P480 VanDerWaalsContact C-CD 3.48Å; P480-V483 PolarHBondContact O-N 2.94Å; P480-Y484 WeakPolarHBondContact O-CB 3.23Å; P480-Y484 PolarHBondContact O-N 3.39Å; P480-L510 HydrophobicContact CG-CD2 4.29Å; P480-W613 HydrophobicContact CB-CZ2 3.52Å; P480-W613 HydrophobicContact CG-CZ2 4.42Å
481	S	77.4	Confident	75.6	Confident	49 Å²	49	55.4 Å²	55.4	34%	0.343	29%	0.291	S	S	.	.	H	α-helix	trans	-66.6	-40.9	176.1	-62.8	0	0	0	0	110.9	L478 L479 Y484 Y485	L478-S481 WeakPolarHBondContact O-CB 3.36Å; L478-S481 PolarHBondContact O-N 3.12Å; L479-S481 VanDerWaalsContact C-N 3.3Å; L479-S481 PolarHBondContact O-N 2.83Å; S481-Y484 PolarHBondContact O-N 3.24Å; S481-Y485 WeakPolarHBondContact O-CD2 3.4Å; S481-Y485 PolarHBondContact O-N 2.66Å
482	I	81.6	Confident	77	Confident	56 Å²	56	54.2 Å²	54.2	29%	0.287	28%	0.284	S	S	.	.	H	α-helix	trans	-61.3	-46.7	177	-64.8	166.9	0	0	0	110.5	L429 L436 L478 L479 Y484 Y485 S486	L429-I482 HydrophobicContact CD1-CG2 3.76Å; L436-I482 HydrophobicContact CD1-CD1 3.96Å; L478-I482 HydrophobicContact CB-CD1 4.44Å; L478-I482 HydrophobicContact CD2-CD1 3.9Å; L478-I482 HydrophobicContact CD2-CG1 4.37Å; L478-I482 HydrophobicContact CG-CD1 3.84Å; L478-I482 HydrophobicContact CG-CG1 3.98Å; L478-I482 WeakPolarHBondContact O-CG1 3.2Å; L478-I482 PolarHBondContact O-N 3.26Å; L479-I482 PolarHBondContact O-N 3.02Å; I482-Y484 VanDerWaalsContact C-N 3.34Å; I482-Y484 PolarHBondContact O-N 3.27Å; I482-Y485 PolarHBondContact O-N 2.82Å; I482-S486 WeakPolarHBondContact O-CB 3.18Å; I482-S486 PolarHBondContact O-N 3.05Å
483	V	81.6	Confident	78.5	Confident	3 Å²	3	54.3 Å²	54.3	2%	0.018	28%	0.278	C	S	.	.	H	α-helix	trans	-63.7	-41.5	178.7	-179.2	0	0	0	0	111	L429 L433 L479 P480 S486 T487 K505 V506 F509	L429-V483 HydrophobicContact CD1-CG2 4.18Å; L433-V483 HydrophobicContact CD1-CG2 4.15Å; L433-V483 HydrophobicContact CD2-CG2 4.41Å; L479-V483 WeakPolarHBondContact O-CG2 3.39Å; L479-V483 PolarHBondContact O-N 3.13Å; L479-V483 VanDerWaalsContact O-N 3.15Å; P480-V483 PolarHBondContact O-N 2.94Å; V483-S486 PolarHBondContact O-N 3.45Å; V483-S486 PolarHBondContact O-OG 3.3Å; V483-T487 PolarHBondContact O-N 3.01Å; V483-T487 PolarHBondContact O-OG1 3.47Å; V483-T487 VanDerWaalsContact O-OG1 3.13Å; V483-K505 HydrophobicContact CG1-CB 4.12Å; V483-V506 HydrophobicContact CB-CG2 4.12Å; V483-V506 HydrophobicContact CG1-CB 4.38Å; V483-V506 HydrophobicContact CG1-CG2 3.57Å; V483-F509 HydrophobicContact CG1-CD2 4.09Å; V483-F509 HydrophobicContact CG2-CB 4.37Å; V483-F509 HydrophobicContact CG2-CD2 4.24Å; V483-F509 HydrophobicContact CG2-CG 4.47Å
484	Y	82.6	Confident	79.9	Confident	47 Å²	47	47.4 Å²	47.4	18%	0.184	26%	0.257	C	S	.	.	H	α-helix	trans	-59.9	-53.8	175.4	169.4	-99.6	0	0	0	112.2	P480 S481 I482 S486 T487 L488 V502 E606	P480-Y484 WeakPolarHBondContact O-CB 3.23Å; P480-Y484 PolarHBondContact O-N 3.39Å; S481-Y484 PolarHBondContact O-N 3.24Å; I482-Y484 VanDerWaalsContact C-N 3.34Å; I482-Y484 PolarHBondContact O-N 3.27Å; Y484-S486 VanDerWaalsContact C-N 3.27Å; Y484-S486 PolarHBondContact O-N 2.86Å; Y484-T487 PolarHBondContact O-N 3.11Å; Y484-L488 HydrophobicContact CD1-CD1 3.97Å; Y484-L488 HydrophobicContact CE1-CD1 3.25Å; Y484-L488 HydrophobicContact CE1-CG 4.16Å; Y484-L488 HydrophobicContact CE2-CD1 4.32Å; Y484-L488 HydrophobicContact CE2-CG 4.45Å; Y484-L488 VanDerWaalsContact CZ-CD1 3.46Å; Y484-L488 PolarHBondContact O-N 2.98Å; Y484-L488 VanDerWaalsContact O-N 3.13Å; Y484-V502 HydrophobicContact CD2-CG1 4.21Å; Y484-E606 PolarHBondContact OH-OE1 2.76Å
485	Y	84.4	Confident	80.9	Confident	138 Å²	138	47.8 Å²	47.8	54%	0.541	25%	0.252	S	S	.	.	H	α-helix	trans	-63.7	-32.5	179.7	-77.7	-65.7	0	0	0	112.5	S481 I482 T487 L488 L489	S481-Y485 WeakPolarHBondContact O-CD2 3.4Å; S481-Y485 PolarHBondContact O-N 2.66Å; I482-Y485 PolarHBondContact O-N 2.82Å; Y485-T487 VanDerWaalsContact C-N 3.26Å; Y485-T487 PolarHBondContact O-N 3.26Å; Y485-L488 HydrophobicContact CD1-CD1 3.81Å; Y485-L488 HydrophobicContact CE1-CD1 4.14Å; Y485-L488 PolarHBondContact O-N 3Å; Y485-L489 VanDerWaalsContact O-CG 3.3Å; Y485-L489 WeakPolarHBondContact O-CG 3.35Å; Y485-L489 PolarHBondContact O-N 2.97Å
486	S	89.1	Confident	81.9	Confident	9 Å²	9	45.2 Å²	45.2	6%	0.063	24%	0.241	C	C	.	.	H	α-helix	trans	-59.7	-39.4	173.8	77.9	0	0	0	0	111.8	I425 L429 I482 V483 Y484 L489 E490	I425-S486 WeakPolarHBondContact CG2-O 3.49Å; L429-S486 WeakPolarHBondContact CD2-OG 3.26Å; I482-S486 WeakPolarHBondContact O-CB 3.18Å; I482-S486 PolarHBondContact O-N 3.05Å; V483-S486 PolarHBondContact O-N 3.45Å; V483-S486 PolarHBondContact O-OG 3.3Å; Y484-S486 VanDerWaalsContact C-N 3.27Å; Y484-S486 PolarHBondContact O-N 2.86Å; S486-L489 PolarHBondContact O-N 2.74Å; S486-E490 PolarHBondContact O-N 2.89Å
487	T	86.5	Confident	83	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-74.5	-36.3	-179.5	-49	0	0	0	0	111.7	V483 Y484 Y485 L489 E490 I501 V502	V483-T487 PolarHBondContact O-N 3.01Å; V483-T487 PolarHBondContact O-OG1 3.47Å; V483-T487 VanDerWaalsContact O-OG1 3.13Å; Y484-T487 PolarHBondContact O-N 3.11Å; Y485-T487 VanDerWaalsContact C-N 3.26Å; Y485-T487 PolarHBondContact O-N 3.26Å; T487-L489 VanDerWaalsContact C-N 3.26Å; T487-L489 PolarHBondContact O-N 3.43Å; T487-E490 WeakPolarHBondContact O-CB 3.39Å; T487-E490 PolarHBondContact O-N 2.95Å; T487-E490 VanDerWaalsContact O-N 3.12Å; T487-I501 HydrophobicContact CG2-CB 4.31Å; T487-I501 HydrophobicContact CG2-CG2 3.82Å; T487-V502 HydrophobicContact CG2-CB 4.46Å; T487-V502 HydrophobicContact CG2-CG2 3.48Å; T487-V502 VanDerWaalsContact CG2-CG2 3.48Å
488	L	84.7	Confident	84.1	Confident	51 Å²	51	40.6 Å²	40.6	27%	0.267	21%	0.205	S	C	.	.	H	α-helix	trans	-59.8	-38.3	171.4	-79	172.9	0	0	0	112.1	Y484 Y485 E490 S491 E498	Y484-L488 HydrophobicContact CD1-CD1 3.97Å; Y484-L488 HydrophobicContact CE1-CD1 3.25Å; Y484-L488 HydrophobicContact CE1-CG 4.16Å; Y484-L488 HydrophobicContact CE2-CD1 4.32Å; Y484-L488 HydrophobicContact CE2-CG 4.45Å; Y484-L488 VanDerWaalsContact CZ-CD1 3.46Å; Y484-L488 PolarHBondContact O-N 2.98Å; Y484-L488 VanDerWaalsContact O-N 3.13Å; Y485-L488 HydrophobicContact CD1-CD1 3.81Å; Y485-L488 HydrophobicContact CE1-CD1 4.14Å; Y485-L488 PolarHBondContact O-N 3Å; L488-E490 PolarHBondContact O-N 2.92Å; L488-S491 PolarHBondContact O-N 3.49Å; L488-E498 WeakPolarHBondContact CD2-OE1 3.4Å
489	L	86.8	Confident	84.9	Confident	108 Å²	108	37.8 Å²	37.8	57%	0.565	19%	0.191	S	C	*	.	H	α-helix	trans	-68.5	-21.1	178.2	-70.3	172	0	0	0	112.4	Q421 I425 Y485 S486 T487 S491	Q421-L489 PolarHBondContact NE2-O 3.15Å; I425-L489 HydrophobicContact CD1-CB 3.65Å; Y485-L489 VanDerWaalsContact O-CG 3.3Å; Y485-L489 WeakPolarHBondContact O-CG 3.35Å; Y485-L489 PolarHBondContact O-N 2.97Å; S486-L489 PolarHBondContact O-N 2.74Å; T487-L489 VanDerWaalsContact C-N 3.26Å; T487-L489 PolarHBondContact O-N 3.43Å; L489-S491 PolarHBondContact O-N 2.89Å; L489-S491 PolarHBondContact O-OG 3.26Å
490	E	88.2	Confident	85.7	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-15.8	176.5	-68.9	168.8	-177.1	0	0	113.6	W418 I425 N426 S486 T487 L488 H492 K505	W418-E490 PolarHBondContact NE1-O 3.49Å; I425-E490 HydrophobicContact CD1-CG 4.06Å; I425-E490 HydrophobicContact CG2-CG 4.36Å; N426-E490 PolarHBondContact ND2-OE1 3.34Å; N426-E490 PolarHBondContact OD1-OE1 3.4Å; S486-E490 PolarHBondContact O-N 2.89Å; T487-E490 WeakPolarHBondContact O-CB 3.39Å; T487-E490 PolarHBondContact O-N 2.95Å; T487-E490 VanDerWaalsContact O-N 3.12Å; L488-E490 PolarHBondContact O-N 2.92Å; E490-H492 IonicContact OE2-CE1 3.56Å; E490-H492 IonicContact OE2-NE2 3.99Å; E490-H492 PolarHBondContact OE2-NE2 3.48Å; E490-H492 VanDerWaalsContact OE2-NE2 3.08Å; E490-K505 IonicContact OE1-NZ 2.7Å; E490-K505 PolarHBondContact OE1-NZ 2.77Å; E490-K505 IonicContact OE2-NZ 3.21Å; E490-K505 PolarHBondContact OE2-NZ 3.33Å
491	S	88.1	Confident	86.7	Confident	16 Å²	16	42.4 Å²	42.4	11%	0.112	21%	0.211	C	C	.	.			trans	57.5	61.1	171.9	-51.4	0	0	0	0	114	L488 L489	L488-S491 PolarHBondContact O-N 3.49Å; L489-S491 PolarHBondContact O-N 2.89Å; L489-S491 PolarHBondContact O-OG 3.26Å
492	H	89.4	Confident	87.3	Confident	17 Å²	17	40.2 Å²	40.2	8%	0.079	20%	0.195	C	C	.	.			trans	-68.9	151.3	177	-65.9	-73.7	0	0	0	112.5	N410 W418 E490 E498 I501	N410-H492 WeakPolarHBondContact CB-O 3.39Å; N410-H492 PolarHBondContact ND2-O 2.96Å; W418-H492 AromaticContact CZ2-CE1 3.93Å; E490-H492 IonicContact OE2-CE1 3.56Å; E490-H492 IonicContact OE2-NE2 3.99Å; E490-H492 PolarHBondContact OE2-NE2 3.48Å; E490-H492 VanDerWaalsContact OE2-NE2 3.08Å; H492-E498 HydrophobicContact CB-CB 4.09Å; H492-I501 WeakPolarHBondContact CE1-CD1 3.4Å
493	W	90.4	Very high	87.7	Confident	88 Å²	88	37.5 Å²	37.5	33%	0.333	18%	0.182	S	C	.	.	S	Bend	trans	-76.1	-21.1	-175.7	-63.2	-19.4	0	0	0	114.7	F231 T233 C407 L411 I413 Q414	F231-W493 HydrophobicContact CE1-CE3 4.35Å; F231-W493 HydrophobicContact CE1-CZ3 4.4Å; T233-W493 HydrophobicContact CG2-CZ3 4.45Å; C407-W493 WeakPolarHBondContact CA-O 3.42Å; C407-W493 WeakPolarHBondContact CB-O 3.31Å; C407-W493 PolarHBondContact N-O 3.34Å; L411-W493 HydrophobicContact CD2-CB 4.09Å; L411-W493 HydrophobicContact CD2-CG 4.06Å; I413-W493 PolarHBondContact O-NE1 2.98Å; Q414-W493 HydrophobicContact CB-CZ2 4.35Å; Q414-W493 HydrophobicContact CG-CZ2 3.9Å
494	T	89.6	Confident	88	Confident	40 Å²	40	39.9 Å²	39.9	25%	0.245	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-128.3	140.7	-177.5	53.3	0	0	0	0	110.1	A401 D405 S496 G497 E498	A401-T494 HydrophobicContact CB-CG2 4.05Å; D405-T494 CarbonylContact O-C 3.56Å; D405-T494 WeakPolarHBondContact O-CA 3.13Å; D405-T494 WeakPolarHBondContact OD2-CB 3.49Å; T494-S496 VanDerWaalsContact C-N 3.32Å; T494-S496 PolarHBondContact O-N 3.08Å; T494-G497 PolarHBondContact O-N 3.31Å; T494-G497 PolarHBondContact OG1-N 2.69Å; T494-E498 PolarHBondContact O-N 3.41Å
495	K	86.9	Confident	88.3	Confident	63 Å²	63	39 Å²	39	27%	0.274	19%	0.193	S	C	.	.	H	α-helix	trans	-66.4	-35.6	176.7	-59.8	171	-174.2	163	0	111.6	E404 D405 C407 E498 N499	E404-K495 WeakPolarHBondContact O-CE 3.44Å; E404-K495 PolarHBondContact O-NZ 2.81Å; D405-K495 WeakPolarHBondContact O-CG 3.26Å; D405-K495 PolarHBondContact O-N 3.49Å; D405-K495 WeakPolarHBondContact OD1-CB 3.28Å; D405-K495 PolarHBondContact OD1-N 3.19Å; C407-K495 WeakPolarHBondContact SG-CG 3.35Å; K495-E498 WeakPolarHBondContact O-CB 3.48Å; K495-E498 PolarHBondContact O-N 2.89Å; K495-N499 PolarHBondContact O-N 2.9Å; K495-N499 PolarHBondContact O-ND2 2.82Å
496	S	88.1	Confident	88.5	Confident	5 Å²	5	32.5 Å²	32.5	4%	0.035	17%	0.168	C	C	.	.	H	α-helix	trans	-65.6	-46.8	177.8	-62.6	0	0	0	0	111.8	D405 T494 E498 N499 Q500 L659 E660	D405-S496 WeakPolarHBondContact OD1-CB 3.2Å; D405-S496 PolarHBondContact OD1-N 3.36Å; D405-S496 PolarHBondContact OD1-OG 3.28Å; D405-S496 WeakPolarHBondContact OD2-CB 3.35Å; D405-S496 PolarHBondContact OD2-OG 3.39Å; T494-S496 VanDerWaalsContact C-N 3.32Å; T494-S496 PolarHBondContact O-N 3.08Å; S496-E498 PolarHBondContact O-N 3.45Å; S496-N499 PolarHBondContact O-N 3.43Å; S496-Q500 PolarHBondContact O-N 3.11Å; S496-L659 WeakPolarHBondContact OG-CA 3.34Å; S496-L659 WeakPolarHBondContact OG-CD2 3.49Å; S496-E660 PolarHBondContact OG-N 3.25Å
497	G	87.8	Confident	88.5	Confident	19 Å²	19	32.7 Å²	32.7	20%	0.196	17%	0.168	C	C	.	.	H	α-helix	trans	-60.2	-42.3	172.4	0	0	0	0	0	112.9	T494 Q500 I501	T494-G497 PolarHBondContact O-N 3.31Å; T494-G497 PolarHBondContact OG1-N 2.69Å; G497-Q500 PolarHBondContact O-N 3.46Å; G497-I501 WeakPolarHBondContact O-CG1 3.26Å; G497-I501 PolarHBondContact O-N 3.33Å
498	E	88.9	Confident	88.6	Confident	25 Å²	25	37.5 Å²	37.5	12%	0.117	19%	0.192	C	C	.	.	H	α-helix	trans	-57.7	-51.4	174.4	-171.7	178.8	95.1	0	0	111.2	L488 H492 T494 K495 S496 Q500 I501 V502	L488-E498 WeakPolarHBondContact CD2-OE1 3.4Å; H492-E498 HydrophobicContact CB-CB 4.09Å; T494-E498 PolarHBondContact O-N 3.41Å; K495-E498 WeakPolarHBondContact O-CB 3.48Å; K495-E498 PolarHBondContact O-N 2.89Å; S496-E498 PolarHBondContact O-N 3.45Å; E498-Q500 VanDerWaalsContact C-N 3.33Å; E498-Q500 PolarHBondContact O-N 2.7Å; E498-I501 PolarHBondContact O-N 2.9Å; E498-V502 HydrophobicContact CG-CG2 4.49Å; E498-V502 VanDerWaalsContact O-CG2 3.27Å; E498-V502 WeakPolarHBondContact O-CG2 3.44Å; E498-V502 PolarHBondContact O-N 2.84Å
499	N	89	Confident	88.6	Confident	24 Å²	24	36.8 Å²	36.8	13%	0.128	19%	0.187	C	C	.	.	H	α-helix	trans	-61.5	-38.4	179.2	-82.6	-78.4	0	0	0	112.8	K495 S496 V502 M503 G608 I663	K495-N499 PolarHBondContact O-N 2.9Å; K495-N499 PolarHBondContact O-ND2 2.82Å; S496-N499 PolarHBondContact O-N 3.43Å; N499-V502 PolarHBondContact O-N 3.43Å; N499-M503 WeakPolarHBondContact O-CB 3.33Å; N499-M503 PolarHBondContact O-N 3.39Å; N499-G608 WeakPolarHBondContact O-CA 3.31Å; N499-G608 PolarHBondContact OD1-N 3.21Å; N499-I663 HydrophobicContact CB-CD1 3.75Å
500	Q	88.9	Confident	88.4	Confident	79 Å²	79	32.3 Å²	32.3	37%	0.369	16%	0.163	S	C	.	.	H	α-helix	trans	-65.7	-40.3	177.5	-173.6	-179.7	0.1	0	0	112.1	S496 G497 E498 M503 T504 A666	S496-Q500 PolarHBondContact O-N 3.11Å; G497-Q500 PolarHBondContact O-N 3.46Å; E498-Q500 VanDerWaalsContact C-N 3.33Å; E498-Q500 PolarHBondContact O-N 2.7Å; Q500-M503 PolarHBondContact O-N 3.47Å; Q500-T504 PolarHBondContact O-N 3.37Å; Q500-T504 VanDerWaalsContact O-N 3.07Å; Q500-T504 PolarHBondContact O-OG1 3.48Å; Q500-A666 HydrophobicContact CG-CB 4.18Å
501	I	89.9	Confident	88.3	Confident	54 Å²	54	32.9 Å²	32.9	28%	0.277	17%	0.166	S	C	.	.	H	α-helix	trans	-70.2	-43	176.9	-67.2	169.7	0	0	0	110.4	T487 H492 G497 E498 M503 T504 K505	T487-I501 HydrophobicContact CG2-CB 4.31Å; T487-I501 HydrophobicContact CG2-CG2 3.82Å; H492-I501 WeakPolarHBondContact CE1-CD1 3.4Å; G497-I501 WeakPolarHBondContact O-CG1 3.26Å; G497-I501 PolarHBondContact O-N 3.33Å; E498-I501 PolarHBondContact O-N 2.9Å; I501-M503 VanDerWaalsContact C-N 3.31Å; I501-M503 PolarHBondContact O-N 3.02Å; I501-T504 PolarHBondContact O-N 3.2Å; I501-K505 HydrophobicContact CG2-CD 3.84Å; I501-K505 HydrophobicContact CG2-CG 4.21Å; I501-K505 WeakPolarHBondContact O-CB 3.43Å; I501-K505 WeakPolarHBondContact O-CG 3.22Å; I501-K505 PolarHBondContact O-N 2.94Å
502	V	89.8	Confident	87.9	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.012	18%	0.178	C	C	.	.	H	α-helix	trans	-53.4	-52.1	172.3	169.1	0	0	0	0	109.4	Y484 T487 E498 N499 T504 K505 V506 A609	Y484-V502 HydrophobicContact CD2-CG1 4.21Å; T487-V502 HydrophobicContact CG2-CB 4.46Å; T487-V502 HydrophobicContact CG2-CG2 3.48Å; T487-V502 VanDerWaalsContact CG2-CG2 3.48Å; E498-V502 HydrophobicContact CG-CG2 4.49Å; E498-V502 VanDerWaalsContact O-CG2 3.27Å; E498-V502 WeakPolarHBondContact O-CG2 3.44Å; E498-V502 PolarHBondContact O-N 2.84Å; N499-V502 PolarHBondContact O-N 3.43Å; V502-T504 VanDerWaalsContact C-N 3.33Å; V502-T504 PolarHBondContact O-N 3.01Å; V502-K505 PolarHBondContact O-N 2.98Å; V502-V506 HydrophobicContact CG1-CG2 3.98Å; V502-V506 VanDerWaalsContact O-CB 3.24Å; V502-V506 WeakPolarHBondContact O-CB 3.42Å; V502-V506 WeakPolarHBondContact O-CG2 3.48Å; V502-V506 PolarHBondContact O-N 2.89Å; V502-A609 HydrophobicContact CG1-CB 4.28Å
503	M	90.6	Very high	87.3	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-56.6	-48	-179.2	-171.9	-173.3	64.4	0	0	111.6	N499 Q500 I501 Y507 G608 Y611 A612 I663 A666 A667	N499-M503 WeakPolarHBondContact O-CB 3.33Å; N499-M503 PolarHBondContact O-N 3.39Å; Q500-M503 PolarHBondContact O-N 3.47Å; I501-M503 VanDerWaalsContact C-N 3.31Å; I501-M503 PolarHBondContact O-N 3.02Å; M503-Y507 WeakPolarHBondContact O-CB 3.36Å; M503-Y507 PolarHBondContact O-N 3.41Å; M503-G608 VanDerWaalsContact CA-O 3.31Å; M503-G608 WeakPolarHBondContact CA-O 3.25Å; M503-G608 VanDerWaalsContact CB-O 3.31Å; M503-G608 WeakPolarHBondContact CB-O 3.46Å; M503-G608 WeakPolarHBondContact CG-O 3.24Å; M503-Y611 HydrophobicContact SD-CD2 4.29Å; M503-Y611 HydrophobicContact SD-CG 4.14Å; M503-A612 HydrophobicContact CG-CB 4.24Å; M503-A612 WeakPolarHBondContact O-CB 3.41Å; M503-I663 HydrophobicContact SD-CG1 4.4Å; M503-A666 HydrophobicContact CE-CB 3.24Å; M503-A667 HydrophobicContact SD-CB 4.09Å
504	T	89.3	Confident	86.6	Confident	52 Å²	52	33.4 Å²	33.4	32%	0.319	17%	0.171	S	C	.	.	H	α-helix	trans	-66.8	-45.8	-178	-55.2	0	0	0	0	112.3	Q500 I501 V502 I508	Q500-T504 PolarHBondContact O-N 3.37Å; Q500-T504 VanDerWaalsContact O-N 3.07Å; Q500-T504 PolarHBondContact O-OG1 3.48Å; I501-T504 PolarHBondContact O-N 3.2Å; V502-T504 VanDerWaalsContact C-N 3.33Å; V502-T504 PolarHBondContact O-N 3.01Å; T504-I508 HydrophobicContact CG2-CD1 3.8Å; T504-I508 WeakPolarHBondContact O-CB 3.44Å; T504-I508 VanDerWaalsContact O-CG1 3.27Å; T504-I508 WeakPolarHBondContact O-CG1 3.39Å; T504-I508 PolarHBondContact O-N 2.91Å
505	K	88.8	Confident	86.1	Confident	28 Å²	28	31.5 Å²	31.5	12%	0.122	16%	0.16	C	C	.	.	H	α-helix	trans	-65.3	-50.4	179.1	-72.8	-175.6	176	-171.5	0	111.4	N426 V483 E490 I501 V502 Y507 I508 F509	N426-K505 PolarHBondContact ND2-NZ 2.97Å; N426-K505 PolarHBondContact OD1-NZ 3.4Å; V483-K505 HydrophobicContact CG1-CB 4.12Å; E490-K505 IonicContact OE1-NZ 2.7Å; E490-K505 PolarHBondContact OE1-NZ 2.77Å; E490-K505 IonicContact OE2-NZ 3.21Å; E490-K505 PolarHBondContact OE2-NZ 3.33Å; I501-K505 HydrophobicContact CG2-CD 3.84Å; I501-K505 HydrophobicContact CG2-CG 4.21Å; I501-K505 WeakPolarHBondContact O-CB 3.43Å; I501-K505 WeakPolarHBondContact O-CG 3.22Å; I501-K505 PolarHBondContact O-N 2.94Å; V502-K505 PolarHBondContact O-N 2.98Å; K505-Y507 VanDerWaalsContact C-N 3.31Å; K505-Y507 PolarHBondContact O-N 3.44Å; K505-I508 PolarHBondContact O-N 3.22Å; K505-F509 HydrophobicContact CB-CD2 4.44Å; K505-F509 WeakPolarHBondContact O-CB 3.31Å; K505-F509 WeakPolarHBondContact O-CD2 3.2Å; K505-F509 PolarHBondContact O-N 3.42Å
506	V	87.3	Confident	85.7	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.012	16%	0.159	C	C	.	.	H	α-helix	trans	-59.3	-45.1	179.2	175.4	0	0	0	0	110	V483 V502 L510 A612	V483-V506 HydrophobicContact CB-CG2 4.12Å; V483-V506 HydrophobicContact CG1-CB 4.38Å; V483-V506 HydrophobicContact CG1-CG2 3.57Å; V502-V506 HydrophobicContact CG1-CG2 3.98Å; V502-V506 VanDerWaalsContact O-CB 3.24Å; V502-V506 WeakPolarHBondContact O-CB 3.42Å; V502-V506 WeakPolarHBondContact O-CG2 3.48Å; V502-V506 PolarHBondContact O-N 2.89Å; V506-L510 HydrophobicContact CG1-CD1 3.49Å; V506-L510 VanDerWaalsContact CG1-CD1 3.49Å; V506-L510 HydrophobicContact CG1-CG 4.09Å; V506-L510 VanDerWaalsContact O-CB 3.26Å; V506-L510 WeakPolarHBondContact O-CB 3.45Å; V506-L510 WeakPolarHBondContact O-CG 3.39Å; V506-L510 PolarHBondContact O-N 3.47Å; V506-A612 HydrophobicContact CB-CB 3.77Å; V506-A612 HydrophobicContact CG1-CB 3.62Å
507	Y	89.8	Confident	84.9	Confident	14 Å²	14	31.7 Å²	31.7	6%	0.055	16%	0.163	C	C	.	.	H	α-helix	trans	-60.8	-50	178.1	179.8	-107.5	0	0	0	112.9	M503 K505 F509 L510 I511 L615 T619 Q670	M503-Y507 WeakPolarHBondContact O-CB 3.36Å; M503-Y507 PolarHBondContact O-N 3.41Å; K505-Y507 VanDerWaalsContact C-N 3.31Å; K505-Y507 PolarHBondContact O-N 3.44Å; Y507-F509 PolarHBondContact O-N 3.07Å; Y507-L510 PolarHBondContact O-N 2.88Å; Y507-I511 HydrophobicContact CD1-CD1 4.08Å; Y507-I511 HydrophobicContact CD2-CD1 4.07Å; Y507-I511 HydrophobicContact CE1-CD1 3.47Å; Y507-I511 VanDerWaalsContact CE1-CD1 3.47Å; Y507-I511 HydrophobicContact CE2-CD1 3.44Å; Y507-I511 VanDerWaalsContact CE2-CD1 3.44Å; Y507-I511 HydrophobicContact CE2-CG1 4.22Å; Y507-I511 HydrophobicContact CG-CD1 4.35Å; Y507-I511 WeakPolarHBondContact O-CB 3.19Å; Y507-I511 PolarHBondContact O-N 3.22Å; Y507-I511 VanDerWaalsContact OH-CD1 3.24Å; Y507-I511 WeakPolarHBondContact OH-CD1 3.5Å; Y507-L615 HydrophobicContact CD2-CB 3.97Å; Y507-L615 HydrophobicContact CE2-CB 3.82Å; Y507-T619 PolarHBondContact OH-OG1 3.48Å; Y507-Q670 HydrophobicContact CD1-CB 4.45Å; Y507-Q670 HydrophobicContact CD1-CG 4.02Å; Y507-Q670 HydrophobicContact CE1-CB 4.16Å; Y507-Q670 HydrophobicContact CE1-CG 4.1Å; Y507-Q670 PolarHBondContact OH-O 2.89Å
508	I	88.2	Confident	84.1	Confident	100 Å²	100	32.4 Å²	32.4	51%	0.513	16%	0.164	S	C	.	.	H	α-helix	trans	-62.1	-46.5	-179.5	-69.1	169.2	0	0	0	111	T504 K505 I511 F512	T504-I508 HydrophobicContact CG2-CD1 3.8Å; T504-I508 WeakPolarHBondContact O-CB 3.44Å; T504-I508 VanDerWaalsContact O-CG1 3.27Å; T504-I508 WeakPolarHBondContact O-CG1 3.39Å; T504-I508 PolarHBondContact O-N 2.91Å; K505-I508 PolarHBondContact O-N 3.22Å; I508-I511 PolarHBondContact O-N 3.27Å; I508-F512 WeakPolarHBondContact O-CB 3.45Å; I508-F512 PolarHBondContact O-N 2.9Å
509	F	84.4	Confident	83.2	Confident	36 Å²	36	31.3 Å²	31.3	16%	0.158	16%	0.159	C	C	.	.	H	α-helix	trans	-66.8	-41.2	-179.9	-79.2	-62.3	0	0	0	112.1	L429 L433 V483 K505 Y507 F512 M513	L429-F509 HydrophobicContact CD2-CD2 4.29Å; L429-F509 HydrophobicContact CD2-CE2 3.56Å; L429-F509 HydrophobicContact CD2-CZ 3.92Å; L429-F509 HydrophobicContact CG-CE2 4.41Å; L429-F509 HydrophobicContact CG-CZ 4.38Å; L433-F509 HydrophobicContact CD1-CB 4.35Å; L433-F509 HydrophobicContact CD1-CD1 3.24Å; L433-F509 HydrophobicContact CD1-CD2 4.09Å; L433-F509 HydrophobicContact CD1-CE1 3.34Å; L433-F509 HydrophobicContact CD1-CE2 4.19Å; L433-F509 HydrophobicContact CD1-CG 3.65Å; L433-F509 HydrophobicContact CD1-CZ 3.84Å; V483-F509 HydrophobicContact CG1-CD2 4.09Å; V483-F509 HydrophobicContact CG2-CB 4.37Å; V483-F509 HydrophobicContact CG2-CD2 4.24Å; V483-F509 HydrophobicContact CG2-CG 4.47Å; K505-F509 HydrophobicContact CB-CD2 4.44Å; K505-F509 WeakPolarHBondContact O-CB 3.31Å; K505-F509 WeakPolarHBondContact O-CD2 3.2Å; K505-F509 PolarHBondContact O-N 3.42Å; Y507-F509 PolarHBondContact O-N 3.07Å; F509-F512 PolarHBondContact O-N 3.5Å; F509-M513 WeakPolarHBondContact O-CB 3.48Å; F509-M513 VanDerWaalsContact O-CG 3.29Å; F509-M513 WeakPolarHBondContact O-CG 3.38Å; F509-M513 PolarHBondContact O-N 2.98Å
510	L	83.3	Confident	82.1	Confident	14 Å²	14	32 Å²	32	7%	0.073	16%	0.163	C	C	.	.	H	α-helix	trans	-65.5	-41.7	176.8	-71.3	174.3	0	0	0	112.1	L479 P480 V506 Y507 F512 M513 V514 W613 C616	L479-L510 HydrophobicContact CD2-CD2 4.42Å; P480-L510 HydrophobicContact CG-CD2 4.29Å; V506-L510 HydrophobicContact CG1-CD1 3.49Å; V506-L510 VanDerWaalsContact CG1-CD1 3.49Å; V506-L510 HydrophobicContact CG1-CG 4.09Å; V506-L510 VanDerWaalsContact O-CB 3.26Å; V506-L510 WeakPolarHBondContact O-CB 3.45Å; V506-L510 WeakPolarHBondContact O-CG 3.39Å; V506-L510 PolarHBondContact O-N 3.47Å; Y507-L510 PolarHBondContact O-N 2.88Å; L510-F512 VanDerWaalsContact C-N 3.33Å; L510-F512 PolarHBondContact O-N 3.18Å; L510-M513 PolarHBondContact O-N 2.93Å; L510-V514 WeakPolarHBondContact O-CA 3.36Å; L510-V514 WeakPolarHBondContact O-CB 3.43Å; L510-V514 WeakPolarHBondContact O-CG2 3.28Å; L510-V514 PolarHBondContact O-N 3.41Å; L510-W613 HydrophobicContact CD1-CG 4.5Å; L510-C616 HydrophobicContact CB-CB 4.16Å; L510-C616 HydrophobicContact CD1-CB 4.25Å
511	I	85.6	Confident	80.5	Confident	12 Å²	12	31.1 Å²	31.1	6%	0.062	18%	0.175	C	C	.	.	I	π-helix	trans	-61.3	-45	174	-78.3	-179.4	0	0	0	110.9	Y507 I508 M513 L515 I516 T619 L677	Y507-I511 HydrophobicContact CD1-CD1 4.08Å; Y507-I511 HydrophobicContact CD2-CD1 4.07Å; Y507-I511 HydrophobicContact CE1-CD1 3.47Å; Y507-I511 VanDerWaalsContact CE1-CD1 3.47Å; Y507-I511 HydrophobicContact CE2-CD1 3.44Å; Y507-I511 VanDerWaalsContact CE2-CD1 3.44Å; Y507-I511 HydrophobicContact CE2-CG1 4.22Å; Y507-I511 HydrophobicContact CG-CD1 4.35Å; Y507-I511 WeakPolarHBondContact O-CB 3.19Å; Y507-I511 PolarHBondContact O-N 3.22Å; Y507-I511 VanDerWaalsContact OH-CD1 3.24Å; Y507-I511 WeakPolarHBondContact OH-CD1 3.5Å; I508-I511 PolarHBondContact O-N 3.27Å; I511-M513 VanDerWaalsContact C-N 3.31Å; I511-M513 PolarHBondContact O-N 2.91Å; I511-L515 HydrophobicContact CG2-CB 4.47Å; I511-L515 HydrophobicContact CG2-CD2 4.37Å; I511-L515 WeakPolarHBondContact O-CA 3.48Å; I511-L515 VanDerWaalsContact O-CB 3.25Å; I511-L515 WeakPolarHBondContact O-CB 3.36Å; I511-L515 PolarHBondContact O-N 2.84Å; I511-I516 HydrophobicContact CG2-CD1 3.91Å; I511-I516 HydrophobicContact CG2-CG1 4.06Å; I511-I516 PolarHBondContact O-N 2.98Å; I511-T619 HydrophobicContact CD1-CG2 3.78Å; I511-T619 HydrophobicContact CG1-CG2 4.39Å; I511-L677 HydrophobicContact CD1-CD1 3.94Å; I511-L677 HydrophobicContact CG2-CD1 4.45Å
512	F	80.2	Confident	78.6	Confident	84 Å²	84	31.9 Å²	31.9	37%	0.368	18%	0.179	S	C	.	.	I	π-helix	trans	-60.4	-43.2	179.4	-176.3	-108.7	0	0	0	111.6	I508 F509 L510 I516 L517	I508-F512 WeakPolarHBondContact O-CB 3.45Å; I508-F512 PolarHBondContact O-N 2.9Å; F509-F512 PolarHBondContact O-N 3.5Å; L510-F512 VanDerWaalsContact C-N 3.33Å; L510-F512 PolarHBondContact O-N 3.18Å; F512-I516 HydrophobicContact CD2-CB 4.26Å; F512-I516 HydrophobicContact CD2-CD1 4.27Å; F512-I516 HydrophobicContact CD2-CG2 4.29Å; F512-I516 HydrophobicContact CE2-CG2 4.47Å; F512-I516 PolarHBondContact O-N 3.19Å; F512-L517 HydrophobicContact CD1-CD1 4.29Å; F512-L517 HydrophobicContact CD1-CG 4.41Å; F512-L517 HydrophobicContact CE1-CD1 3.83Å; F512-L517 HydrophobicContact CE1-CD2 4.22Å; F512-L517 HydrophobicContact CE1-CG 4Å; F512-L517 HydrophobicContact CE2-CD2 4.26Å; F512-L517 HydrophobicContact CE2-CG 4.4Å; F512-L517 HydrophobicContact CZ-CD1 4.26Å; F512-L517 HydrophobicContact CZ-CD2 3.79Å; F512-L517 HydrophobicContact CZ-CG 4Å; F512-L517 WeakPolarHBondContact O-CG 3.08Å; F512-L517 PolarHBondContact O-N 3.37Å
513	M	76.3	Confident	76.8	Confident	26 Å²	26	34 Å²	34	13%	0.128	19%	0.192	C	C	.	.	I	π-helix	trans	-82.1	-40.7	-176.3	-63.6	-37	-178	0	0	115.2	L433 T437 L479 F509 L510 I511 L517 P518	L433-M513 HydrophobicContact CB-CE 3.83Å; T437-M513 HydrophobicContact CG2-CE 3.29Å; T437-M513 HydrophobicContact CG2-CG 4.22Å; T437-M513 HydrophobicContact CG2-SD 3.08Å; T437-M513 WeakPolarHBondContact CG2-SD 3.49Å; L479-M513 HydrophobicContact CD2-CB 4.07Å; L479-M513 HydrophobicContact CD2-CG 3.82Å; F509-M513 WeakPolarHBondContact O-CB 3.48Å; F509-M513 VanDerWaalsContact O-CG 3.29Å; F509-M513 WeakPolarHBondContact O-CG 3.38Å; F509-M513 PolarHBondContact O-N 2.98Å; L510-M513 PolarHBondContact O-N 2.93Å; I511-M513 VanDerWaalsContact C-N 3.31Å; I511-M513 PolarHBondContact O-N 2.91Å; M513-L517 HydrophobicContact SD-CD1 3.45Å; M513-L517 WeakPolarHBondContact SD-CD1 3.49Å; M513-L517 HydrophobicContact SD-CG 4.46Å; M513-P518 WeakPolarHBondContact O-CD 3.43Å; M513-P518 WeakPolarHBondContact O-CG 3.2Å
514	V	76.9	Confident	74.9	Confident	22 Å²	22	34.6 Å²	34.6	13%	0.133	20%	0.196	C	C	.	.	I	π-helix	trans	-85.8	-41.5	-175.3	176.7	0	0	0	0	110.4	L510 P518 F556 Y559 V620	L510-V514 WeakPolarHBondContact O-CA 3.36Å; L510-V514 WeakPolarHBondContact O-CB 3.43Å; L510-V514 WeakPolarHBondContact O-CG2 3.28Å; L510-V514 PolarHBondContact O-N 3.41Å; V514-P518 WeakPolarHBondContact O-CG 3.32Å; V514-F556 WeakPolarHBondContact O-CE1 3.34Å; V514-F556 WeakPolarHBondContact O-CZ 3.19Å; V514-Y559 HydrophobicContact CG1-CD1 4.19Å; V514-Y559 HydrophobicContact CG1-CD2 4.47Å; V514-Y559 HydrophobicContact CG1-CE1 3.65Å; V514-Y559 HydrophobicContact CG1-CE2 3.96Å; V514-V620 HydrophobicContact CG1-CG2 4.16Å
515	L	78.6	Confident	73	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.005	18%	0.183	C	C	.	.	I	π-helix	trans	-98	-64.7	-174.5	-173.6	67.6	0	0	0	111.3	I511 P518 S519 F556 T619 V620 A623 Y624 W681	I511-L515 HydrophobicContact CG2-CB 4.47Å; I511-L515 HydrophobicContact CG2-CD2 4.37Å; I511-L515 WeakPolarHBondContact O-CA 3.48Å; I511-L515 VanDerWaalsContact O-CB 3.25Å; I511-L515 WeakPolarHBondContact O-CB 3.36Å; I511-L515 PolarHBondContact O-N 2.84Å; L515-P518 WeakPolarHBondContact O-CD 3.29Å; L515-S519 WeakPolarHBondContact O-CB 3.28Å; L515-S519 PolarHBondContact O-N 3.23Å; L515-S519 PolarHBondContact O-OG 2.93Å; L515-F556 HydrophobicContact CD1-CE1 4.15Å; L515-F556 HydrophobicContact CD1-CZ 4.26Å; L515-T619 HydrophobicContact CD2-CG2 4.27Å; L515-V620 HydrophobicContact CD1-CG2 4.33Å; L515-A623 HydrophobicContact CD1-CB 4.25Å; L515-A623 HydrophobicContact CD2-CB 4.24Å; L515-Y624 HydrophobicContact CD1-CD2 4.03Å; L515-Y624 HydrophobicContact CD1-CE2 3.5Å; L515-Y624 VanDerWaalsContact CD1-CE2 3.5Å; L515-W681 HydrophobicContact CG-CZ2 4.4Å
516	I	78.2	Confident	71.1	Confident	48 Å²	48	33.6 Å²	33.6	25%	0.246	19%	0.19	C	C	.	.	I	π-helix	trans	-66	-51.2	-165.5	-59.8	176.2	0	0	0	112.6	I511 F512 L520 W681	I511-I516 HydrophobicContact CG2-CD1 3.91Å; I511-I516 HydrophobicContact CG2-CG1 4.06Å; I511-I516 PolarHBondContact O-N 2.98Å; F512-I516 HydrophobicContact CD2-CB 4.26Å; F512-I516 HydrophobicContact CD2-CD1 4.27Å; F512-I516 HydrophobicContact CD2-CG2 4.29Å; F512-I516 HydrophobicContact CE2-CG2 4.47Å; F512-I516 PolarHBondContact O-N 3.19Å; I516-L520 HydrophobicContact CG2-CD1 3.72Å; I516-L520 HydrophobicContact CG2-CG 4.43Å; I516-L520 WeakPolarHBondContact O-CB 3.14Å; I516-L520 VanDerWaalsContact O-CG 3.28Å; I516-L520 WeakPolarHBondContact O-CG 3.31Å; I516-L520 PolarHBondContact O-N 3.11Å; I516-L520 VanDerWaalsContact O-N 3.11Å; I516-W681 HydrophobicContact CG1-CZ2 4.21Å
517	L	71.6	Confident	69.4	Low	23 Å²	23	39.2 Å²	39.2	12%	0.12	21%	0.214	C	C	.	.	H	α-helix	trans	-62.7	-50.4	-177	-72.8	-179.1	0	0	0	112.9	T437 F512 M513 L520 G521 L522	T437-L517 HydrophobicContact CG2-CD1 3.64Å; F512-L517 HydrophobicContact CD1-CD1 4.29Å; F512-L517 HydrophobicContact CD1-CG 4.41Å; F512-L517 HydrophobicContact CE1-CD1 3.83Å; F512-L517 HydrophobicContact CE1-CD2 4.22Å; F512-L517 HydrophobicContact CE1-CG 4Å; F512-L517 HydrophobicContact CE2-CD2 4.26Å; F512-L517 HydrophobicContact CE2-CG 4.4Å; F512-L517 HydrophobicContact CZ-CD1 4.26Å; F512-L517 HydrophobicContact CZ-CD2 3.79Å; F512-L517 HydrophobicContact CZ-CG 4Å; F512-L517 WeakPolarHBondContact O-CG 3.08Å; F512-L517 PolarHBondContact O-N 3.37Å; M513-L517 HydrophobicContact SD-CD1 3.45Å; M513-L517 WeakPolarHBondContact SD-CD1 3.49Å; M513-L517 HydrophobicContact SD-CG 4.46Å; L517-L520 PolarHBondContact O-N 2.93Å; L517-G521 PolarHBondContact O-N 2.94Å; L517-L522 PolarHBondContact O-N 2.91Å
518	P	69.9	Low	67.5	Low	35 Å²	35	41.9 Å²	41.9	23%	0.227	23%	0.227	C	C	.	.	H	α-helix	trans	-65.2	-40.1	178.3	-24.1	37.6	0	0	0	112.9	M513 V514 L515 L520 G521 F555 F556	M513-P518 WeakPolarHBondContact O-CD 3.43Å; M513-P518 WeakPolarHBondContact O-CG 3.2Å; V514-P518 WeakPolarHBondContact O-CG 3.32Å; L515-P518 WeakPolarHBondContact O-CD 3.29Å; P518-L520 VanDerWaalsContact C-N 3.3Å; P518-L520 PolarHBondContact O-N 2.93Å; P518-G521 PolarHBondContact O-N 3.25Å; P518-F555 HydrophobicContact CB-CE1 4.26Å; P518-F556 HydrophobicContact CB-CZ 4.21Å
519	S	70.6	Confident	65.9	Low	2 Å²	2	40.2 Å²	40.2	1%	0.014	22%	0.216	C	C	.	.	H	α-helix	trans	-62.4	-35.5	179	-62.4	0	0	0	0	112.9	L515 G521 V547 Y624	L515-S519 WeakPolarHBondContact O-CB 3.28Å; L515-S519 PolarHBondContact O-N 3.23Å; L515-S519 PolarHBondContact O-OG 2.93Å; S519-G521 VanDerWaalsContact C-N 3.28Å; S519-V547 VanDerWaalsContact O-CG1 3.31Å; S519-V547 WeakPolarHBondContact O-CG1 3.5Å; S519-Y624 WeakPolarHBondContact CB-OH 3.37Å; S519-Y624 PolarHBondContact OG-OH 3.46Å
520	L	66.4	Low	64.7	Low	39 Å²	39	45.5 Å²	45.5	20%	0.204	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-9.6	177.4	-65.7	175.5	0	0	0	113.2	I516 L517 P518 L522 V547 W681 F684	I516-L520 HydrophobicContact CG2-CD1 3.72Å; I516-L520 HydrophobicContact CG2-CG 4.43Å; I516-L520 WeakPolarHBondContact O-CB 3.14Å; I516-L520 VanDerWaalsContact O-CG 3.28Å; I516-L520 WeakPolarHBondContact O-CG 3.31Å; I516-L520 PolarHBondContact O-N 3.11Å; I516-L520 VanDerWaalsContact O-N 3.11Å; L517-L520 PolarHBondContact O-N 2.93Å; P518-L520 VanDerWaalsContact C-N 3.3Å; P518-L520 PolarHBondContact O-N 2.93Å; L520-L522 HydrophobicContact CB-CB 4.15Å; L520-L522 HydrophobicContact CB-CD1 3.84Å; L520-L522 HydrophobicContact CB-CG 3.82Å; L520-L522 HydrophobicContact CD1-CD1 4Å; L520-L522 HydrophobicContact CG-CD1 4.5Å; L520-L522 PolarHBondContact O-N 2.92Å; L520-L522 VanDerWaalsContact O-N 3.07Å; L520-V547 HydrophobicContact CD2-CG1 4.27Å; L520-W681 HydrophobicContact CD2-CH2 4.06Å; L520-W681 HydrophobicContact CD2-CZ3 4Å; L520-W681 HydrophobicContact CG-CH2 4.12Å; L520-F684 HydrophobicContact CD2-CE1 4.15Å; L520-F684 HydrophobicContact CD2-CZ 4.06Å
521	G	54.4	Low	63.5	Low	60 Å²	60	53.6 Å²	53.6	62%	0.619	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	14.1	-171.7	0	0	0	0	0	113.3	L517 P518 S519	L517-G521 PolarHBondContact O-N 2.94Å; P518-G521 PolarHBondContact O-N 3.25Å; S519-G521 VanDerWaalsContact C-N 3.28Å
522	L	49.8	Very low	62	Low	69 Å²	69	57.1 Å²	57.1	36%	0.361	28%	0.283	S	S	.	.			trans	-90.4	120.2	-176.7	-69.4	175.4	0	0	0	109	L517 L520	L517-L522 PolarHBondContact O-N 2.91Å; L520-L522 HydrophobicContact CB-CB 4.15Å; L520-L522 HydrophobicContact CB-CD1 3.84Å; L520-L522 HydrophobicContact CB-CG 3.82Å; L520-L522 HydrophobicContact CD1-CD1 4Å; L520-L522 HydrophobicContact CG-CD1 4.5Å; L520-L522 PolarHBondContact O-N 2.92Å; L520-L522 VanDerWaalsContact O-N 3.07Å
523	T	52.4	Low	60.9	Low	46 Å²	46	60 Å²	60	28%	0.282	30%	0.296	S	S	.	.			trans	-89.8	122	161	62.2	0	0	0	0	107.9	I441 L525 D526 F527	I441-T523 HydrophobicContact CD1-CG2 4.18Å; I441-T523 WeakPolarHBondContact CD1-OG1 3.38Å; I441-T523 HydrophobicContact CG1-CG2 4Å; T523-L525 PolarHBondContact O-N 3.17Å; T523-L525 VanDerWaalsContact O-N 3.08Å; T523-D526 PolarHBondContact O-N 3.25Å; T523-D526 WeakPolarHBondContact OG1-CB 3.12Å; T523-F527 PolarHBondContact O-N 3.28Å
524	S	51.9	Low	60	Low	14 Å²	14	62.3 Å²	62.3	10%	0.098	31%	0.308	C	S	.	.	H	α-helix	trans	-51.2	-34	-175.4	51.6	0	0	0	0	113.5	F434 T437 T438 F528	F434-S524 PolarHBondContact O-OG 3.44Å; T437-S524 PolarHBondContact OG1-OG 3.38Å; T438-S524 PolarHBondContact OG1-OG 3.28Å; S524-F528 WeakPolarHBondContact O-CB 3.49Å; S524-F528 PolarHBondContact O-N 3.32Å; S524-F528 VanDerWaalsContact O-N 3.09Å
525	L	47.8	Very low	58.7	Low	6 Å²	6	71.6 Å²	71.6	3%	0.031	35%	0.347	C	S	.	.	H	α-helix	trans	-85.5	-29.5	-176.1	-125.2	166.2	0	0	0	113.8	F435 T438 I442 T523 F528 F529	F435-L525 HydrophobicContact CD1-CD1 4.05Å; T438-L525 HydrophobicContact CG2-CB 3.52Å; T438-L525 HydrophobicContact CG2-CD1 4.24Å; I442-L525 HydrophobicContact CG1-CD1 4.21Å; T523-L525 PolarHBondContact O-N 3.17Å; T523-L525 VanDerWaalsContact O-N 3.08Å; L525-F528 HydrophobicContact CD2-CD1 4.36Å; L525-F528 PolarHBondContact O-N 2.95Å; L525-F529 HydrophobicContact CD2-CD1 4.34Å; L525-F529 HydrophobicContact CD2-CD2 3.24Å; L525-F529 HydrophobicContact CD2-CE1 4.16Å; L525-F529 HydrophobicContact CD2-CE2 3.03Å; L525-F529 HydrophobicContact CD2-CG 3.94Å; L525-F529 HydrophobicContact CD2-CZ 3.53Å; L525-F529 HydrophobicContact CG-CE2 4.43Å; L525-F529 VanDerWaalsContact O-CB 3.3Å; L525-F529 WeakPolarHBondContact O-CB 3.26Å; L525-F529 WeakPolarHBondContact O-CD2 3.47Å; L525-F529 WeakPolarHBondContact O-CG 3.21Å; L525-F529 PolarHBondContact O-N 2.91Å
526	D	50.4	Low	57.1	Low	52 Å²	52	77 Å²	77	28%	0.278	38%	0.38	S	S	.	.	H	α-helix	trans	-67.1	-40.8	170.9	-175.7	42.7	0	0	0	110.4	I441 T523 R530	I441-D526 HydrophobicContact CD1-CB 4.33Å; T523-D526 PolarHBondContact O-N 3.25Å; T523-D526 WeakPolarHBondContact OG1-CB 3.12Å; D526-R530 VanDerWaalsContact O-CB 3.26Å; D526-R530 WeakPolarHBondContact O-CB 3.26Å; D526-R530 WeakPolarHBondContact O-CD 3.37Å; D526-R530 WeakPolarHBondContact O-CG 3.16Å; D526-R530 PolarHBondContact O-N 3.29Å; D526-R530 IonicContact OD1-CZ 3.33Å; D526-R530 IonicContact OD1-NE 3.15Å; D526-R530 PolarHBondContact OD1-NE 3.08Å; D526-R530 IonicContact OD1-NH2 3.1Å; D526-R530 PolarHBondContact OD1-NH2 2.72Å; D526-R530 IonicContact OD2-CZ 3.15Å; D526-R530 IonicContact OD2-NE 2.85Å; D526-R530 PolarHBondContact OD2-NE 3.31Å; D526-R530 IonicContact OD2-NH1 2.85Å; D526-R530 IonicContact OD2-NH2 3.86Å; D526-R530 PolarHBondContact OD2-NH2 2.63Å
527	F	51.4	Low	55.4	Low	120 Å²	120	78.4 Å²	78.4	53%	0.526	39%	0.394	S	S	.	.	H	α-helix	trans	-62.9	-47.1	171.7	-177.5	-96.3	0	0	0	112.1	T523 W531 I542	T523-F527 PolarHBondContact O-N 3.28Å; F527-W531 WeakPolarHBondContact O-CB 3.3Å; F527-W531 PolarHBondContact O-N 3.36Å; F527-I542 HydrophobicContact CE2-CD1 4.48Å
528	F	48.8	Very low	53.7	Low	71 Å²	71	82.7 Å²	82.7	31%	0.311	43%	0.426	S	S	.	.	H	α-helix	trans	-63.2	-43.9	177.5	175.4	-100.7	0	0	0	112.8	F434 S524 L525 W531 L532	F434-F528 HydrophobicContact CZ-CB 4.08Å; F434-F528 HydrophobicContact CZ-CG 4.45Å; S524-F528 WeakPolarHBondContact O-CB 3.49Å; S524-F528 PolarHBondContact O-N 3.32Å; S524-F528 VanDerWaalsContact O-N 3.09Å; L525-F528 HydrophobicContact CD2-CD1 4.36Å; L525-F528 PolarHBondContact O-N 2.95Å; F528-W531 HydrophobicContact CD2-CE3 4.19Å; F528-W531 HydrophobicContact CD2-CZ3 4.48Å; F528-W531 HydrophobicContact CE2-CE3 4.3Å; F528-W531 HydrophobicContact CE2-CZ3 4.18Å; F528-W531 PolarHBondContact O-N 3.41Å; F528-L532 HydrophobicContact CE1-CD1 4.42Å; F528-L532 HydrophobicContact CE1-CD2 4.46Å; F528-L532 HydrophobicContact CE2-CD1 4Å; F528-L532 HydrophobicContact CZ-CD1 3.74Å; F528-L532 HydrophobicContact CZ-CD2 4.48Å; F528-L532 VanDerWaalsContact O-CB 3.22Å; F528-L532 WeakPolarHBondContact O-CB 3.06Å; F528-L532 PolarHBondContact O-N 3.02Å
529	F	55.9	Low	52.2	Low	64 Å²	64	90.6 Å²	90.6	28%	0.281	46%	0.457	S	S	.	.	H	α-helix	trans	-69.2	-39	178.7	-81.9	-43.9	0	0	0	112.5	T445 L525 W531 L532 F533	T445-F529 HydrophobicContact CG2-CE2 4.37Å; L525-F529 HydrophobicContact CD2-CD1 4.34Å; L525-F529 HydrophobicContact CD2-CD2 3.24Å; L525-F529 HydrophobicContact CD2-CE1 4.16Å; L525-F529 HydrophobicContact CD2-CE2 3.03Å; L525-F529 HydrophobicContact CD2-CG 3.94Å; L525-F529 HydrophobicContact CD2-CZ 3.53Å; L525-F529 HydrophobicContact CG-CE2 4.43Å; L525-F529 VanDerWaalsContact O-CB 3.3Å; L525-F529 WeakPolarHBondContact O-CB 3.26Å; L525-F529 WeakPolarHBondContact O-CD2 3.47Å; L525-F529 WeakPolarHBondContact O-CG 3.21Å; L525-F529 PolarHBondContact O-N 2.91Å; F529-W531 VanDerWaalsContact C-N 3.33Å; F529-L532 PolarHBondContact O-N 3.4Å; F529-F533 HydrophobicContact CB-CD2 4.46Å; F529-F533 AromaticContact CD1-CD2 3.61Å; F529-F533 HydrophobicContact CD1-CD2 3.61Å; F529-F533 AromaticContact CD1-CE2 3.45Å; F529-F533 HydrophobicContact CD1-CE2 3.45Å; F529-F533 VanDerWaalsContact CD1-CE2 3.45Å; F529-F533 HydrophobicContact CE1-CD2 4.32Å; F529-F533 AromaticContact CE1-CE2 3.71Å; F529-F533 HydrophobicContact CE1-CE2 3.71Å; F529-F533 HydrophobicContact CG-CD2 4.46Å; F529-F533 WeakPolarHBondContact O-CB 3.3Å; F529-F533 PolarHBondContact O-N 3.17Å
530	R	59.1	Low	50.9	Low	148 Å²	148	93.7 Å²	93.7	56%	0.558	48%	0.482	S	S	*	.	H	α-helix	trans	-63	-41.5	171.6	-71.2	173.6	-169.9	-157.3	7.5	111.2	D526 D534	D526-R530 VanDerWaalsContact O-CB 3.26Å; D526-R530 WeakPolarHBondContact O-CB 3.26Å; D526-R530 WeakPolarHBondContact O-CD 3.37Å; D526-R530 WeakPolarHBondContact O-CG 3.16Å; D526-R530 PolarHBondContact O-N 3.29Å; D526-R530 IonicContact OD1-CZ 3.33Å; D526-R530 IonicContact OD1-NE 3.15Å; D526-R530 PolarHBondContact OD1-NE 3.08Å; D526-R530 IonicContact OD1-NH2 3.1Å; D526-R530 PolarHBondContact OD1-NH2 2.72Å; D526-R530 IonicContact OD2-CZ 3.15Å; D526-R530 IonicContact OD2-NE 2.85Å; D526-R530 PolarHBondContact OD2-NE 3.31Å; D526-R530 IonicContact OD2-NH1 2.85Å; D526-R530 IonicContact OD2-NH2 3.86Å; D526-R530 PolarHBondContact OD2-NH2 2.63Å; R530-D534 WeakPolarHBondContact O-CA 3.1Å; R530-D534 WeakPolarHBondContact O-CB 3.43Å; R530-D534 PolarHBondContact O-N 2.81Å
531	W	57.5	Low	49.8	Very low	184 Å²	184	93.9 Å²	93.9	70%	0.697	49%	0.487	S	S	*	.	H	α-helix	trans	-65.8	-41.7	176.1	176.2	81	0	0	0	113.1	F527 F528 F529	F527-W531 WeakPolarHBondContact O-CB 3.3Å; F527-W531 PolarHBondContact O-N 3.36Å; F528-W531 HydrophobicContact CD2-CE3 4.19Å; F528-W531 HydrophobicContact CD2-CZ3 4.48Å; F528-W531 HydrophobicContact CE2-CE3 4.3Å; F528-W531 HydrophobicContact CE2-CZ3 4.18Å; F528-W531 PolarHBondContact O-N 3.41Å; F529-W531 VanDerWaalsContact C-N 3.33Å
532	L	54.5	Low	49.5	Very low	86 Å²	86	95.2 Å²	95.2	45%	0.45	48%	0.479	S	S	.	.	H	α-helix	trans	-80.7	-35.8	-174.5	-161.2	101.7	0	0	0	113	F528 F529	F528-L532 HydrophobicContact CE1-CD1 4.42Å; F528-L532 HydrophobicContact CE1-CD2 4.46Å; F528-L532 HydrophobicContact CE2-CD1 4Å; F528-L532 HydrophobicContact CZ-CD1 3.74Å; F528-L532 HydrophobicContact CZ-CD2 4.48Å; F528-L532 VanDerWaalsContact O-CB 3.22Å; F528-L532 WeakPolarHBondContact O-CB 3.06Å; F528-L532 PolarHBondContact O-N 3.02Å; F529-L532 PolarHBondContact O-N 3.4Å
533	F	57.5	Low	49.6	Very low	145 Å²	145	99.5 Å²	99.5	64%	0.636	49%	0.49	S	S	*	.	H	α-helix	trans	-110.7	-19	-171.4	-68.5	-74.7	0	0	0	114.9	F529 K535	F529-F533 HydrophobicContact CB-CD2 4.46Å; F529-F533 AromaticContact CD1-CD2 3.61Å; F529-F533 HydrophobicContact CD1-CD2 3.61Å; F529-F533 AromaticContact CD1-CE2 3.45Å; F529-F533 HydrophobicContact CD1-CE2 3.45Å; F529-F533 VanDerWaalsContact CD1-CE2 3.45Å; F529-F533 HydrophobicContact CE1-CD2 4.32Å; F529-F533 AromaticContact CE1-CE2 3.71Å; F529-F533 HydrophobicContact CE1-CE2 3.71Å; F529-F533 HydrophobicContact CG-CD2 4.46Å; F529-F533 WeakPolarHBondContact O-CB 3.3Å; F529-F533 PolarHBondContact O-N 3.17Å; F533-K535 PolarHBondContact O-N 3.31Å
534	D	56.8	Low	49.6	Very low	73 Å²	73	98.7 Å²	98.7	39%	0.39	48%	0.484	S	S	.	.			trans	-93.5	80	-178.9	-153.3	-13.3	0	0	0	111.6	R530 T536 S537	R530-D534 WeakPolarHBondContact O-CA 3.1Å; R530-D534 WeakPolarHBondContact O-CB 3.43Å; R530-D534 PolarHBondContact O-N 2.81Å; D534-T536 PolarHBondContact O-N 3.46Å; D534-T536 PolarHBondContact OD1-N 2.99Å; D534-T536 PolarHBondContact OD1-OG1 3.25Å; D534-S537 PolarHBondContact O-N 3.27Å
535	K	49.2	Very low	49.3	Very low	218 Å²	218	102.5 Å²	102.5	95%	0.948	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-2.8	176.3	-116.5	179.8	-178.1	177.1	0	113.9	F533	F533-K535 PolarHBondContact O-N 3.31Å
536	T	45.4	Very low	49.4	Very low	115 Å²	115	104.3 Å²	104.3	71%	0.706	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	2.9	-178.1	9.7	0	0	0	0	114.4	D534 S538	D534-T536 PolarHBondContact O-N 3.46Å; D534-T536 PolarHBondContact OD1-N 2.99Å; D534-T536 PolarHBondContact OD1-OG1 3.25Å; T536-S538 PolarHBondContact O-N 3.15Å
537	S	41.8	Very low	49.4	Very low	77 Å²	77	102.8 Å²	102.8	54%	0.538	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	56.7	-173.6	-161.7	0	0	0	0	115.1	D534	D534-S537 PolarHBondContact O-N 3.27Å
538	S	35.3	Very low	49.4	Very low	112 Å²	112	98.4 Å²	98.4	78%	0.783	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-9	163.9	60	0	0	0	0	113.4	T536	T536-S538 PolarHBondContact O-N 3.15Å
539	K	40.4	Very low	49.7	Very low	202 Å²	202	96.7 Å²	96.7	88%	0.878	48%	0.48	S	S	*	.	S	Bend	trans	-144.8	34	-178.2	-73.6	-173.9	177.5	176.7	0	114.6
540	A	41.8	Very low	49.4	Very low	67 Å²	67	94.2 Å²	94.2	55%	0.554	47%	0.47	S	S	*	.			trans	-109.3	96.4	168.4	0	0	0	0	0	108.8	I542	A540-I542 PolarHBondContact O-N 3.39Å
541	S	44.2	Very low	49.2	Very low	42 Å²	42	91.2 Å²	91.2	29%	0.294	47%	0.466	S	S	.	.			trans	-63.2	124.8	176.1	57.1	0	0	0	0	110.7	Q20 G22 R543	Q20-S541 WeakPolarHBondContact O-CA 3.5Å; Q20-S541 VanDerWaalsContact O-CB 3.26Å; Q20-S541 WeakPolarHBondContact O-CB 3.41Å; G22-S541 WeakPolarHBondContact CA-OG 3.37Å; G22-S541 VanDerWaalsContact N-CB 3.33Å; S541-R543 VanDerWaalsContact C-N 3.35Å; S541-R543 PolarHBondContact O-N 3Å
542	I	48.1	Very low	49.5	Very low	89 Å²	89	85.3 Å²	85.3	46%	0.456	45%	0.446	S	S	.	.			trans	-67.5	95	170.2	-58.3	169.7	0	0	0	106.6	L21 F527 A540 L544	L21-I542 CarbonylContact C-O 3.54Å; L21-I542 CarbonylContact O-C 3.17Å; F527-I542 HydrophobicContact CE2-CD1 4.48Å; A540-I542 PolarHBondContact O-N 3.39Å; I542-L544 VanDerWaalsContact C-N 3.32Å; I542-L544 HydrophobicContact CG2-CD2 3.86Å; I542-L544 HydrophobicContact CG2-CG 4.13Å; I542-L544 PolarHBondContact O-N 3.37Å
543	R	50.9	Low	50.5	Low	159 Å²	159	81.4 Å²	81.4	60%	0.6	43%	0.427	S	S	*	.			trans	-70.1	86.2	-177.7	-68.7	-174.9	-163.9	-172.8	3.5	110.6	L21 S541 E545	L21-R543 WeakPolarHBondContact O-CA 3.45Å; S541-R543 VanDerWaalsContact C-N 3.35Å; S541-R543 PolarHBondContact O-N 3Å; R543-E545 PolarHBondContact O-N 2.93Å
544	L	52.3	Low	51.4	Low	29 Å²	29	74.6 Å²	74.6	15%	0.152	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-72.9	-1.6	176.1	-64.6	176.2	0	0	0	113.2	L21 I542 C546 V547 L688	L21-L544 HydrophobicContact CD1-CD1 4.2Å; L21-L544 HydrophobicContact CD2-CD1 3.64Å; L21-L544 HydrophobicContact CD2-CG 4.29Å; L21-L544 HydrophobicContact CG-CD1 4.37Å; I542-L544 VanDerWaalsContact C-N 3.32Å; I542-L544 HydrophobicContact CG2-CD2 3.86Å; I542-L544 HydrophobicContact CG2-CG 4.13Å; I542-L544 PolarHBondContact O-N 3.37Å; L544-C546 PolarHBondContact O-N 2.84Å; L544-V547 HydrophobicContact CB-CG2 4.17Å; L544-V547 HydrophobicContact CD2-CG2 3.87Å; L544-V547 WeakPolarHBondContact O-CB 3.46Å; L544-V547 VanDerWaalsContact O-CG2 3.32Å; L544-V547 WeakPolarHBondContact O-CG2 3.47Å; L544-V547 PolarHBondContact O-N 3.22Å; L544-V547 VanDerWaalsContact O-N 3.08Å; L544-L688 HydrophobicContact CB-CD2 3.79Å; L544-L688 HydrophobicContact CD1-CD2 4.47Å
545	E	46.6	Very low	52.4	Low	93 Å²	93	75.1 Å²	75.1	44%	0.435	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-61	-22.1	-178.2	-141.3	157.9	-136	0	0	113.3	L23 R543	L23-E545 HydrophobicContact CD2-CB 3.62Å; L23-E545 HydrophobicContact CD2-CG 3.43Å; L23-E545 VanDerWaalsContact CD2-CG 3.43Å; L23-E545 WeakPolarHBondContact CD2-OE1 3.24Å; R543-E545 PolarHBondContact O-N 2.93Å
546	C	49.2	Very low	54	Low	44 Å²	44	64.7 Å²	64.7	30%	0.297	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-102.4	12.4	176.8	-43.5	0	0	0	0	114.2	C32 L544 L549	C32-C546 VanDerWaalsContact CA-SG 3.58Å; C32-C546 HydrophobicContact CB-CB 3.86Å; C32-C546 WeakPolarHBondContact CB-SG 3.42Å; C32-C546 VanDerWaalsContact SG-CA 3.55Å; C32-C546 WeakPolarHBondContact SG-CB 3.37Å; C32-C546 CovalentContact SG-SG 2.05Å; C32-C546 PolarHBondContact SG-SG 3.25Å; L544-C546 PolarHBondContact O-N 2.84Å; C546-L549 HydrophobicContact CB-CD1 4.38Å; C546-L549 WeakPolarHBondContact O-CD1 3.44Å
547	V	50.3	Low	56	Low	20 Å²	20	59.2 Å²	59.2	12%	0.121	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	128.5	176.9	-177.3	0	0	0	0	108.4	S519 L520 L544 F684 L688	S519-V547 VanDerWaalsContact O-CG1 3.31Å; S519-V547 WeakPolarHBondContact O-CG1 3.5Å; L520-V547 HydrophobicContact CD2-CG1 4.27Å; L544-V547 HydrophobicContact CB-CG2 4.17Å; L544-V547 HydrophobicContact CD2-CG2 3.87Å; L544-V547 WeakPolarHBondContact O-CB 3.46Å; L544-V547 VanDerWaalsContact O-CG2 3.32Å; L544-V547 WeakPolarHBondContact O-CG2 3.47Å; L544-V547 PolarHBondContact O-N 3.22Å; L544-V547 VanDerWaalsContact O-N 3.08Å; V547-F684 HydrophobicContact CB-CE1 4.44Å; V547-F684 HydrophobicContact CG1-CE1 3.75Å; V547-F684 HydrophobicContact CG1-CZ 4.31Å; V547-L688 HydrophobicContact CB-CD1 4.06Å
548	F	52	Low	57.9	Low	29 Å²	29	56.3 Å²	56.3	13%	0.127	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	45.4	-165.9	-63.9	-87.5	0	0	0	116.6	Y624 W681 F684 F685	F548-Y624 HydrophobicContact CD1-CE1 4.37Å; F548-Y624 HydrophobicContact CE1-CE1 4.17Å; F548-Y624 WeakPolarHBondContact CE1-OH 3.29Å; F548-W681 HydrophobicContact CE1-CE3 4.4Å; F548-W681 AromaticContact CE2-CE3 3.73Å; F548-W681 HydrophobicContact CE2-CE3 3.73Å; F548-W681 AromaticContact CE2-CZ3 3.72Å; F548-W681 HydrophobicContact CE2-CZ3 3.72Å; F548-W681 AromaticContact CZ-CD2 3.89Å; F548-W681 HydrophobicContact CZ-CD2 3.89Å; F548-W681 AromaticContact CZ-CE3 3.27Å; F548-W681 HydrophobicContact CZ-CE3 3.27Å; F548-W681 HydrophobicContact CZ-CH2 4.24Å; F548-W681 AromaticContact CZ-CZ3 3.47Å; F548-W681 HydrophobicContact CZ-CZ3 3.47Å; F548-W681 VanDerWaalsContact CZ-CZ3 3.47Å; F548-F684 HydrophobicContact CD2-CD1 4.16Å; F548-F684 HydrophobicContact CD2-CE1 4.18Å; F548-F684 AromaticContact CE2-CD1 3.57Å; F548-F684 HydrophobicContact CE2-CD1 3.57Å; F548-F684 AromaticContact CE2-CE1 3.75Å; F548-F684 HydrophobicContact CE2-CE1 3.75Å; F548-F685 HydrophobicContact CB-CD2 4.18Å; F548-F685 HydrophobicContact CG-CD2 4.44Å
549	L	54.9	Low	60.3	Low	34 Å²	34	53.9 Å²	53.9	18%	0.178	27%	0.269	C	S	.	.			trans	-56.2	140.1	165.2	-83.3	145.6	0	0	0	111	A36 C546 D551 Q552	A36-L549 HydrophobicContact CB-CD1 4.26Å; A36-L549 HydrophobicContact CB-CD2 3.93Å; C546-L549 HydrophobicContact CB-CD1 4.38Å; C546-L549 WeakPolarHBondContact O-CD1 3.44Å; L549-D551 PolarHBondContact O-N 3.46Å; L549-Q552 HydrophobicContact CB-CG 4.25Å; L549-Q552 VanDerWaalsContact O-CB 3.26Å; L549-Q552 WeakPolarHBondContact O-CB 3.41Å; L549-Q552 PolarHBondContact O-N 2.84Å
550	P	49.1	Very low	62.6	Low	12 Å²	12	44.2 Å²	44.2	8%	0.078	23%	0.227	C	C	.	.	H	α-helix	trans	-55.2	-29.1	178.5	-20.8	28.8	0	0	0	113.5	Y33 F178 G179 A184 Q552 G553	Y33-P550 HydrophobicContact CE1-CG 4.25Å; F178-P550 WeakPolarHBondContact CD1-O 3.41Å; F178-P550 WeakPolarHBondContact CE1-O 3.31Å; G179-P550 VanDerWaalsContact CA-CB 3.41Å; A184-P550 HydrophobicContact CB-CB 4.5Å; A184-P550 HydrophobicContact CB-CG 3.72Å; P550-Q552 VanDerWaalsContact C-N 3.26Å; P550-Q552 PolarHBondContact O-N 3.17Å; P550-G553 PolarHBondContact O-N 2.95Å; P550-G553 VanDerWaalsContact O-N 3.08Å
551	D	56	Low	64.8	Low	86 Å²	86	41 Å²	41	46%	0.46	20%	0.201	S	C	.	.	H	α-helix	trans	-65.3	-24.7	175.2	-61.2	-35	0	0	0	113.3	L549 G553 A554 F555	L549-D551 PolarHBondContact O-N 3.46Å; D551-G553 VanDerWaalsContact C-N 3.32Å; D551-A554 PolarHBondContact O-N 3.28Å; D551-F555 PolarHBondContact O-N 3.23Å
552	Q	64.2	Low	66.8	Low	59 Å²	59	40.6 Å²	40.6	28%	0.276	20%	0.2	S	C	.	.	H	α-helix	trans	-69.5	-31.1	171.9	-62.8	-65.1	-18.1	0	0	111.6	L549 P550 A554 F555 F556	L549-Q552 HydrophobicContact CB-CG 4.25Å; L549-Q552 VanDerWaalsContact O-CB 3.26Å; L549-Q552 WeakPolarHBondContact O-CB 3.41Å; L549-Q552 PolarHBondContact O-N 2.84Å; P550-Q552 VanDerWaalsContact C-N 3.26Å; P550-Q552 PolarHBondContact O-N 3.17Å; Q552-A554 VanDerWaalsContact C-N 3.31Å; Q552-A554 PolarHBondContact O-N 2.85Å; Q552-F555 WeakPolarHBondContact O-CB 3.3Å; Q552-F555 PolarHBondContact O-N 3.19Å; Q552-F556 WeakPolarHBondContact O-CD2 3.2Å; Q552-F556 PolarHBondContact O-N 2.98Å
553	G	74.4	Confident	68.7	Low	5 Å²	5	37.2 Å²	37.2	5%	0.052	18%	0.184	C	C	.	.	H	α-helix	trans	-62.1	-40	173.6	0	0	0	0	0	112	P550 D551 F555 F556 V557	P550-G553 PolarHBondContact O-N 2.95Å; P550-G553 VanDerWaalsContact O-N 3.08Å; D551-G553 VanDerWaalsContact C-N 3.32Å; G553-F555 VanDerWaalsContact C-N 3.32Å; G553-F555 PolarHBondContact O-N 3.03Å; G553-F556 PolarHBondContact O-N 3.12Å; G553-V557 WeakPolarHBondContact O-CG2 3.4Å; G553-V557 PolarHBondContact O-N 3.26Å; G553-V557 VanDerWaalsContact O-N 3.08Å
554	A	76.4	Confident	70.7	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.008	16%	0.156	C	C	.	.	H	α-helix	trans	-64.9	-37.1	177.9	0	0	0	0	0	111.8	I50 F178 D551 Q552 F556 V557 N558	I50-A554 HydrophobicContact CD1-CB 4.4Å; F178-A554 HydrophobicContact CD1-CB 3.74Å; F178-A554 HydrophobicContact CD2-CB 4.44Å; F178-A554 HydrophobicContact CE1-CB 3.77Å; F178-A554 HydrophobicContact CE2-CB 4.46Å; F178-A554 HydrophobicContact CG-CB 4.07Å; F178-A554 HydrophobicContact CZ-CB 4.1Å; D551-A554 PolarHBondContact O-N 3.28Å; Q552-A554 VanDerWaalsContact C-N 3.31Å; Q552-A554 PolarHBondContact O-N 2.85Å; A554-F556 PolarHBondContact O-N 3.48Å; A554-V557 PolarHBondContact O-N 3.26Å; A554-N558 WeakPolarHBondContact O-CB 3.42Å; A554-N558 VanDerWaalsContact O-CG 3.28Å; A554-N558 PolarHBondContact O-N 3.06Å; A554-N558 PolarHBondContact O-ND2 3.44Å
555	F	77.6	Confident	72.5	Confident	84 Å²	84	29.3 Å²	29.3	37%	0.368	15%	0.153	S	C	.	.	H	α-helix	trans	-57	-47.1	172.9	170.9	-96.2	0	0	0	112	P518 D551 Q552 G553 N558 Y559	P518-F555 HydrophobicContact CB-CE1 4.26Å; D551-F555 PolarHBondContact O-N 3.23Å; Q552-F555 WeakPolarHBondContact O-CB 3.3Å; Q552-F555 PolarHBondContact O-N 3.19Å; G553-F555 VanDerWaalsContact C-N 3.32Å; G553-F555 PolarHBondContact O-N 3.03Å; F555-N558 PolarHBondContact O-N 3.49Å; F555-Y559 WeakPolarHBondContact O-CB 3.15Å; F555-Y559 PolarHBondContact O-N 3.35Å
556	F	82.6	Confident	74.5	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-69.6	-34.8	179.7	-74.9	-71.7	0	0	0	113.5	V514 L515 P518 Q552 G553 A554 Y559 V560 V620 Y624	V514-F556 WeakPolarHBondContact O-CE1 3.34Å; V514-F556 WeakPolarHBondContact O-CZ 3.19Å; L515-F556 HydrophobicContact CD1-CE1 4.15Å; L515-F556 HydrophobicContact CD1-CZ 4.26Å; P518-F556 HydrophobicContact CB-CZ 4.21Å; Q552-F556 WeakPolarHBondContact O-CD2 3.2Å; Q552-F556 PolarHBondContact O-N 2.98Å; G553-F556 PolarHBondContact O-N 3.12Å; A554-F556 PolarHBondContact O-N 3.48Å; F556-Y559 PolarHBondContact O-N 2.87Å; F556-V560 VanDerWaalsContact O-CG2 3.24Å; F556-V560 WeakPolarHBondContact O-CG2 3.14Å; F556-V560 PolarHBondContact O-N 2.9Å; F556-V620 HydrophobicContact CB-CG1 4.4Å; F556-V620 HydrophobicContact CD1-CG1 3.65Å; F556-V620 HydrophobicContact CE1-CG1 4.35Å; F556-V620 HydrophobicContact CG-CG1 4.36Å; F556-Y624 HydrophobicContact CB-CD2 4.32Å; F556-Y624 HydrophobicContact CD1-CD2 4.36Å; F556-Y624 HydrophobicContact CD1-CE2 4.08Å; F556-Y624 HydrophobicContact CD2-CD1 4.44Å; F556-Y624 HydrophobicContact CD2-CD2 4.03Å; F556-Y624 AromaticContact CD2-CE1 3.89Å; F556-Y624 HydrophobicContact CD2-CE1 3.89Å; F556-Y624 AromaticContact CD2-CE2 3.38Å; F556-Y624 HydrophobicContact CD2-CE2 3.38Å; F556-Y624 AromaticContact CD2-CZ 3.32Å; F556-Y624 HydrophobicContact CE1-CE2 4.09Å; F556-Y624 HydrophobicContact CE2-CD2 4.48Å; F556-Y624 HydrophobicContact CE2-CE1 4.28Å; F556-Y624 AromaticContact CE2-CE2 3.46Å; F556-Y624 HydrophobicContact CE2-CE2 3.46Å; F556-Y624 VanDerWaalsContact CE2-CE2 3.46Å; F556-Y624 AromaticContact CE2-CZ 3.35Å; F556-Y624 WeakPolarHBondContact CE2-OH 3.17Å; F556-Y624 AromaticContact CG-CD2 3.97Å; F556-Y624 HydrophobicContact CG-CD2 3.97Å; F556-Y624 AromaticContact CG-CE2 3.72Å; F556-Y624 HydrophobicContact CG-CE2 3.72Å; F556-Y624 AromaticContact CZ-CE2 3.81Å; F556-Y624 HydrophobicContact CZ-CE2 3.81Å
557	V	86.9	Confident	76.2	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.2	-50.8	170.6	176.6	0	0	0	0	110.1	I50 F178 G553 A554 Y559 V560 I561 I630 V631 F634	I50-V557 HydrophobicContact CD1-CB 3.99Å; I50-V557 HydrophobicContact CD1-CG1 3.77Å; I50-V557 HydrophobicContact CD1-CG2 4.34Å; I50-V557 HydrophobicContact CG1-CB 4.3Å; I50-V557 HydrophobicContact CG1-CG1 3.94Å; I50-V557 HydrophobicContact CG2-CG1 4.06Å; F178-V557 HydrophobicContact CE2-CG2 4.37Å; F178-V557 HydrophobicContact CZ-CG2 4Å; G553-V557 WeakPolarHBondContact O-CG2 3.4Å; G553-V557 PolarHBondContact O-N 3.26Å; G553-V557 VanDerWaalsContact O-N 3.08Å; A554-V557 PolarHBondContact O-N 3.26Å; V557-Y559 VanDerWaalsContact C-N 3.32Å; V557-Y559 PolarHBondContact O-N 3.25Å; V557-V560 PolarHBondContact O-N 3.06Å; V557-I561 HydrophobicContact CG1-CD1 3.77Å; V557-I561 HydrophobicContact CG1-CG1 4.39Å; V557-I561 VanDerWaalsContact O-CG1 3.32Å; V557-I561 WeakPolarHBondContact O-CG1 3.49Å; V557-I561 PolarHBondContact O-N 3.44Å; V557-I630 HydrophobicContact CG1-CG2 4.26Å; V557-I630 HydrophobicContact CG2-CB 4.5Å; V557-I630 HydrophobicContact CG2-CG2 4.31Å; V557-V631 HydrophobicContact CB-CG2 4.33Å; V557-V631 HydrophobicContact CG2-CB 4.37Å; V557-V631 HydrophobicContact CG2-CG2 3.34Å; V557-F634 HydrophobicContact CG1-CD2 3.82Å; V557-F634 HydrophobicContact CG1-CE2 4.04Å
558	N	82.4	Confident	78.2	Confident	16 Å²	16	25.8 Å²	25.8	9%	0.086	14%	0.14	C	C	.	.	H	α-helix	trans	-60.8	-40.3	178.5	-71.6	-29	0	0	0	111.9	G48 I50 V53 A554 F555 V560 I561 A562	G48-N558 PolarHBondContact O-ND2 2.89Å; G48-N558 VanDerWaalsContact O-ND2 3.12Å; I50-N558 WeakPolarHBondContact CA-OD1 3.29Å; I50-N558 VanDerWaalsContact CG1-OD1 3.3Å; I50-N558 WeakPolarHBondContact CG1-OD1 3.4Å; V53-N558 HydrophobicContact CG1-CB 4.21Å; A554-N558 WeakPolarHBondContact O-CB 3.42Å; A554-N558 VanDerWaalsContact O-CG 3.28Å; A554-N558 PolarHBondContact O-N 3.06Å; A554-N558 PolarHBondContact O-ND2 3.44Å; F555-N558 PolarHBondContact O-N 3.49Å; N558-V560 PolarHBondContact O-N 3Å; N558-I561 PolarHBondContact O-N 3.2Å; N558-A562 WeakPolarHBondContact O-CB 3.34Å; N558-A562 PolarHBondContact O-N 3.25Å
559	Y	85.1	Confident	79.9	Confident	60 Å²	60	24.5 Å²	24.5	24%	0.235	13%	0.134	C	C	.	.	H	α-helix	trans	-60.1	-44.3	174.4	169.2	-99.7	0	0	0	112.3	V514 F555 F556 V557 S563 V617 V620	V514-Y559 HydrophobicContact CG1-CD1 4.19Å; V514-Y559 HydrophobicContact CG1-CD2 4.47Å; V514-Y559 HydrophobicContact CG1-CE1 3.65Å; V514-Y559 HydrophobicContact CG1-CE2 3.96Å; F555-Y559 WeakPolarHBondContact O-CB 3.15Å; F555-Y559 PolarHBondContact O-N 3.35Å; F556-Y559 PolarHBondContact O-N 2.87Å; V557-Y559 VanDerWaalsContact C-N 3.32Å; V557-Y559 PolarHBondContact O-N 3.25Å; Y559-S563 VanDerWaalsContact O-CB 3.3Å; Y559-S563 WeakPolarHBondContact O-CB 3.22Å; Y559-S563 PolarHBondContact O-N 3.37Å; Y559-S563 PolarHBondContact O-OG 3.4Å; Y559-V617 HydrophobicContact CE1-CG2 4.35Å; Y559-V620 HydrophobicContact CD1-CG1 4.44Å; Y559-V620 HydrophobicContact CE1-CG2 4.4Å
560	V	90.4	Very high	81.4	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-67.4	-40	178.4	172.4	0	0	0	0	110.9	F556 V557 N558 S563 A564 V620 I621 V631 F634	F556-V560 VanDerWaalsContact O-CG2 3.24Å; F556-V560 WeakPolarHBondContact O-CG2 3.14Å; F556-V560 PolarHBondContact O-N 2.9Å; V557-V560 PolarHBondContact O-N 3.06Å; N558-V560 PolarHBondContact O-N 3Å; V560-S563 PolarHBondContact O-N 3.09Å; V560-A564 WeakPolarHBondContact O-CB 3.23Å; V560-A564 PolarHBondContact O-N 2.86Å; V560-V620 HydrophobicContact CG2-CG1 4.19Å; V560-I621 HydrophobicContact CG1-CG1 4.37Å; V560-I621 HydrophobicContact CG2-CG1 4.26Å; V560-V631 HydrophobicContact CG2-CG1 3.93Å; V560-F634 HydrophobicContact CG1-CB 4.14Å
561	I	87.8	Confident	83.2	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.8	-50.1	175.2	-67.4	170.5	0	0	0	110.7	I50 V53 L54 D57 V557 N558 S563 A564 F565 F634	I50-I561 HydrophobicContact CG2-CD1 3.77Å; V53-I561 HydrophobicContact CG1-CG2 4.43Å; L54-I561 HydrophobicContact CB-CD1 4.47Å; L54-I561 HydrophobicContact CB-CG2 4.35Å; L54-I561 HydrophobicContact CD1-CD1 4.48Å; L54-I561 HydrophobicContact CD1-CG2 3.77Å; D57-I561 HydrophobicContact CB-CG2 4.18Å; D57-I561 WeakPolarHBondContact OD2-CG2 3.42Å; V557-I561 HydrophobicContact CG1-CD1 3.77Å; V557-I561 HydrophobicContact CG1-CG1 4.39Å; V557-I561 VanDerWaalsContact O-CG1 3.32Å; V557-I561 WeakPolarHBondContact O-CG1 3.49Å; V557-I561 PolarHBondContact O-N 3.44Å; N558-I561 PolarHBondContact O-N 3.2Å; I561-S563 VanDerWaalsContact C-N 3.29Å; I561-S563 PolarHBondContact O-N 3.42Å; I561-A564 WeakPolarHBondContact O-CB 3.47Å; I561-A564 PolarHBondContact O-N 3.5Å; I561-A564 VanDerWaalsContact O-N 3.08Å; I561-F565 HydrophobicContact CG2-CD2 3.91Å; I561-F565 HydrophobicContact CG2-CE2 4.16Å; I561-F565 WeakPolarHBondContact O-CD2 3.22Å; I561-F565 PolarHBondContact O-N 2.88Å; I561-F634 HydrophobicContact CD1-CD1 3.98Å; I561-F634 HydrophobicContact CD1-CD2 4.03Å; I561-F634 HydrophobicContact CD1-CE1 3.96Å; I561-F634 HydrophobicContact CD1-CE2 4.01Å; I561-F634 HydrophobicContact CD1-CG 4.03Å; I561-F634 HydrophobicContact CD1-CZ 3.97Å; I561-F634 HydrophobicContact CG1-CB 4Å; I561-F634 HydrophobicContact CG1-CD1 3.66Å; I561-F634 HydrophobicContact CG1-CD2 4.13Å; I561-F634 HydrophobicContact CG1-CE1 4.12Å; I561-F634 HydrophobicContact CG1-CG 3.66Å
562	A	85.6	Confident	84.6	Confident	32 Å²	32	23.6 Å²	23.6	26%	0.264	13%	0.126	S	C	.	.	H	α-helix	trans	-60.9	-40.3	177.6	0	0	0	0	0	111.5	D57 N558 A564 I566 G567	D57-A562 WeakPolarHBondContact OD2-CA 3.34Å; D57-A562 PolarHBondContact OD2-N 2.9Å; N558-A562 WeakPolarHBondContact O-CB 3.34Å; N558-A562 PolarHBondContact O-N 3.25Å; A562-A564 VanDerWaalsContact C-N 3.34Å; A562-A564 PolarHBondContact O-N 3.42Å; A562-I566 WeakPolarHBondContact O-CA 3.36Å; A562-I566 WeakPolarHBondContact O-CB 3.5Å; A562-I566 PolarHBondContact O-N 3.28Å; A562-G567 PolarHBondContact O-N 2.91Å
563	S	88.2	Confident	85.5	Confident	18 Å²	18	21.3 Å²	21.3	13%	0.126	12%	0.116	C	C	.	.	I	π-helix	trans	-65.3	-37	175	-59.4	0	0	0	0	112.1	Y559 V560 I561 G567 N568	Y559-S563 VanDerWaalsContact O-CB 3.3Å; Y559-S563 WeakPolarHBondContact O-CB 3.22Å; Y559-S563 PolarHBondContact O-N 3.37Å; Y559-S563 PolarHBondContact O-OG 3.4Å; V560-S563 PolarHBondContact O-N 3.09Å; I561-S563 VanDerWaalsContact C-N 3.29Å; I561-S563 PolarHBondContact O-N 3.42Å; S563-G567 WeakPolarHBondContact O-CA 3.35Å; S563-G567 PolarHBondContact O-N 3.04Å; S563-N568 PolarHBondContact O-N 3.2Å
564	A	92.4	Very high	85.9	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.008	12%	0.119	C	C	.	.	I	π-helix	trans	-64.3	-44.7	179	0	0	0	0	0	112.3	V560 I561 A562 N568 Y638 L641	V560-A564 WeakPolarHBondContact O-CB 3.23Å; V560-A564 PolarHBondContact O-N 2.86Å; I561-A564 WeakPolarHBondContact O-CB 3.47Å; I561-A564 PolarHBondContact O-N 3.5Å; I561-A564 VanDerWaalsContact O-N 3.08Å; A562-A564 VanDerWaalsContact C-N 3.34Å; A562-A564 PolarHBondContact O-N 3.42Å; A564-N568 WeakPolarHBondContact O-CB 3.46Å; A564-N568 PolarHBondContact O-ND2 3.45Å; A564-Y638 HydrophobicContact CB-CD2 4.34Å; A564-L641 VanDerWaalsContact O-CD1 3.3Å; A564-L641 WeakPolarHBondContact O-CD1 3.49Å
565	F	91.1	Very high	85.9	Confident	22 Å²	22	25.1 Å²	25.1	10%	0.096	13%	0.132	C	C	.	.	I	π-helix	trans	-97.8	-64.3	-173.3	-69.7	-65.2	0	0	0	111.6	L54 D57 V58 F61 I561 G569 I637 L641	L54-F565 HydrophobicContact CD1-CD2 4.46Å; L54-F565 HydrophobicContact CD1-CE2 3.66Å; L54-F565 HydrophobicContact CD1-CZ 4.36Å; D57-F565 HydrophobicContact CB-CB 4Å; D57-F565 HydrophobicContact CB-CD2 4.16Å; D57-F565 HydrophobicContact CB-CG 4.42Å; V58-F565 HydrophobicContact CG2-CD1 4.21Å; V58-F565 HydrophobicContact CG2-CD2 4.15Å; V58-F565 HydrophobicContact CG2-CE1 3.81Å; V58-F565 HydrophobicContact CG2-CE2 3.76Å; V58-F565 HydrophobicContact CG2-CG 4.37Å; V58-F565 HydrophobicContact CG2-CZ 3.58Å; F61-F565 HydrophobicContact CB-CB 3.9Å; F61-F565 HydrophobicContact CB-CD1 4.03Å; F61-F565 HydrophobicContact CB-CG 4.38Å; F61-F565 AromaticContact CD1-CD1 3.83Å; F61-F565 HydrophobicContact CD1-CD1 3.83Å; F61-F565 HydrophobicContact CD1-CE1 4.46Å; F61-F565 WeakPolarHBondContact CD2-O 3.27Å; F61-F565 HydrophobicContact CE1-CD1 4.41Å; F61-F565 HydrophobicContact CG-CB 4.31Å; F61-F565 AromaticContact CG-CD1 3.93Å; F61-F565 HydrophobicContact CG-CD1 3.93Å; I561-F565 HydrophobicContact CG2-CD2 3.91Å; I561-F565 HydrophobicContact CG2-CE2 4.16Å; I561-F565 WeakPolarHBondContact O-CD2 3.22Å; I561-F565 PolarHBondContact O-N 2.88Å; F565-G569 PolarHBondContact O-N 3.3Å; F565-I637 HydrophobicContact CZ-CG2 4.08Å; F565-L641 HydrophobicContact CD1-CD1 4Å; F565-L641 HydrophobicContact CE1-CD1 3.95Å
566	I	87.6	Confident	85.7	Confident	55 Å²	55	25.8 Å²	25.8	28%	0.282	15%	0.145	S	C	.	.	I	π-helix	trans	-66.4	-46.1	-178.4	-59.7	177.6	0	0	0	110.4	D57 C60 A562 G569 M570	D57-I566 WeakPolarHBondContact OD1-CD1 3.28Å; C60-I566 HydrophobicContact CB-CG1 4.48Å; A562-I566 WeakPolarHBondContact O-CA 3.36Å; A562-I566 WeakPolarHBondContact O-CB 3.5Å; A562-I566 PolarHBondContact O-N 3.28Å; I566-G569 PolarHBondContact O-N 2.71Å; I566-M570 HydrophobicContact CG2-CG 4.01Å; I566-M570 WeakPolarHBondContact O-CB 3.39Å; I566-M570 WeakPolarHBondContact O-CG 3.23Å; I566-M570 PolarHBondContact O-N 2.98Å
567	G	85.9	Confident	85.4	Confident	28 Å²	28	26.8 Å²	26.8	29%	0.289	16%	0.155	S	C	.	.	I	π-helix	trans	-56.6	-58.2	-179.4	0	0	0	0	0	112.7	A562 S563 G569 M570 E571	A562-G567 PolarHBondContact O-N 2.91Å; S563-G567 WeakPolarHBondContact O-CA 3.35Å; S563-G567 PolarHBondContact O-N 3.04Å; G567-G569 VanDerWaalsContact C-N 3.33Å; G567-G569 PolarHBondContact O-N 3.22Å; G567-M570 PolarHBondContact O-N 2.73Å; G567-E571 PolarHBondContact O-N 3.49Å
568	N	90.5	Very high	85	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63	-35.9	177.4	-72	-55.1	0	0	0	113	S563 A564 E571 L572 Y638 L641 K642 V645	S563-N568 PolarHBondContact O-N 3.2Å; A564-N568 WeakPolarHBondContact O-CB 3.46Å; A564-N568 PolarHBondContact O-ND2 3.45Å; N568-E571 PolarHBondContact O-N 2.93Å; N568-L572 WeakPolarHBondContact O-CB 3.5Å; N568-L572 PolarHBondContact O-N 3.37Å; N568-Y638 PolarHBondContact ND2-O 3Å; N568-L641 HydrophobicContact CB-CB 4.44Å; N568-K642 VanDerWaalsContact OD1-CA 3.22Å; N568-K642 WeakPolarHBondContact OD1-CA 3.34Å; N568-K642 WeakPolarHBondContact OD1-CB 3.39Å; N568-K642 VanDerWaalsContact OD1-CD 3.22Å; N568-K642 WeakPolarHBondContact OD1-CD 2.99Å; N568-V645 HydrophobicContact CB-CG2 4.22Å
569	G	89.7	Confident	84.9	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-61.3	-46.5	174.2	0	0	0	0	0	112	F565 I566 G567 E571 L572 L573	F565-G569 PolarHBondContact O-N 3.3Å; I566-G569 PolarHBondContact O-N 2.71Å; G567-G569 VanDerWaalsContact C-N 3.33Å; G567-G569 PolarHBondContact O-N 3.22Å; G569-E571 PolarHBondContact O-N 3Å; G569-L572 WeakPolarHBondContact O-CB 3.47Å; G569-L572 PolarHBondContact O-N 3.14Å; G569-L573 WeakPolarHBondContact O-CD1 3.22Å; G569-L573 PolarHBondContact O-N 3.17Å; G569-L573 VanDerWaalsContact O-N 3.08Å
570	M	85.5	Confident	84.7	Confident	73 Å²	73	32.7 Å²	32.7	36%	0.36	19%	0.189	S	C	.	.	H	α-helix	trans	-64.5	-38.9	177.6	-69.3	-66.2	-65.5	0	0	112.5	L64 I566 G567 L572 L573 R574 L575	L64-M570 HydrophobicContact CD1-CG 4.5Å; L64-M570 HydrophobicContact CD1-SD 4.5Å; L64-M570 HydrophobicContact CD2-SD 4.34Å; I566-M570 HydrophobicContact CG2-CG 4.01Å; I566-M570 WeakPolarHBondContact O-CB 3.39Å; I566-M570 WeakPolarHBondContact O-CG 3.23Å; I566-M570 PolarHBondContact O-N 2.98Å; G567-M570 PolarHBondContact O-N 2.73Å; M570-L572 VanDerWaalsContact C-N 3.32Å; M570-L573 PolarHBondContact O-N 2.8Å; M570-R574 PolarHBondContact O-N 2.85Å; M570-L575 HydrophobicContact CE-CB 4.1Å; M570-L575 HydrophobicContact CE-CD1 3.43Å; M570-L575 VanDerWaalsContact CE-CD1 3.43Å; M570-L575 HydrophobicContact CE-CG 4.29Å; M570-L575 HydrophobicContact SD-CD1 3.65Å
571	E	86.1	Confident	84.2	Confident	38 Å²	38	33.6 Å²	33.6	18%	0.178	19%	0.193	C	C	.	.	H	α-helix	trans	-64.3	-34.8	173.9	-75.4	-175.4	-174.7	0	0	112.7	G567 N568 G569 R574 K642 V645 N649	G567-E571 PolarHBondContact O-N 3.49Å; N568-E571 PolarHBondContact O-N 2.93Å; G569-E571 PolarHBondContact O-N 3Å; E571-R574 WeakPolarHBondContact O-CG 3.45Å; E571-K642 IonicContact OE1-NZ 3.62Å; E571-K642 WeakPolarHBondContact OE2-CE 3.43Å; E571-K642 IonicContact OE2-NZ 3.95Å; E571-K642 PolarHBondContact OE2-NZ 2.82Å; E571-V645 HydrophobicContact CB-CG1 4.32Å; E571-N649 PolarHBondContact O-ND2 2.98Å
572	L	86.7	Confident	83.9	Confident	3 Å²	3	36.8 Å²	36.8	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-67.3	-44.7	174.3	-174.3	69.8	0	0	0	111.4	F68 W116 N568 G569 M570 V645	F68-L572 HydrophobicContact CB-CD2 4.41Å; F68-L572 HydrophobicContact CD1-CD2 3.81Å; F68-L572 HydrophobicContact CD1-CG 4.17Å; F68-L572 HydrophobicContact CD2-CD2 4.31Å; F68-L572 HydrophobicContact CD2-CG 3.89Å; F68-L572 HydrophobicContact CE1-CD1 4.27Å; F68-L572 HydrophobicContact CE1-CD2 4.11Å; F68-L572 HydrophobicContact CE1-CG 4.19Å; F68-L572 HydrophobicContact CE2-CD1 4.17Å; F68-L572 HydrophobicContact CE2-CG 3.91Å; F68-L572 HydrophobicContact CG-CD2 3.91Å; F68-L572 HydrophobicContact CG-CG 4.02Å; F68-L572 HydrophobicContact CZ-CD1 3.97Å; F68-L572 HydrophobicContact CZ-CD2 4.48Å; F68-L572 HydrophobicContact CZ-CG 4.06Å; W116-L572 HydrophobicContact CH2-CD1 4.38Å; W116-L572 HydrophobicContact CH2-CD2 3.54Å; W116-L572 HydrophobicContact CZ2-CD2 4.14Å; W116-L572 HydrophobicContact CZ3-CD1 4.25Å; W116-L572 HydrophobicContact CZ3-CD2 4.23Å; N568-L572 WeakPolarHBondContact O-CB 3.5Å; N568-L572 PolarHBondContact O-N 3.37Å; G569-L572 WeakPolarHBondContact O-CB 3.47Å; G569-L572 PolarHBondContact O-N 3.14Å; M570-L572 VanDerWaalsContact C-N 3.32Å; L572-V645 HydrophobicContact CB-CG1 4.04Å; L572-V645 HydrophobicContact CB-CG2 4.44Å; L572-V645 HydrophobicContact CD1-CG1 4.22Å
573	L	83.3	Confident	83.8	Confident	10 Å²	10	40.8 Å²	40.8	5%	0.052	22%	0.224	C	C	.	.	H	α-helix	trans	-71.5	-28.7	178.6	-81.9	85.8	0	0	0	113.3	L64 V67 F68 I71 G569 M570 L575	L64-L573 HydrophobicContact CB-CD1 3.85Å; L64-L573 HydrophobicContact CD2-CD1 4.1Å; L64-L573 HydrophobicContact CD2-CD2 4.14Å; L64-L573 HydrophobicContact CG-CD1 4.49Å; L64-L573 WeakPolarHBondContact O-CD1 3.26Å; V67-L573 HydrophobicContact CB-CD2 4.24Å; V67-L573 HydrophobicContact CG1-CD2 3.7Å; F68-L573 HydrophobicContact CB-CD1 4.01Å; F68-L573 HydrophobicContact CB-CG 4.1Å; I71-L573 HydrophobicContact CD1-CD2 4.36Å; G569-L573 WeakPolarHBondContact O-CD1 3.22Å; G569-L573 PolarHBondContact O-N 3.17Å; G569-L573 VanDerWaalsContact O-N 3.08Å; M570-L573 PolarHBondContact O-N 2.8Å; L573-L575 VanDerWaalsContact C-N 3.28Å; L573-L575 HydrophobicContact CB-CG 4.07Å; L573-L575 HydrophobicContact CD2-CD1 4.41Å; L573-L575 HydrophobicContact CD2-CD2 4.45Å; L573-L575 HydrophobicContact CD2-CG 4.27Å; L573-L575 PolarHBondContact O-N 3.41Å
574	R	82.2	Confident	83.5	Confident	34 Å²	34	45 Å²	45	13%	0.128	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	45.8	-174.3	-58.3	178.1	-72.6	136	-4.5	112.3	Y78 M570 E571 G577 L578	Y78-R574 VanDerWaalsContact CD1-NH2 3.34Å; M570-R574 PolarHBondContact O-N 2.85Å; E571-R574 WeakPolarHBondContact O-CG 3.45Å; R574-G577 PolarHBondContact O-N 3.47Å; R574-L578 PolarHBondContact O-N 2.86Å
575	L	76.9	Confident	83	Confident	53 Å²	53	46 Å²	46	28%	0.277	24%	0.242	S	C	.	.	H	α-helix	trans	-50.7	-45	-174.4	-85.6	172.6	0	0	0	114.2	M570 L573 G577 L578 I579	M570-L575 HydrophobicContact CE-CB 4.1Å; M570-L575 HydrophobicContact CE-CD1 3.43Å; M570-L575 VanDerWaalsContact CE-CD1 3.43Å; M570-L575 HydrophobicContact CE-CG 4.29Å; M570-L575 HydrophobicContact SD-CD1 3.65Å; L573-L575 VanDerWaalsContact C-N 3.28Å; L573-L575 HydrophobicContact CB-CG 4.07Å; L573-L575 HydrophobicContact CD2-CD1 4.41Å; L573-L575 HydrophobicContact CD2-CD2 4.45Å; L573-L575 HydrophobicContact CD2-CG 4.27Å; L573-L575 PolarHBondContact O-N 3.41Å; L575-G577 VanDerWaalsContact C-N 3.33Å; L575-G577 PolarHBondContact O-N 3.38Å; L575-L578 PolarHBondContact O-N 3.48Å; L575-I579 VanDerWaalsContact O-CG1 3.26Å; L575-I579 WeakPolarHBondContact O-CG1 3.35Å; L575-I579 PolarHBondContact O-N 2.86Å
576	P	73.6	Confident	82.6	Confident	98 Å²	98	49.1 Å²	49.1	64%	0.636	26%	0.259	S	S	*	.	H	α-helix	trans	-59.3	-42	177.3	-25.3	35	0	0	0	113.2	I579 L580	P576-I579 PolarHBondContact O-N 2.81Å; P576-L580 PolarHBondContact O-N 2.9Å
577	G	75.4	Confident	82.2	Confident	21 Å²	21	50.9 Å²	50.9	22%	0.216	27%	0.267	C	S	.	.	H	α-helix	trans	-66.3	-38.5	176.9	0	0	0	0	0	112.6	R574 L575 Y581	R574-G577 PolarHBondContact O-N 3.47Å; L575-G577 VanDerWaalsContact C-N 3.33Å; L575-G577 PolarHBondContact O-N 3.38Å; G577-Y581 WeakPolarHBondContact O-CB 3.4Å; G577-Y581 PolarHBondContact O-N 3.27Å
578	L	78.8	Confident	82	Confident	23 Å²	23	50 Å²	50	12%	0.12	26%	0.257	C	S	.	.	H	α-helix	trans	-69.5	-38	177.7	-169.2	71.4	0	0	0	112.4	I71 Y78 R574 L575 Y581 T582	I71-L578 HydrophobicContact CD1-CD2 3.98Å; I71-L578 HydrophobicContact CG2-CD2 4.29Å; Y78-L578 HydrophobicContact CD1-CD1 4.47Å; Y78-L578 HydrophobicContact CE1-CD1 4.35Å; Y78-L578 HydrophobicContact CE2-CD1 4.46Å; R574-L578 PolarHBondContact O-N 2.86Å; L575-L578 PolarHBondContact O-N 3.48Å; L578-Y581 HydrophobicContact CD1-CD1 4.39Å; L578-Y581 WeakPolarHBondContact O-CB 3.42Å; L578-Y581 PolarHBondContact O-N 3.1Å; L578-T582 WeakPolarHBondContact O-CB 3.12Å; L578-T582 PolarHBondContact O-N 3.05Å; L578-T582 PolarHBondContact O-OG1 3.47Å
579	I	80.5	Confident	81.4	Confident	111 Å²	111	53.9 Å²	53.9	57%	0.569	27%	0.274	S	S	*	.	H	α-helix	trans	-64.3	-48.2	175	-68.4	163.5	0	0	0	109.8	L575 P576 Y581 T582 F583	L575-I579 VanDerWaalsContact O-CG1 3.26Å; L575-I579 WeakPolarHBondContact O-CG1 3.35Å; L575-I579 PolarHBondContact O-N 2.86Å; P576-I579 PolarHBondContact O-N 2.81Å; I579-Y581 VanDerWaalsContact C-N 3.31Å; I579-Y581 PolarHBondContact O-N 3.48Å; I579-T582 PolarHBondContact O-N 3.02Å; I579-F583 WeakPolarHBondContact O-CB 3.43Å; I579-F583 PolarHBondContact O-N 3.34Å
580	L	79.4	Confident	80.9	Confident	66 Å²	66	54.1 Å²	54.1	35%	0.346	28%	0.275	S	S	.	.	H	α-helix	trans	-62.3	-39.3	177.5	-175.6	64.1	0	0	0	111.9	P576 F583 R584	P576-L580 PolarHBondContact O-N 2.9Å; L580-F583 PolarHBondContact O-N 2.77Å; L580-R584 WeakPolarHBondContact O-CB 3.34Å; L580-R584 VanDerWaalsContact O-CG 3.28Å; L580-R584 WeakPolarHBondContact O-CG 3.49Å; L580-R584 PolarHBondContact O-N 2.77Å
581	Y	79.9	Confident	80.7	Confident	18 Å²	18	52.2 Å²	52.2	7%	0.071	27%	0.271	C	S	.	.	H	α-helix	trans	-59.3	-50.6	173.1	174.3	-114.2	0	0	0	111.7	Y78 G577 L578 I579 F583 R584 M585 V597 K598 Q601	Y78-Y581 HydrophobicContact CD2-CD1 4.11Å; Y78-Y581 HydrophobicContact CD2-CE1 4.32Å; Y78-Y581 HydrophobicContact CD2-CG 4.21Å; Y78-Y581 HydrophobicContact CE2-CD1 4.23Å; Y78-Y581 HydrophobicContact CE2-CD2 4.43Å; Y78-Y581 AromaticContact CE2-CG 3.99Å; Y78-Y581 HydrophobicContact CE2-CG 3.99Å; G577-Y581 WeakPolarHBondContact O-CB 3.4Å; G577-Y581 PolarHBondContact O-N 3.27Å; L578-Y581 HydrophobicContact CD1-CD1 4.39Å; L578-Y581 WeakPolarHBondContact O-CB 3.42Å; L578-Y581 PolarHBondContact O-N 3.1Å; I579-Y581 VanDerWaalsContact C-N 3.31Å; I579-Y581 PolarHBondContact O-N 3.48Å; Y581-F583 VanDerWaalsContact C-N 3.31Å; Y581-F583 PolarHBondContact O-N 3.06Å; Y581-R584 PolarHBondContact O-N 2.82Å; Y581-M585 HydrophobicContact CD1-CG 4.42Å; Y581-M585 HydrophobicContact CD2-CG 4Å; Y581-M585 HydrophobicContact CE1-CG 4.07Å; Y581-M585 HydrophobicContact CE2-CG 3.6Å; Y581-M585 HydrophobicContact CE2-SD 3.97Å; Y581-M585 HydrophobicContact CG-CG 4.4Å; Y581-M585 WeakPolarHBondContact O-CB 3.27Å; Y581-M585 VanDerWaalsContact O-CG 3.24Å; Y581-M585 WeakPolarHBondContact O-CG 3.17Å; Y581-M585 PolarHBondContact O-N 3.41Å; Y581-V597 HydrophobicContact CD2-CG1 4.14Å; Y581-V597 HydrophobicContact CE2-CG1 4.12Å; Y581-K598 HydrophobicContact CE2-CG 4.39Å; Y581-K598 WeakPolarHBondContact OH-CG 3.45Å; Y581-Q601 HydrophobicContact CD2-CB 4.47Å; Y581-Q601 HydrophobicContact CD2-CG 3.72Å; Y581-Q601 HydrophobicContact CE2-CG 4.26Å; Y581-Q601 HydrophobicContact CG-CG 4.38Å
582	T	81.9	Confident	80.4	Confident	68 Å²	68	50.5 Å²	50.5	42%	0.417	26%	0.264	S	S	.	.	H	α-helix	trans	-61.5	-43.2	-179.2	-55	0	0	0	0	110.6	L578 I579 M585 I586	L578-T582 WeakPolarHBondContact O-CB 3.12Å; L578-T582 PolarHBondContact O-N 3.05Å; L578-T582 PolarHBondContact O-OG1 3.47Å; I579-T582 PolarHBondContact O-N 3.02Å; T582-M585 WeakPolarHBondContact O-CB 3Å; T582-M585 PolarHBondContact O-N 3.09Å; T582-I586 HydrophobicContact CG2-CD1 4.12Å; T582-I586 VanDerWaalsContact O-CG1 3.31Å; T582-I586 WeakPolarHBondContact O-CG1 3.15Å; T582-I586 PolarHBondContact O-N 2.69Å
583	F	83.3	Confident	80	Confident	116 Å²	116	51.2 Å²	51.2	51%	0.509	27%	0.267	S	S	.	.	H	α-helix	trans	-60.7	-47.8	174.6	-178.8	-103.6	0	0	0	112.3	I579 L580 Y581 M585 I586 M587	I579-F583 WeakPolarHBondContact O-CB 3.43Å; I579-F583 PolarHBondContact O-N 3.34Å; L580-F583 PolarHBondContact O-N 2.77Å; Y581-F583 VanDerWaalsContact C-N 3.31Å; Y581-F583 PolarHBondContact O-N 3.06Å; F583-M585 VanDerWaalsContact C-N 3.29Å; F583-M585 PolarHBondContact O-N 3.08Å; F583-I586 PolarHBondContact O-N 3.17Å; F583-M587 HydrophobicContact CD1-CG 4.39Å; F583-M587 HydrophobicContact CD1-SD 4.11Å; F583-M587 HydrophobicContact CE1-CG 4.02Å; F583-M587 HydrophobicContact CE1-SD 3.25Å; F583-M587 WeakPolarHBondContact CE1-SD 3.39Å; F583-M587 HydrophobicContact CE2-CG 4.24Å; F583-M587 HydrophobicContact CE2-SD 4.11Å; F583-M587 HydrophobicContact CZ-CE 4.42Å; F583-M587 HydrophobicContact CZ-CG 3.94Å; F583-M587 HydrophobicContact CZ-SD 3.25Å; F583-M587 WeakPolarHBondContact CZ-SD 3.26Å; F583-M587 WeakPolarHBondContact O-CG 3.3Å; F583-M587 PolarHBondContact O-N 2.9Å
584	R	82.8	Confident	79.8	Confident	105 Å²	105	55.8 Å²	55.8	40%	0.396	28%	0.284	S	S	.	.	H	α-helix	trans	-61.9	-36	175.7	-75.1	176.4	178	-179.8	1.1	112.5	L580 Y581 M587 A588 V597	L580-R584 WeakPolarHBondContact O-CB 3.34Å; L580-R584 VanDerWaalsContact O-CG 3.28Å; L580-R584 WeakPolarHBondContact O-CG 3.49Å; L580-R584 PolarHBondContact O-N 2.77Å; Y581-R584 PolarHBondContact O-N 2.82Å; R584-M587 PolarHBondContact O-N 3.27Å; R584-A588 PolarHBondContact O-N 3.06Å; R584-V597 HydrophobicContact CB-CG1 3.94Å
585	M	81.9	Confident	79.6	Confident	22 Å²	22	57.8 Å²	57.8	11%	0.108	29%	0.291	C	S	.	.	H	α-helix	trans	-68	-34.5	176.4	-76.3	-69.7	-76.7	0	0	112.5	Y581 T582 F583 R594 V597 K598	Y581-M585 HydrophobicContact CD1-CG 4.42Å; Y581-M585 HydrophobicContact CD2-CG 4Å; Y581-M585 HydrophobicContact CE1-CG 4.07Å; Y581-M585 HydrophobicContact CE2-CG 3.6Å; Y581-M585 HydrophobicContact CE2-SD 3.97Å; Y581-M585 HydrophobicContact CG-CG 4.4Å; Y581-M585 WeakPolarHBondContact O-CB 3.27Å; Y581-M585 VanDerWaalsContact O-CG 3.24Å; Y581-M585 WeakPolarHBondContact O-CG 3.17Å; Y581-M585 PolarHBondContact O-N 3.41Å; T582-M585 WeakPolarHBondContact O-CB 3Å; T582-M585 PolarHBondContact O-N 3.09Å; F583-M585 VanDerWaalsContact C-N 3.29Å; F583-M585 PolarHBondContact O-N 3.08Å; M585-R594 HydrophobicContact CE-CB 4.32Å; M585-R594 HydrophobicContact SD-CB 4.19Å; M585-R594 HydrophobicContact SD-CG 4.39Å; M585-V597 HydrophobicContact CG-CG1 4.09Å; M585-V597 HydrophobicContact SD-CB 4.2Å; M585-V597 HydrophobicContact SD-CG1 3.9Å; M585-K598 HydrophobicContact CE-CG 4.41Å; M585-K598 HydrophobicContact SD-CG 4.31Å
586	I	81.9	Confident	79.6	Confident	88 Å²	88	55.5 Å²	55.5	45%	0.451	28%	0.28	S	S	.	.	H	α-helix	trans	-73.6	-40.4	174.4	-66.8	164.6	0	0	0	110.8	T582 F583 A588	T582-I586 HydrophobicContact CG2-CD1 4.12Å; T582-I586 VanDerWaalsContact O-CG1 3.31Å; T582-I586 WeakPolarHBondContact O-CG1 3.15Å; T582-I586 PolarHBondContact O-N 2.69Å; F583-I586 PolarHBondContact O-N 3.17Å; I586-A588 VanDerWaalsContact C-N 3.28Å; I586-A588 PolarHBondContact O-N 3.34Å
587	M	80.6	Confident	79.9	Confident	92 Å²	92	52.1 Å²	52.1	45%	0.453	26%	0.257	S	S	.	.	H	α-helix	trans	-74.8	-12.1	178.5	-68.8	-157.9	91.2	0	0	114.5	F583 R584 K589	F583-M587 HydrophobicContact CD1-CG 4.39Å; F583-M587 HydrophobicContact CD1-SD 4.11Å; F583-M587 HydrophobicContact CE1-CG 4.02Å; F583-M587 HydrophobicContact CE1-SD 3.25Å; F583-M587 WeakPolarHBondContact CE1-SD 3.39Å; F583-M587 HydrophobicContact CE2-CG 4.24Å; F583-M587 HydrophobicContact CE2-SD 4.11Å; F583-M587 HydrophobicContact CZ-CE 4.42Å; F583-M587 HydrophobicContact CZ-CG 3.94Å; F583-M587 HydrophobicContact CZ-SD 3.25Å; F583-M587 WeakPolarHBondContact CZ-SD 3.26Å; F583-M587 WeakPolarHBondContact O-CG 3.3Å; F583-M587 PolarHBondContact O-N 2.9Å; R584-M587 PolarHBondContact O-N 3.27Å; M587-K589 PolarHBondContact O-N 3.07Å
588	A	80.1	Confident	79.9	Confident	10 Å²	10	54.1 Å²	54.1	8%	0.083	26%	0.26	C	S	.	.			trans	-62.7	129.8	-179.3	0	0	0	0	0	111.1	R584 I586 D593 R594	R584-A588 PolarHBondContact O-N 3.06Å; I586-A588 VanDerWaalsContact C-N 3.28Å; I586-A588 PolarHBondContact O-N 3.34Å; A588-D593 HydrophobicContact CB-CB 4.11Å; A588-R594 HydrophobicContact CB-CB 4.46Å; A588-R594 HydrophobicContact CB-CG 3.47Å; A588-R594 VanDerWaalsContact CB-CG 3.47Å
589	K	77.9	Confident	79.5	Confident	82 Å²	82	54.4 Å²	54.4	36%	0.357	26%	0.261	S	S	.	.			trans	-77	-37.7	-171.8	-58.6	171.5	171.1	-167.8	0	112.6	P301 M587	P301-K589 WeakPolarHBondContact O-CD 3.42Å; P301-K589 PolarHBondContact O-NZ 3.36Å; M587-K589 PolarHBondContact O-N 3.07Å
590	T	80.8	Confident	78.9	Confident	5 Å²	5	53.5 Å²	53.5	3%	0.031	26%	0.257	C	S	.	.	S	Bend	trans	-132.9	162.2	-169.8	66	0	0	0	0	111.7	Y286 I299 Y324 A592 D593 R594	Y286-T590 WeakPolarHBondContact OH-CB 3.33Å; I299-T590 HydrophobicContact CB-CG2 4.07Å; I299-T590 HydrophobicContact CD1-CG2 4.04Å; I299-T590 HydrophobicContact CG2-CG2 4.18Å; Y324-T590 PolarHBondContact OH-OG1 3.42Å; T590-A592 PolarHBondContact O-N 2.93Å; T590-D593 WeakPolarHBondContact O-CB 3.38Å; T590-D593 PolarHBondContact O-N 2.83Å; T590-D593 VanDerWaalsContact O-N 3.12Å; T590-D593 PolarHBondContact OG1-N 3.48Å; T590-D593 VanDerWaalsContact OG1-N 3.1Å; T590-D593 PolarHBondContact OG1-OD2 3.07Å; T590-D593 VanDerWaalsContact OG1-OD2 3.09Å; T590-R594 PolarHBondContact O-N 3.47Å; T590-R594 VanDerWaalsContact O-N 3.07Å
591	A	80.2	Confident	78.3	Confident	34 Å²	34	50.6 Å²	50.6	28%	0.281	24%	0.242	S	C	.	.	H	α-helix	trans	-58.3	-37.4	173.9	0	0	0	0	0	112.3	Y285 Y286 R594 R595	Y285-A591 HydrophobicContact CE1-CB 4.47Å; Y286-A591 PolarHBondContact OH-N 2.86Å; A591-R594 PolarHBondContact O-N 3.5Å; A591-R595 PolarHBondContact O-N 3.21Å
592	A	79.4	Confident	77.8	Confident	2 Å²	2	50.6 Å²	50.6	2%	0.017	25%	0.245	C	C	.	.	H	α-helix	trans	-67.5	-38.8	174.4	0	0	0	0	0	112.7	Y285 Y286 T590 R594 R595 N596	Y285-A592 HydrophobicContact CD1-CB 3.85Å; Y285-A592 HydrophobicContact CE1-CB 4.41Å; Y286-A592 HydrophobicContact CD2-CB 4.1Å; Y286-A592 HydrophobicContact CE2-CB 3.34Å; Y286-A592 PolarHBondContact OH-N 3.46Å; T590-A592 PolarHBondContact O-N 2.93Å; A592-R594 VanDerWaalsContact C-N 3.31Å; A592-R594 PolarHBondContact O-N 3.37Å; A592-R595 PolarHBondContact O-N 2.98Å; A592-N596 PolarHBondContact O-N 3.41Å; A592-N596 PolarHBondContact O-ND2 2.92Å
593	D	78.5	Confident	77.4	Confident	18 Å²	18	51.3 Å²	51.3	10%	0.096	24%	0.243	C	C	.	.	H	α-helix	trans	-61.9	-38.9	174.2	-80.9	-44.9	0	0	0	112	K278 A588 T590 R595 N596 V597	K278-D593 WeakPolarHBondContact CE-OD1 3.48Å; K278-D593 IonicContact NZ-OD1 2.96Å; K278-D593 PolarHBondContact NZ-OD1 3.33Å; K278-D593 VanDerWaalsContact NZ-OD1 3.1Å; A588-D593 HydrophobicContact CB-CB 4.11Å; T590-D593 WeakPolarHBondContact O-CB 3.38Å; T590-D593 PolarHBondContact O-N 2.83Å; T590-D593 VanDerWaalsContact O-N 3.12Å; T590-D593 PolarHBondContact OG1-N 3.48Å; T590-D593 VanDerWaalsContact OG1-N 3.1Å; T590-D593 PolarHBondContact OG1-OD2 3.07Å; T590-D593 VanDerWaalsContact OG1-OD2 3.09Å; D593-R595 PolarHBondContact O-N 3.5Å; D593-N596 WeakPolarHBondContact O-CB 3.42Å; D593-N596 PolarHBondContact O-N 2.94Å; D593-V597 VanDerWaalsContact O-CG2 3.28Å; D593-V597 WeakPolarHBondContact O-CG2 3.5Å; D593-V597 PolarHBondContact O-N 2.72Å
594	R	79.4	Confident	77.3	Confident	105 Å²	105	49.9 Å²	49.9	40%	0.396	24%	0.237	S	C	.	.	H	α-helix	trans	-62	-42.4	174.3	-69.6	-179	75.1	-130.2	6.1	111.8	M585 A588 T590 A591 A592 V597 K598	M585-R594 HydrophobicContact CE-CB 4.32Å; M585-R594 HydrophobicContact SD-CB 4.19Å; M585-R594 HydrophobicContact SD-CG 4.39Å; A588-R594 HydrophobicContact CB-CB 4.46Å; A588-R594 HydrophobicContact CB-CG 3.47Å; A588-R594 VanDerWaalsContact CB-CG 3.47Å; T590-R594 PolarHBondContact O-N 3.47Å; T590-R594 VanDerWaalsContact O-N 3.07Å; A591-R594 PolarHBondContact O-N 3.5Å; A592-R594 VanDerWaalsContact C-N 3.31Å; A592-R594 PolarHBondContact O-N 3.37Å; R594-V597 PolarHBondContact O-N 3.34Å; R594-K598 WeakPolarHBondContact O-CG 3.16Å; R594-K598 PolarHBondContact O-N 3.07Å
595	R	77.7	Confident	77.4	Confident	76 Å²	76	45.2 Å²	45.2	29%	0.287	22%	0.22	S	C	.	.	H	α-helix	trans	-62.9	-43.7	174.1	-171.4	178.4	-179	-154.2	-1.5	111.2	E86 E90 A591 A592 D593 V597 K598 Q599	E86-R595 IonicContact OE1-CZ 3.75Å; E86-R595 IonicContact OE1-NE 3.81Å; E86-R595 PolarHBondContact OE1-NE 3.15Å; E86-R595 IonicContact OE1-NH2 3.61Å; E86-R595 PolarHBondContact OE1-NH2 2.93Å; E90-R595 IonicContact OE1-NH2 3.75Å; A591-R595 PolarHBondContact O-N 3.21Å; A592-R595 PolarHBondContact O-N 2.98Å; D593-R595 PolarHBondContact O-N 3.5Å; R595-V597 VanDerWaalsContact C-N 3.32Å; R595-V597 PolarHBondContact O-N 2.95Å; R595-K598 WeakPolarHBondContact O-CB 3.18Å; R595-K598 PolarHBondContact O-N 2.86Å; R595-Q599 WeakPolarHBondContact O-CG 3.48Å; R595-Q599 PolarHBondContact O-N 3.14Å
596	N	77.8	Confident	77.6	Confident	6 Å²	6	46.9 Å²	46.9	3%	0.032	23%	0.227	C	C	.	.	H	α-helix	trans	-61.8	-38.3	175.4	-73.5	-33.9	0	0	0	112.3	K278 S282 A592 D593 Q599 N600	K278-N596 HydrophobicContact CG-CB 4.37Å; S282-N596 PolarHBondContact OG-ND2 3.46Å; A592-N596 PolarHBondContact O-N 3.41Å; A592-N596 PolarHBondContact O-ND2 2.92Å; D593-N596 WeakPolarHBondContact O-CB 3.42Å; D593-N596 PolarHBondContact O-N 2.94Å; N596-Q599 PolarHBondContact O-N 3.3Å; N596-N600 WeakPolarHBondContact O-CB 3.38Å; N596-N600 PolarHBondContact O-N 2.85Å; N596-N600 PolarHBondContact O-ND2 3.44Å
597	V	78.9	Confident	78	Confident	27 Å²	27	42.9 Å²	42.9	16%	0.164	21%	0.207	C	C	.	.	H	α-helix	trans	-63.4	-45.4	174.3	169.7	0	0	0	0	110.2	Y581 R584 M585 D593 R594 R595 Q599 N600 Q601	Y581-V597 HydrophobicContact CD2-CG1 4.14Å; Y581-V597 HydrophobicContact CE2-CG1 4.12Å; R584-V597 HydrophobicContact CB-CG1 3.94Å; M585-V597 HydrophobicContact CG-CG1 4.09Å; M585-V597 HydrophobicContact SD-CB 4.2Å; M585-V597 HydrophobicContact SD-CG1 3.9Å; D593-V597 VanDerWaalsContact O-CG2 3.28Å; D593-V597 WeakPolarHBondContact O-CG2 3.5Å; D593-V597 PolarHBondContact O-N 2.72Å; R594-V597 PolarHBondContact O-N 3.34Å; R595-V597 VanDerWaalsContact C-N 3.32Å; R595-V597 PolarHBondContact O-N 2.95Å; V597-Q599 PolarHBondContact O-N 3.11Å; V597-N600 PolarHBondContact O-N 3.06Å; V597-Q601 WeakPolarHBondContact O-CB 3.26Å; V597-Q601 PolarHBondContact O-N 2.72Å
598	K	76.3	Confident	78.4	Confident	63 Å²	63	38.5 Å²	38.5	27%	0.274	19%	0.185	S	C	.	.	H	α-helix	trans	-57.9	-45.6	174.3	-70.7	-176.3	177.1	-164.5	0	112.2	D77 Y581 M585 R594 R595 N600 Q601	D77-K598 IonicContact OD2-NZ 2.7Å; D77-K598 PolarHBondContact OD2-NZ 3.34Å; Y581-K598 HydrophobicContact CE2-CG 4.39Å; Y581-K598 WeakPolarHBondContact OH-CG 3.45Å; M585-K598 HydrophobicContact CE-CG 4.41Å; M585-K598 HydrophobicContact SD-CG 4.31Å; R594-K598 WeakPolarHBondContact O-CG 3.16Å; R594-K598 PolarHBondContact O-N 3.07Å; R595-K598 WeakPolarHBondContact O-CB 3.18Å; R595-K598 PolarHBondContact O-N 2.86Å; K598-N600 PolarHBondContact O-N 2.79Å; K598-Q601 WeakPolarHBondContact O-CB 3.42Å; K598-Q601 PolarHBondContact O-N 3.41Å
599	Q	69.9	Low	78.8	Confident	29 Å²	29	38.1 Å²	38.1	14%	0.136	18%	0.182	C	C	.	.	H	α-helix	trans	-70.4	-28.7	-178.4	-72.1	-173.8	-4.1	0	0	114.1	L83 E86 R595 N596 V597	L83-Q599 HydrophobicContact CD2-CB 4.33Å; L83-Q599 WeakPolarHBondContact CD2-O 3.37Å; E86-Q599 VanDerWaalsContact CD-NE2 3.34Å; E86-Q599 PolarHBondContact OE1-NE2 3.3Å; E86-Q599 WeakPolarHBondContact OE2-CG 3.5Å; E86-Q599 PolarHBondContact OE2-NE2 2.96Å; R595-Q599 WeakPolarHBondContact O-CG 3.48Å; R595-Q599 PolarHBondContact O-N 3.14Å; N596-Q599 PolarHBondContact O-N 3.3Å; V597-Q599 PolarHBondContact O-N 3.11Å
600	N	69.1	Low	79.3	Confident	91 Å²	91	35 Å²	35	49%	0.487	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	15.1	-178.4	-66.5	-27.3	0	0	0	112.7	N596 V597 K598	N596-N600 WeakPolarHBondContact O-CB 3.38Å; N596-N600 PolarHBondContact O-N 2.85Å; N596-N600 PolarHBondContact O-ND2 3.44Å; V597-N600 PolarHBondContact O-N 3.06Å; K598-N600 PolarHBondContact O-N 2.79Å
601	Q	66.9	Low	79.9	Confident	6 Å²	6	34.8 Å²	34.8	3%	0.028	17%	0.167	C	C	.	.			trans	-89.7	-17.8	-173.3	-168.1	58.1	20.4	0	0	114	Y78 Y581 V597 K598 F603	Y78-Q601 HydrophobicContact CD2-CG 4.01Å; Y78-Q601 HydrophobicContact CE2-CG 3.57Å; Y581-Q601 HydrophobicContact CD2-CB 4.47Å; Y581-Q601 HydrophobicContact CD2-CG 3.72Å; Y581-Q601 HydrophobicContact CE2-CG 4.26Å; Y581-Q601 HydrophobicContact CG-CG 4.38Å; V597-Q601 WeakPolarHBondContact O-CB 3.26Å; V597-Q601 PolarHBondContact O-N 2.72Å; K598-Q601 WeakPolarHBondContact O-CB 3.42Å; K598-Q601 PolarHBondContact O-N 3.41Å; Q601-F603 WeakPolarHBondContact O-CD2 3.42Å; Q601-F603 WeakPolarHBondContact O-CE2 3.37Å; Q601-F603 PolarHBondContact O-N 2.8Å
602	A	68.4	Low	80.5	Confident	17 Å²	17	33.1 Å²	33.1	14%	0.14	15%	0.154	C	C	.	.	P	Polyproline II helix	trans	-71.7	125.4	176.7	0	0	0	0	0	109.8	L83 L655	L83-A602 HydrophobicContact CD1-CB 3.38Å; L83-A602 HydrophobicContact CG-CB 4.38Å; A602-L655 HydrophobicContact CB-CD1 3.59Å; A602-L655 HydrophobicContact CB-CG 3.82Å; A602-L655 WeakPolarHBondContact O-CD1 3.41Å
603	F	74.1	Confident	80.9	Confident	84 Å²	84	36.2 Å²	36.2	37%	0.368	17%	0.165	S	C	.	.	P	Polyproline II helix	trans	-100.4	155.1	176	-63	-81.3	0	0	0	109.7	Q601 Y654 L655	Q601-F603 WeakPolarHBondContact O-CD2 3.42Å; Q601-F603 WeakPolarHBondContact O-CE2 3.37Å; Q601-F603 PolarHBondContact O-N 2.8Å; F603-Y654 HydrophobicContact CB-CD1 4.49Å; F603-Y654 HydrophobicContact CB-CE1 4.44Å; F603-Y654 WeakPolarHBondContact O-CD1 3.26Å; F603-L655 PolarHBondContact O-N 2.97Å
604	Q	81.4	Confident	81.6	Confident	86 Å²	86	35.4 Å²	35.4	40%	0.402	16%	0.161	S	C	.	.	B	Isolated β-bridge	trans	-71.3	149.1	166.6	-69.2	-175.2	-37.6	0	0	109.1	E606 L655 A657	Q604-E606 PolarHBondContact O-N 2.83Å; Q604-L655 HydrophobicContact CG-CB 4.38Å; Q604-A657 HydrophobicContact CB-CB 4.28Å
605	Y	84.4	Confident	82.3	Confident	7 Å²	7	30.4 Å²	30.4	3%	0.027	14%	0.142	C	C	.	.	P	Polyproline II helix	trans	-69.6	126.2	176.5	-169.5	-105	0	0	0	110.2	Y139 F607 M610 D646 L650 Y654	Y139-Y605 HydrophobicContact CD1-CE1 4.49Å; Y139-Y605 HydrophobicContact CE1-CE1 4.26Å; Y139-Y605 PolarHBondContact OH-OH 3.43Å; Y605-F607 VanDerWaalsContact C-N 3.34Å; Y605-F607 AromaticContact CD1-CD1 3.68Å; Y605-F607 HydrophobicContact CD1-CD1 3.68Å; Y605-F607 AromaticContact CD1-CD2 3.83Å; Y605-F607 HydrophobicContact CD1-CD2 3.83Å; Y605-F607 AromaticContact CD1-CE1 3.69Å; Y605-F607 HydrophobicContact CD1-CE1 3.69Å; Y605-F607 AromaticContact CD1-CE2 3.87Å; Y605-F607 HydrophobicContact CD1-CE2 3.87Å; Y605-F607 AromaticContact CD1-CG 3.77Å; Y605-F607 HydrophobicContact CD1-CG 3.77Å; Y605-F607 AromaticContact CD1-CZ 3.8Å; Y605-F607 HydrophobicContact CD1-CZ 3.8Å; Y605-F607 AromaticContact CE1-CD1 3.9Å; Y605-F607 HydrophobicContact CE1-CD1 3.9Å; Y605-F607 HydrophobicContact CE1-CE1 4.04Å; Y605-F607 HydrophobicContact CE1-CG 4.3Å; Y605-F607 HydrophobicContact CG-CE2 4.48Å; Y605-F607 VanDerWaalsContact O-CD2 3.3Å; Y605-F607 WeakPolarHBondContact O-CD2 3.35Å; Y605-F607 PolarHBondContact O-N 3.22Å; Y605-M610 HydrophobicContact CE1-CB 4.12Å; Y605-M610 HydrophobicContact CE1-CG 3.93Å; Y605-M610 HydrophobicContact CE2-CG 4.15Å; Y605-D646 PolarHBondContact OH-OD1 2.83Å; Y605-L650 HydrophobicContact CD1-CD2 3.56Å; Y605-L650 HydrophobicContact CD1-CG 4.48Å; Y605-L650 HydrophobicContact CD2-CD2 3.73Å; Y605-L650 HydrophobicContact CD2-CG 4.24Å; Y605-L650 HydrophobicContact CE1-CD2 3.89Å; Y605-L650 HydrophobicContact CE1-CG 4.37Å; Y605-L650 HydrophobicContact CE2-CD2 4.05Å; Y605-L650 HydrophobicContact CE2-CG 4.13Å; Y605-L650 HydrophobicContact CG-CD2 3.45Å; Y605-L650 VanDerWaalsContact CG-CD2 3.45Å; Y605-L650 HydrophobicContact CG-CG 4.39Å; Y605-Y654 HydrophobicContact CD2-CD1 4.14Å; Y605-Y654 AromaticContact CD2-CD2 3.49Å; Y605-Y654 HydrophobicContact CD2-CD2 3.49Å; Y605-Y654 VanDerWaalsContact CD2-CD2 3.49Å; Y605-Y654 HydrophobicContact CD2-CE1 4.33Å; Y605-Y654 AromaticContact CD2-CE2 3.73Å; Y605-Y654 HydrophobicContact CD2-CE2 3.73Å; Y605-Y654 AromaticContact CD2-CG 3.71Å; Y605-Y654 HydrophobicContact CD2-CG 3.71Å; Y605-Y654 HydrophobicContact CE2-CD2 4.17Å; Y605-Y654 HydrophobicContact CE2-CE2 4.1Å; Y605-Y654 HydrophobicContact CG-CG 4.36Å
606	E	86.3	Confident	83	Confident	56 Å²	56	26.8 Å²	26.8	26%	0.262	13%	0.129	S	C	.	.			trans	-86.9	72.9	-175.1	-63.7	178.6	162	0	0	110.7	Y484 Q604 G608 A609 M610	Y484-E606 PolarHBondContact OH-OE1 2.76Å; Q604-E606 PolarHBondContact O-N 2.83Å; E606-G608 PolarHBondContact O-N 2.98Å; E606-G608 VanDerWaalsContact O-N 3.11Å; E606-A609 PolarHBondContact O-N 3.42Å; E606-M610 VanDerWaalsContact O-CG 3.31Å; E606-M610 WeakPolarHBondContact O-CG 3.32Å; E606-M610 PolarHBondContact O-N 3.24Å
607	F	89.6	Confident	83.7	Confident	4 Å²	4	26.7 Å²	26.7	2%	0.018	13%	0.128	C	C	.	.	H	α-helix	trans	-51	-39.5	-176.3	-72.7	-86.1	0	0	0	112.9	D135 Y139 Y605 A609 M610 Y611 L650 A657 L659 I663	D135-F607 HydrophobicContact CB-CE2 4.43Å; D135-F607 HydrophobicContact CB-CZ 4.07Å; Y139-F607 AromaticContact CD2-CD1 3.92Å; Y139-F607 HydrophobicContact CD2-CD1 3.92Å; Y139-F607 HydrophobicContact CD2-CE1 4.36Å; Y139-F607 HydrophobicContact CG-CD1 4.07Å; Y139-F607 HydrophobicContact CG-CE1 4.04Å; Y605-F607 VanDerWaalsContact C-N 3.34Å; Y605-F607 AromaticContact CD1-CD1 3.68Å; Y605-F607 HydrophobicContact CD1-CD1 3.68Å; Y605-F607 AromaticContact CD1-CD2 3.83Å; Y605-F607 HydrophobicContact CD1-CD2 3.83Å; Y605-F607 AromaticContact CD1-CE1 3.69Å; Y605-F607 HydrophobicContact CD1-CE1 3.69Å; Y605-F607 AromaticContact CD1-CE2 3.87Å; Y605-F607 HydrophobicContact CD1-CE2 3.87Å; Y605-F607 AromaticContact CD1-CG 3.77Å; Y605-F607 HydrophobicContact CD1-CG 3.77Å; Y605-F607 AromaticContact CD1-CZ 3.8Å; Y605-F607 HydrophobicContact CD1-CZ 3.8Å; Y605-F607 AromaticContact CE1-CD1 3.9Å; Y605-F607 HydrophobicContact CE1-CD1 3.9Å; Y605-F607 HydrophobicContact CE1-CE1 4.04Å; Y605-F607 HydrophobicContact CE1-CG 4.3Å; Y605-F607 HydrophobicContact CG-CE2 4.48Å; Y605-F607 VanDerWaalsContact O-CD2 3.3Å; Y605-F607 WeakPolarHBondContact O-CD2 3.35Å; Y605-F607 PolarHBondContact O-N 3.22Å; F607-A609 PolarHBondContact O-N 3.36Å; F607-M610 PolarHBondContact O-N 3.13Å; F607-Y611 HydrophobicContact CB-CD2 4.26Å; F607-Y611 HydrophobicContact CB-CE2 4.3Å; F607-Y611 HydrophobicContact CD1-CE2 4.34Å; F607-Y611 WeakPolarHBondContact O-CB 3.24Å; F607-Y611 WeakPolarHBondContact O-CD2 3.42Å; F607-Y611 PolarHBondContact O-N 2.87Å; F607-L650 HydrophobicContact CZ-CD2 4.3Å; F607-A657 HydrophobicContact CE2-CB 4.19Å; F607-L659 HydrophobicContact CB-CD1 3.86Å; F607-L659 HydrophobicContact CD2-CD1 3.29Å; F607-L659 HydrophobicContact CD2-CG 4.47Å; F607-L659 HydrophobicContact CE2-CD1 4.01Å; F607-L659 HydrophobicContact CG-CD1 3.78Å; F607-I663 HydrophobicContact CB-CD1 3.69Å
608	G	89.6	Confident	84.5	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-60.8	-47.1	-177.3	0	0	0	0	0	113.8	N499 M503 E606 A612	N499-G608 WeakPolarHBondContact O-CA 3.31Å; N499-G608 PolarHBondContact OD1-N 3.21Å; M503-G608 VanDerWaalsContact CA-O 3.31Å; M503-G608 WeakPolarHBondContact CA-O 3.25Å; M503-G608 VanDerWaalsContact CB-O 3.31Å; M503-G608 WeakPolarHBondContact CB-O 3.46Å; M503-G608 WeakPolarHBondContact CG-O 3.24Å; E606-G608 PolarHBondContact O-N 2.98Å; E606-G608 VanDerWaalsContact O-N 3.11Å; G608-A612 WeakPolarHBondContact O-CB 3.44Å; G608-A612 PolarHBondContact O-N 3.36Å
609	A	87.7	Confident	85.3	Confident	3 Å²	3	22.5 Å²	22.5	3%	0.025	11%	0.108	C	C	.	.	H	α-helix	trans	-69.8	-41	178.9	0	0	0	0	0	111.8	V502 E606 F607 A612 W613	V502-A609 HydrophobicContact CG1-CB 4.28Å; E606-A609 PolarHBondContact O-N 3.42Å; F607-A609 PolarHBondContact O-N 3.36Å; A609-A612 PolarHBondContact O-N 3.13Å; A609-W613 PolarHBondContact O-N 3.11Å
610	M	90	Very high	86.3	Confident	15 Å²	15	21.1 Å²	21.1	7%	0.074	10%	0.101	C	C	.	.	H	α-helix	trans	-66.1	-42.5	-178.3	-59.9	-62.9	142.7	0	0	112	Y139 Y605 E606 F607 W613 M614	Y139-M610 HydrophobicContact CE2-CB 4.35Å; Y605-M610 HydrophobicContact CE1-CB 4.12Å; Y605-M610 HydrophobicContact CE1-CG 3.93Å; Y605-M610 HydrophobicContact CE2-CG 4.15Å; E606-M610 VanDerWaalsContact O-CG 3.31Å; E606-M610 WeakPolarHBondContact O-CG 3.32Å; E606-M610 PolarHBondContact O-N 3.24Å; F607-M610 PolarHBondContact O-N 3.13Å; M610-W613 HydrophobicContact CE-CE3 4.06Å; M610-W613 HydrophobicContact CE-CH2 4.27Å; M610-W613 HydrophobicContact CE-CZ3 3.42Å; M610-W613 VanDerWaalsContact CE-CZ3 3.42Å; M610-W613 HydrophobicContact SD-CE3 3.98Å; M610-W613 HydrophobicContact SD-CZ3 3.94Å; M610-M614 WeakPolarHBondContact O-CB 3.31Å; M610-M614 PolarHBondContact O-N 3.26Å
611	Y	92.8	Very high	87.6	Confident	1 Å²	1	16.8 Å²	16.8	0%	0.004	8%	0.078	C	C	.	.	H	α-helix	trans	-58.2	-48	171	-86.7	-61.7	0	0	0	111.3	Y139 F142 M503 F607 W613 M614 L615 I663 H664 A667	Y139-Y611 WeakPolarHBondContact CA-OH 3.47Å; Y139-Y611 HydrophobicContact CD2-CD1 4.03Å; Y139-Y611 HydrophobicContact CD2-CD2 4.1Å; Y139-Y611 AromaticContact CD2-CE1 3.55Å; Y139-Y611 HydrophobicContact CD2-CE1 3.55Å; Y139-Y611 AromaticContact CD2-CE2 3.63Å; Y139-Y611 HydrophobicContact CD2-CE2 3.63Å; Y139-Y611 HydrophobicContact CD2-CG 4.28Å; Y139-Y611 AromaticContact CD2-CZ 3.33Å; Y139-Y611 AromaticContact CE2-CD1 3.89Å; Y139-Y611 HydrophobicContact CE2-CD1 3.89Å; Y139-Y611 HydrophobicContact CE2-CD2 4.25Å; Y139-Y611 AromaticContact CE2-CE1 3.87Å; Y139-Y611 HydrophobicContact CE2-CE1 3.87Å; Y139-Y611 HydrophobicContact CE2-CE2 4.23Å; Y139-Y611 HydrophobicContact CE2-CG 4.07Å; F142-Y611 HydrophobicContact CD1-CD1 4.11Å; F142-Y611 AromaticContact CD1-CE1 3.55Å; F142-Y611 HydrophobicContact CD1-CE1 3.55Å; F142-Y611 AromaticContact CE1-CD1 3.99Å; F142-Y611 HydrophobicContact CE1-CD1 3.99Å; F142-Y611 AromaticContact CE1-CE1 3.84Å; F142-Y611 HydrophobicContact CE1-CE1 3.84Å; F142-Y611 HydrophobicContact CG-CE1 4.16Å; M503-Y611 HydrophobicContact SD-CD2 4.29Å; M503-Y611 HydrophobicContact SD-CG 4.14Å; F607-Y611 HydrophobicContact CB-CD2 4.26Å; F607-Y611 HydrophobicContact CB-CE2 4.3Å; F607-Y611 HydrophobicContact CD1-CE2 4.34Å; F607-Y611 WeakPolarHBondContact O-CB 3.24Å; F607-Y611 WeakPolarHBondContact O-CD2 3.42Å; F607-Y611 PolarHBondContact O-N 2.87Å; Y611-W613 PolarHBondContact O-N 3.3Å; Y611-M614 HydrophobicContact CD1-CE 3.85Å; Y611-M614 HydrophobicContact CE1-CE 4.38Å; Y611-M614 PolarHBondContact O-N 3.39Å; Y611-L615 WeakPolarHBondContact O-CB 3.39Å; Y611-L615 WeakPolarHBondContact O-CG 3.08Å; Y611-L615 PolarHBondContact O-N 3.07Å; Y611-I663 HydrophobicContact CD2-CD1 4.39Å; Y611-I663 HydrophobicContact CD2-CG1 4.29Å; Y611-I663 HydrophobicContact CE2-CG1 4.38Å; Y611-H664 AromaticContact CZ-ND1 3.88Å; Y611-H664 PolarHBondContact OH-CE1 3.45Å; Y611-H664 VanDerWaalsContact OH-CE1 3.3Å; Y611-H664 PolarHBondContact OH-ND1 3.48Å; Y611-A667 HydrophobicContact CD1-CB 3.54Å; Y611-A667 HydrophobicContact CD2-CB 4.37Å; Y611-A667 HydrophobicContact CE1-CB 3.61Å; Y611-A667 HydrophobicContact CE2-CB 4.44Å; Y611-A667 HydrophobicContact CG-CB 3.95Å
612	A	91.7	Very high	88.8	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-62.4	-43.4	-175.9	0	0	0	0	0	113.2	M503 V506 G608 A609 C616	M503-A612 HydrophobicContact CG-CB 4.24Å; M503-A612 WeakPolarHBondContact O-CB 3.41Å; V506-A612 HydrophobicContact CB-CB 3.77Å; V506-A612 HydrophobicContact CG1-CB 3.62Å; G608-A612 WeakPolarHBondContact O-CB 3.44Å; G608-A612 PolarHBondContact O-N 3.36Å; A609-A612 PolarHBondContact O-N 3.13Å; A612-C616 VanDerWaalsContact O-CB 3.26Å; A612-C616 WeakPolarHBondContact O-CB 3.11Å; A612-C616 PolarHBondContact O-N 3.31Å
613	W	88.3	Confident	89.9	Confident	67 Å²	67	15.8 Å²	15.8	25%	0.254	7%	0.071	S	C	.	.	H	α-helix	trans	-63.5	-49.5	176.8	-72.1	-36	0	0	0	112.4	P480 L510 A609 M610 Y611 L615 C616 V617	P480-W613 HydrophobicContact CB-CZ2 3.52Å; P480-W613 HydrophobicContact CG-CZ2 4.42Å; L510-W613 HydrophobicContact CD1-CG 4.5Å; A609-W613 PolarHBondContact O-N 3.11Å; M610-W613 HydrophobicContact CE-CE3 4.06Å; M610-W613 HydrophobicContact CE-CH2 4.27Å; M610-W613 HydrophobicContact CE-CZ3 3.42Å; M610-W613 VanDerWaalsContact CE-CZ3 3.42Å; M610-W613 HydrophobicContact SD-CE3 3.98Å; M610-W613 HydrophobicContact SD-CZ3 3.94Å; Y611-W613 PolarHBondContact O-N 3.3Å; W613-L615 VanDerWaalsContact C-N 3.34Å; W613-L615 PolarHBondContact O-N 2.85Å; W613-C616 WeakPolarHBondContact O-CB 3.38Å; W613-C616 PolarHBondContact O-N 3.12Å; W613-V617 PolarHBondContact O-N 3.34Å; W613-V617 VanDerWaalsContact O-N 3.11Å
614	M	93.7	Very high	90.6	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-61.2	-44.3	178.9	177.9	-168.2	66.1	0	0	111.4	F142 Q143 I146 M610 Y611 V617 F618 I639	F142-M614 HydrophobicContact CD1-CE 3.66Å; F142-M614 HydrophobicContact CE1-CE 3.44Å; F142-M614 VanDerWaalsContact CE1-CE 3.44Å; Q143-M614 HydrophobicContact CG-CE 4.49Å; Q143-M614 HydrophobicContact CG-SD 3.6Å; Q143-M614 VanDerWaalsContact CG-SD 3.6Å; I146-M614 HydrophobicContact CD1-CE 4.27Å; M610-M614 WeakPolarHBondContact O-CB 3.31Å; M610-M614 PolarHBondContact O-N 3.26Å; Y611-M614 HydrophobicContact CD1-CE 3.85Å; Y611-M614 HydrophobicContact CE1-CE 4.38Å; Y611-M614 PolarHBondContact O-N 3.39Å; M614-V617 PolarHBondContact O-N 3.41Å; M614-F618 WeakPolarHBondContact O-CB 3.48Å; M614-F618 PolarHBondContact O-N 3.31Å; M614-I639 HydrophobicContact CG-CD1 3.54Å; M614-I639 HydrophobicContact SD-CD1 3.73Å
615	L	94.2	Very high	91.1	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-69	-32.3	178.9	-73	171.3	0	0	0	112.8	F142 I146 Y507 Y611 W613 F618 T619 A667 Q670 A671	F142-L615 HydrophobicContact CE1-CD2 4Å; F142-L615 HydrophobicContact CZ-CD2 3.91Å; I146-L615 HydrophobicContact CD1-CD2 4.28Å; Y507-L615 HydrophobicContact CD2-CB 3.97Å; Y507-L615 HydrophobicContact CE2-CB 3.82Å; Y611-L615 WeakPolarHBondContact O-CB 3.39Å; Y611-L615 WeakPolarHBondContact O-CG 3.08Å; Y611-L615 PolarHBondContact O-N 3.07Å; W613-L615 VanDerWaalsContact C-N 3.34Å; W613-L615 PolarHBondContact O-N 2.85Å; L615-F618 HydrophobicContact CD2-CD1 4.35Å; L615-T619 VanDerWaalsContact O-CB 3.31Å; L615-T619 WeakPolarHBondContact O-CB 3.44Å; L615-T619 PolarHBondContact O-N 3.44Å; L615-T619 PolarHBondContact O-OG1 3.47Å; L615-A667 HydrophobicContact CD1-CB 4.12Å; L615-Q670 HydrophobicContact CD1-CB 3.84Å; L615-A671 HydrophobicContact CD2-CB 3.82Å
616	C	91.6	Very high	91.4	Very high	1 Å²	1	7.8 Å²	7.8	1%	0.007	3%	0.034	C	C	.	.	H	α-helix	trans	-62.5	-51.9	172.9	-179.7	0	0	0	0	110.7	L510 A612 W613 F618 T619 V620	L510-C616 HydrophobicContact CB-CB 4.16Å; L510-C616 HydrophobicContact CD1-CB 4.25Å; A612-C616 VanDerWaalsContact O-CB 3.26Å; A612-C616 WeakPolarHBondContact O-CB 3.11Å; A612-C616 PolarHBondContact O-N 3.31Å; W613-C616 WeakPolarHBondContact O-CB 3.38Å; W613-C616 PolarHBondContact O-N 3.12Å; C616-F618 VanDerWaalsContact C-N 3.34Å; C616-F618 PolarHBondContact O-N 3.27Å; C616-T619 WeakPolarHBondContact O-CB 3.35Å; C616-T619 PolarHBondContact O-N 3.01Å; C616-T619 VanDerWaalsContact O-N 3.08Å; C616-V620 WeakPolarHBondContact O-CG2 3.38Å; C616-V620 PolarHBondContact O-N 3.42Å
617	V	92.6	Very high	91.4	Very high	4 Å²	4	5.6 Å²	5.6	2%	0.024	3%	0.025	C	C	.	.	H	α-helix	trans	-62.8	-42.1	178	179.6	0	0	0	0	110.6	Y559 W613 M614 T619 V620 I621 Y638	Y559-V617 HydrophobicContact CE1-CG2 4.35Å; W613-V617 PolarHBondContact O-N 3.34Å; W613-V617 VanDerWaalsContact O-N 3.11Å; M614-V617 PolarHBondContact O-N 3.41Å; V617-T619 VanDerWaalsContact C-N 3.29Å; V617-T619 PolarHBondContact O-N 3.32Å; V617-V620 PolarHBondContact O-N 2.81Å; V617-I621 HydrophobicContact CG1-CD1 3.87Å; V617-I621 HydrophobicContact CG1-CG1 4.41Å; V617-I621 WeakPolarHBondContact O-CD1 3.36Å; V617-I621 VanDerWaalsContact O-CG1 3.23Å; V617-I621 WeakPolarHBondContact O-CG1 3.45Å; V617-I621 PolarHBondContact O-N 3.01Å; V617-Y638 HydrophobicContact CB-CD1 4.15Å; V617-Y638 HydrophobicContact CB-CE1 3.66Å; V617-Y638 HydrophobicContact CB-CE2 4.39Å; V617-Y638 HydrophobicContact CG1-CD1 3.57Å; V617-Y638 HydrophobicContact CG1-CD2 4.1Å; V617-Y638 HydrophobicContact CG1-CE1 3.62Å; V617-Y638 HydrophobicContact CG1-CE2 4.18Å; V617-Y638 HydrophobicContact CG1-CG 3.84Å; V617-Y638 HydrophobicContact CG2-CE1 4.22Å; V617-Y638 HydrophobicContact CG2-CE2 4.14Å
618	F	95.8	Very high	91.4	Very high	2 Å²	2	5.5 Å²	5.5	1%	0.009	3%	0.025	C	C	.	.	H	α-helix	trans	-56.3	-42.4	171.7	174	-108.6	0	0	0	112.3	I146 L149 L150 M614 L615 C616 I621 M622 A671 A674	I146-F618 HydrophobicContact CG2-CD2 3.69Å; I146-F618 HydrophobicContact CG2-CE2 3.94Å; I146-F618 HydrophobicContact CG2-CG 4.37Å; L149-F618 HydrophobicContact CD2-CE2 4.02Å; L149-F618 HydrophobicContact CD2-CZ 3.72Å; L150-F618 HydrophobicContact CD1-CD2 4.16Å; L150-F618 HydrophobicContact CD2-CD2 4.23Å; L150-F618 HydrophobicContact CD2-CE2 4.14Å; L150-F618 HydrophobicContact CG-CD2 4.23Å; L150-F618 HydrophobicContact CG-CE2 4.18Å; M614-F618 WeakPolarHBondContact O-CB 3.48Å; M614-F618 PolarHBondContact O-N 3.31Å; L615-F618 HydrophobicContact CD2-CD1 4.35Å; C616-F618 VanDerWaalsContact C-N 3.34Å; C616-F618 PolarHBondContact O-N 3.27Å; F618-I621 PolarHBondContact O-N 2.69Å; F618-M622 HydrophobicContact CD1-CG 4.38Å; F618-M622 HydrophobicContact CD2-CG 4.12Å; F618-M622 HydrophobicContact CE1-CG 3.92Å; F618-M622 HydrophobicContact CE2-CG 3.62Å; F618-M622 HydrophobicContact CE2-SD 3.85Å; F618-M622 HydrophobicContact CG-CG 4.48Å; F618-M622 HydrophobicContact CZ-CG 3.51Å; F618-M622 HydrophobicContact CZ-SD 3.95Å; F618-M622 WeakPolarHBondContact O-CG 3.33Å; F618-M622 PolarHBondContact O-N 2.88Å; F618-A671 HydrophobicContact CE1-CB 4.26Å; F618-A674 HydrophobicContact CD1-CB 3.98Å; F618-A674 HydrophobicContact CE1-CB 3.71Å
619	T	94	Very high	91.5	Very high	0 Å²	0	5.5 Å²	5.5	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-65.4	-41	177.6	-58.6	0	0	0	0	111.8	Y507 I511 L515 L615 C616 V617 M622 A623 A674 L677	Y507-T619 PolarHBondContact OH-OG1 3.48Å; I511-T619 HydrophobicContact CD1-CG2 3.78Å; I511-T619 HydrophobicContact CG1-CG2 4.39Å; L515-T619 HydrophobicContact CD2-CG2 4.27Å; L615-T619 VanDerWaalsContact O-CB 3.31Å; L615-T619 WeakPolarHBondContact O-CB 3.44Å; L615-T619 PolarHBondContact O-N 3.44Å; L615-T619 PolarHBondContact O-OG1 3.47Å; C616-T619 WeakPolarHBondContact O-CB 3.35Å; C616-T619 PolarHBondContact O-N 3.01Å; C616-T619 VanDerWaalsContact O-N 3.08Å; V617-T619 VanDerWaalsContact C-N 3.29Å; V617-T619 PolarHBondContact O-N 3.32Å; T619-M622 PolarHBondContact O-N 3.09Å; T619-A623 VanDerWaalsContact O-CB 3.22Å; T619-A623 WeakPolarHBondContact O-CB 3.25Å; T619-A623 PolarHBondContact O-N 3.22Å; T619-A674 HydrophobicContact CG2-CB 4.18Å; T619-L677 HydrophobicContact CG2-CD1 3.6Å
620	V	91.1	Very high	91.7	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-60.7	-46.1	173.6	172.8	0	0	0	0	110.6	V514 L515 F556 Y559 V560 C616 V617 A623 Y624	V514-V620 HydrophobicContact CG1-CG2 4.16Å; L515-V620 HydrophobicContact CD1-CG2 4.33Å; F556-V620 HydrophobicContact CB-CG1 4.4Å; F556-V620 HydrophobicContact CD1-CG1 3.65Å; F556-V620 HydrophobicContact CE1-CG1 4.35Å; F556-V620 HydrophobicContact CG-CG1 4.36Å; Y559-V620 HydrophobicContact CD1-CG1 4.44Å; Y559-V620 HydrophobicContact CE1-CG2 4.4Å; V560-V620 HydrophobicContact CG2-CG1 4.19Å; C616-V620 WeakPolarHBondContact O-CG2 3.38Å; C616-V620 PolarHBondContact O-N 3.42Å; V617-V620 PolarHBondContact O-N 2.81Å; V620-A623 PolarHBondContact O-N 3.44Å; V620-Y624 HydrophobicContact CG1-CD2 4.44Å; V620-Y624 PolarHBondContact O-N 3.05Å
621	I	94.5	Very high	91.8	Very high	0 Å²	0	5.8 Å²	5.8	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-59.8	-50.1	177.8	-64.1	156.2	0	0	0	110.1	L150 V560 V617 F618 A623 Y624 S625 V631	L150-I621 HydrophobicContact CD1-CD1 4.41Å; L150-I621 HydrophobicContact CD2-CG2 3.65Å; V560-I621 HydrophobicContact CG1-CG1 4.37Å; V560-I621 HydrophobicContact CG2-CG1 4.26Å; V617-I621 HydrophobicContact CG1-CD1 3.87Å; V617-I621 HydrophobicContact CG1-CG1 4.41Å; V617-I621 WeakPolarHBondContact O-CD1 3.36Å; V617-I621 VanDerWaalsContact O-CG1 3.23Å; V617-I621 WeakPolarHBondContact O-CG1 3.45Å; V617-I621 PolarHBondContact O-N 3.01Å; F618-I621 PolarHBondContact O-N 2.69Å; I621-A623 PolarHBondContact O-N 3.34Å; I621-Y624 PolarHBondContact O-N 3.4Å; I621-S625 WeakPolarHBondContact O-CA 3.26Å; I621-S625 WeakPolarHBondContact O-CB 3.46Å; I621-S625 PolarHBondContact O-N 3.37Å; I621-S625 PolarHBondContact O-OG 3.14Å; I621-V631 HydrophobicContact CB-CG1 4.43Å; I621-V631 HydrophobicContact CG1-CG1 4.19Å
622	M	94	Very high	91.9	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-62.5	-45.4	179.4	-69.9	-57.5	-64.6	0	0	111.9	L150 V153 Y203 F618 T619 Y624 S625 A674 C678	L150-M622 HydrophobicContact CD2-SD 4.49Å; V153-M622 HydrophobicContact CG1-SD 4.44Å; V153-M622 HydrophobicContact CG2-CE 4.4Å; V153-M622 HydrophobicContact CG2-SD 4.25Å; Y203-M622 HydrophobicContact CD2-CE 4.02Å; Y203-M622 HydrophobicContact CG-CE 4.3Å; F618-M622 HydrophobicContact CD1-CG 4.38Å; F618-M622 HydrophobicContact CD2-CG 4.12Å; F618-M622 HydrophobicContact CE1-CG 3.92Å; F618-M622 HydrophobicContact CE2-CG 3.62Å; F618-M622 HydrophobicContact CE2-SD 3.85Å; F618-M622 HydrophobicContact CG-CG 4.48Å; F618-M622 HydrophobicContact CZ-CG 3.51Å; F618-M622 HydrophobicContact CZ-SD 3.95Å; F618-M622 WeakPolarHBondContact O-CG 3.33Å; F618-M622 PolarHBondContact O-N 2.88Å; T619-M622 PolarHBondContact O-N 3.09Å; M622-Y624 VanDerWaalsContact C-N 3.32Å; M622-Y624 PolarHBondContact O-N 2.94Å; M622-S625 PolarHBondContact O-OG 3.29Å; M622-A674 HydrophobicContact CB-CB 4Å; M622-A674 HydrophobicContact CG-CB 4.06Å; M622-C678 PolarHBondContact O-SG 3.45Å
623	A	90.5	Very high	92.1	Very high	2 Å²	2	7.3 Å²	7.3	2%	0.017	4%	0.036	C	C	.	.	H	α-helix	trans	-59.6	-41	179.9	0	0	0	0	0	112.7	L515 T619 V620 I621	L515-A623 HydrophobicContact CD1-CB 4.25Å; L515-A623 HydrophobicContact CD2-CB 4.24Å; T619-A623 VanDerWaalsContact O-CB 3.22Å; T619-A623 WeakPolarHBondContact O-CB 3.25Å; T619-A623 PolarHBondContact O-N 3.22Å; V620-A623 PolarHBondContact O-N 3.44Å; I621-A623 PolarHBondContact O-N 3.34Å
624	Y	89	Confident	92.4	Very high	8 Å²	8	5.9 Å²	5.9	3%	0.031	3%	0.032	C	C	.	.	H	α-helix	trans	-97.2	-11.1	-177	-80.8	-82.9	0	0	0	115.1	L515 S519 F548 F556 V620 I621 M622 I626 T627 C628	L515-Y624 HydrophobicContact CD1-CD2 4.03Å; L515-Y624 HydrophobicContact CD1-CE2 3.5Å; L515-Y624 VanDerWaalsContact CD1-CE2 3.5Å; S519-Y624 WeakPolarHBondContact CB-OH 3.37Å; S519-Y624 PolarHBondContact OG-OH 3.46Å; F548-Y624 HydrophobicContact CD1-CE1 4.37Å; F548-Y624 HydrophobicContact CE1-CE1 4.17Å; F548-Y624 WeakPolarHBondContact CE1-OH 3.29Å; F556-Y624 HydrophobicContact CB-CD2 4.32Å; F556-Y624 HydrophobicContact CD1-CD2 4.36Å; F556-Y624 HydrophobicContact CD1-CE2 4.08Å; F556-Y624 HydrophobicContact CD2-CD1 4.44Å; F556-Y624 HydrophobicContact CD2-CD2 4.03Å; F556-Y624 AromaticContact CD2-CE1 3.89Å; F556-Y624 HydrophobicContact CD2-CE1 3.89Å; F556-Y624 AromaticContact CD2-CE2 3.38Å; F556-Y624 HydrophobicContact CD2-CE2 3.38Å; F556-Y624 AromaticContact CD2-CZ 3.32Å; F556-Y624 HydrophobicContact CE1-CE2 4.09Å; F556-Y624 HydrophobicContact CE2-CD2 4.48Å; F556-Y624 HydrophobicContact CE2-CE1 4.28Å; F556-Y624 AromaticContact CE2-CE2 3.46Å; F556-Y624 HydrophobicContact CE2-CE2 3.46Å; F556-Y624 VanDerWaalsContact CE2-CE2 3.46Å; F556-Y624 AromaticContact CE2-CZ 3.35Å; F556-Y624 WeakPolarHBondContact CE2-OH 3.17Å; F556-Y624 AromaticContact CG-CD2 3.97Å; F556-Y624 HydrophobicContact CG-CD2 3.97Å; F556-Y624 AromaticContact CG-CE2 3.72Å; F556-Y624 HydrophobicContact CG-CE2 3.72Å; F556-Y624 AromaticContact CZ-CE2 3.81Å; F556-Y624 HydrophobicContact CZ-CE2 3.81Å; V620-Y624 HydrophobicContact CG1-CD2 4.44Å; V620-Y624 PolarHBondContact O-N 3.05Å; I621-Y624 PolarHBondContact O-N 3.4Å; M622-Y624 VanDerWaalsContact C-N 3.32Å; M622-Y624 PolarHBondContact O-N 2.94Å; Y624-I626 PolarHBondContact O-N 3.25Å; Y624-T627 WeakPolarHBondContact CA-OG1 3.3Å; Y624-T627 VanDerWaalsContact CD1-OG1 3.29Å; Y624-T627 WeakPolarHBondContact CD1-OG1 3.48Å; Y624-T627 PolarHBondContact O-N 2.81Å; Y624-T627 PolarHBondContact O-OG1 3.37Å; Y624-C628 HydrophobicContact CD1-CB 4.43Å; Y624-C628 CarbonylContact O-C 3.59Å; Y624-C628 VanDerWaalsContact O-CA 3.31Å; Y624-C628 WeakPolarHBondContact O-CA 3.46Å; Y624-C628 PolarHBondContact O-N 3.2Å
625	S	92.3	Very high	92.5	Very high	0 Å²	0	5.9 Å²	5.9	0%	0	3%	0.032	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-24	-177.4	57.6	0	0	0	0	115.1	S157 Y203 I621 M622 P629	S157-S625 PolarHBondContact OG-O 3.18Å; Y203-S625 VanDerWaalsContact CE2-OG 3.28Å; Y203-S625 WeakPolarHBondContact CE2-OG 3.38Å; I621-S625 WeakPolarHBondContact O-CA 3.26Å; I621-S625 WeakPolarHBondContact O-CB 3.46Å; I621-S625 PolarHBondContact O-N 3.37Å; I621-S625 PolarHBondContact O-OG 3.14Å; M622-S625 PolarHBondContact O-OG 3.29Å; S625-P629 WeakPolarHBondContact O-CA 3.42Å
626	I	90.2	Very high	92.6	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.04	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-44.3	178	-62.9	177.3	0	0	0	111.1	I161 H196 A200 Y203 Y624 L682	I161-I626 HydrophobicContact CD1-CB 4.48Å; I161-I626 HydrophobicContact CD1-CG1 4.09Å; H196-I626 HydrophobicContact CB-CG2 3.73Å; A200-I626 HydrophobicContact CB-CD1 3.53Å; Y203-I626 HydrophobicContact CD2-CD1 3.92Å; Y203-I626 HydrophobicContact CD2-CG1 4.04Å; Y203-I626 HydrophobicContact CE2-CD1 4.14Å; Y203-I626 HydrophobicContact CE2-CG1 3.76Å; Y624-I626 PolarHBondContact O-N 3.25Å; I626-L682 HydrophobicContact CB-CD1 4.31Å; I626-L682 HydrophobicContact CB-CD2 4.47Å; I626-L682 HydrophobicContact CD1-CD1 3.81Å; I626-L682 HydrophobicContact CG2-CD1 3.99Å; I626-L682 HydrophobicContact CG2-CD2 3.92Å
627	T	86.8	Confident	92.9	Very high	11 Å²	11	10.5 Å²	10.5	7%	0.067	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-35.9	-178.9	54.9	0	0	0	0	112.3	T182 I183 Y624 L682	T182-T627 VanDerWaalsContact CA-O 3.26Å; T182-T627 WeakPolarHBondContact CA-O 3.34Å; T182-T627 WeakPolarHBondContact CB-O 3.22Å; I183-T627 HydrophobicContact CG2-CG2 4.09Å; I183-T627 PolarHBondContact N-O 2.69Å; Y624-T627 WeakPolarHBondContact CA-OG1 3.3Å; Y624-T627 VanDerWaalsContact CD1-OG1 3.29Å; Y624-T627 WeakPolarHBondContact CD1-OG1 3.48Å; Y624-T627 PolarHBondContact O-N 2.81Å; Y624-T627 PolarHBondContact O-OG1 3.37Å; T627-L682 HydrophobicContact CG2-CD2 3.76Å
628	C	88.8	Confident	93	Very high	2 Å²	2	10.7 Å²	10.7	1%	0.014	6%	0.056	C	C	.	.	S	Bend	trans	-134.6	86.6	176.9	-175.7	0	0	0	0	110.5	F178 T182 Y624 I630 V631	F178-C628 WeakPolarHBondContact CZ-SG 2.96Å; T182-C628 HydrophobicContact CG2-CB 4.34Å; Y624-C628 HydrophobicContact CD1-CB 4.43Å; Y624-C628 CarbonylContact O-C 3.59Å; Y624-C628 VanDerWaalsContact O-CA 3.31Å; Y624-C628 WeakPolarHBondContact O-CA 3.46Å; Y624-C628 PolarHBondContact O-N 3.2Å; C628-I630 PolarHBondContact O-N 3.42Å; C628-I630 VanDerWaalsContact O-N 3.07Å; C628-V631 HydrophobicContact CB-CG2 4.2Å; C628-V631 PolarHBondContact O-N 2.83Å; C628-V631 VanDerWaalsContact O-N 3.17Å
629	P	92.2	Very high	93.1	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-25.6	-175.4	-29.3	38	0	0	0	115.7	S157 I161 L162 N165 T181 S625 V631 A632 P633	S157-P629 WeakPolarHBondContact O-CB 3.48Å; I161-P629 HydrophobicContact CB-CG 3.93Å; I161-P629 HydrophobicContact CG2-CG 3.54Å; L162-P629 HydrophobicContact CB-CB 3.99Å; L162-P629 HydrophobicContact CB-CG 4.31Å; N165-P629 WeakPolarHBondContact ND2-CD 3.37Å; T181-P629 WeakPolarHBondContact O-CD 3.33Å; S625-P629 WeakPolarHBondContact O-CA 3.42Å; P629-V631 PolarHBondContact O-N 2.82Å; P629-A632 PolarHBondContact O-N 2.88Å; P629-P633 WeakPolarHBondContact O-CD 3.41Å
630	I	91.4	Very high	93.1	Very high	23 Å²	23	14.3 Å²	14.3	12%	0.118	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-24.1	-178.6	-64.5	179.4	0	0	0	112	F47 L162 F178 T181 V557 C628 A632 P633 F634	F47-I630 HydrophobicContact CE1-CD1 4.15Å; F47-I630 HydrophobicContact CZ-CD1 3.74Å; L162-I630 HydrophobicContact CD1-CG1 4.39Å; F178-I630 HydrophobicContact CE2-CD1 4.23Å; T181-I630 HydrophobicContact CG2-CD1 3.75Å; V557-I630 HydrophobicContact CG1-CG2 4.26Å; V557-I630 HydrophobicContact CG2-CB 4.5Å; V557-I630 HydrophobicContact CG2-CG2 4.31Å; C628-I630 PolarHBondContact O-N 3.42Å; C628-I630 VanDerWaalsContact O-N 3.07Å; I630-A632 VanDerWaalsContact C-N 3.28Å; I630-A632 PolarHBondContact O-N 3.24Å; I630-P633 VanDerWaalsContact O-CD 3.24Å; I630-P633 WeakPolarHBondContact O-CD 3.39Å; I630-P633 VanDerWaalsContact O-CG 3.29Å; I630-P633 WeakPolarHBondContact O-CG 3.43Å; I630-F634 HydrophobicContact CG2-CD2 4.07Å; I630-F634 HydrophobicContact CG2-CE2 3.73Å; I630-F634 VanDerWaalsContact O-CD2 3.29Å; I630-F634 WeakPolarHBondContact O-CD2 3.28Å
631	V	92.8	Very high	93.3	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-62.6	-35.6	177	177.3	0	0	0	0	111.9	V557 V560 I621 C628 P629 F634 G635	V557-V631 HydrophobicContact CB-CG2 4.33Å; V557-V631 HydrophobicContact CG2-CB 4.37Å; V557-V631 HydrophobicContact CG2-CG2 3.34Å; V560-V631 HydrophobicContact CG2-CG1 3.93Å; I621-V631 HydrophobicContact CB-CG1 4.43Å; I621-V631 HydrophobicContact CG1-CG1 4.19Å; C628-V631 HydrophobicContact CB-CG2 4.2Å; C628-V631 PolarHBondContact O-N 2.83Å; C628-V631 VanDerWaalsContact O-N 3.17Å; P629-V631 PolarHBondContact O-N 2.82Å; V631-F634 PolarHBondContact O-N 3.43Å; V631-G635 PolarHBondContact O-N 3.39Å
632	A	94.5	Very high	93.3	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-59.4	-52.5	-173	0	0	0	0	0	114.6	V153 S154 P629 I630 F634 G635 L636	V153-A632 HydrophobicContact CG1-CB 4.45Å; S154-A632 VanDerWaalsContact OG-C 3.32Å; S154-A632 PolarHBondContact OG-O 3.09Å; P629-A632 PolarHBondContact O-N 2.88Å; I630-A632 VanDerWaalsContact C-N 3.28Å; I630-A632 PolarHBondContact O-N 3.24Å; A632-F634 PolarHBondContact O-N 3.35Å; A632-G635 CarbonylContact O-C 3.58Å; A632-G635 WeakPolarHBondContact O-CA 3.27Å; A632-G635 PolarHBondContact O-N 3.43Å; A632-G635 VanDerWaalsContact O-N 3.09Å; A632-L636 PolarHBondContact O-N 3.36Å
633	P	95.3	Very high	93.3	Very high	34 Å²	34	17.1 Å²	17.1	22%	0.221	9%	0.089	C	C	.	.	H	α-helix	trans	-63.4	-37.7	178.7	25.1	-37.4	0	0	0	113.7	L158 P629 I630 G635 L636 I637	L158-P633 HydrophobicContact CD1-CB 4.08Å; L158-P633 HydrophobicContact CD1-CG 4.03Å; L158-P633 HydrophobicContact CD2-CG 4.15Å; L158-P633 HydrophobicContact CG-CG 4.37Å; P629-P633 WeakPolarHBondContact O-CD 3.41Å; I630-P633 VanDerWaalsContact O-CD 3.24Å; I630-P633 WeakPolarHBondContact O-CD 3.39Å; I630-P633 VanDerWaalsContact O-CG 3.29Å; I630-P633 WeakPolarHBondContact O-CG 3.43Å; P633-G635 VanDerWaalsContact C-N 3.28Å; P633-G635 PolarHBondContact O-N 3.09Å; P633-L636 WeakPolarHBondContact O-CB 3.4Å; P633-L636 PolarHBondContact O-N 3.41Å; P633-I637 WeakPolarHBondContact O-CG1 3.12Å; P633-I637 PolarHBondContact O-N 3.2Å; P633-I637 VanDerWaalsContact O-N 3.08Å
634	F	95	Very high	93.4	Very high	36 Å²	36	19.1 Å²	19.1	16%	0.158	10%	0.098	C	C	.	.	H	α-helix	trans	-67.6	-33.5	173.7	-67.7	-64.5	0	0	0	111.5	I50 L54 V557 V560 I561 I630 V631 A632 I637 Y638	I50-F634 HydrophobicContact CG2-CE2 4.44Å; L54-F634 HydrophobicContact CD1-CE1 3.99Å; L54-F634 HydrophobicContact CD2-CE1 4.07Å; L54-F634 HydrophobicContact CD2-CZ 4.33Å; V557-F634 HydrophobicContact CG1-CD2 3.82Å; V557-F634 HydrophobicContact CG1-CE2 4.04Å; V560-F634 HydrophobicContact CG1-CB 4.14Å; I561-F634 HydrophobicContact CD1-CD1 3.98Å; I561-F634 HydrophobicContact CD1-CD2 4.03Å; I561-F634 HydrophobicContact CD1-CE1 3.96Å; I561-F634 HydrophobicContact CD1-CE2 4.01Å; I561-F634 HydrophobicContact CD1-CG 4.03Å; I561-F634 HydrophobicContact CD1-CZ 3.97Å; I561-F634 HydrophobicContact CG1-CB 4Å; I561-F634 HydrophobicContact CG1-CD1 3.66Å; I561-F634 HydrophobicContact CG1-CD2 4.13Å; I561-F634 HydrophobicContact CG1-CE1 4.12Å; I561-F634 HydrophobicContact CG1-CG 3.66Å; I630-F634 HydrophobicContact CG2-CD2 4.07Å; I630-F634 HydrophobicContact CG2-CE2 3.73Å; I630-F634 VanDerWaalsContact O-CD2 3.29Å; I630-F634 WeakPolarHBondContact O-CD2 3.28Å; V631-F634 PolarHBondContact O-N 3.43Å; A632-F634 PolarHBondContact O-N 3.35Å; F634-I637 HydrophobicContact CD1-CD1 4.22Å; F634-I637 PolarHBondContact O-N 2.84Å; F634-Y638 PolarHBondContact O-N 3.46Å
635	G	95.6	Very high	93.5	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-63.6	-37	170.5	0	0	0	0	0	113.9	V631 A632 P633 Y638 I639	V631-G635 PolarHBondContact O-N 3.39Å; A632-G635 CarbonylContact O-C 3.58Å; A632-G635 WeakPolarHBondContact O-CA 3.27Å; A632-G635 PolarHBondContact O-N 3.43Å; A632-G635 VanDerWaalsContact O-N 3.09Å; P633-G635 VanDerWaalsContact C-N 3.28Å; P633-G635 PolarHBondContact O-N 3.09Å; G635-Y638 WeakPolarHBondContact O-CB 3.43Å; G635-Y638 PolarHBondContact O-N 3.06Å; G635-I639 PolarHBondContact O-N 3.47Å; G635-I639 VanDerWaalsContact O-N 3.09Å
636	L	97.3	Very high	93.5	Very high	33 Å²	33	19.3 Å²	19.3	17%	0.173	10%	0.1	C	C	.	.	H	α-helix	trans	-63.3	-44.1	171.8	177.8	61.4	0	0	0	111.2	I147 L150 V151 A632 P633 Y638 I639 L640	I147-L636 HydrophobicContact CG2-CD1 4.26Å; L150-L636 HydrophobicContact CB-CD1 4.22Å; V151-L636 HydrophobicContact CG2-CD1 3.67Å; V151-L636 HydrophobicContact CG2-CD2 3.93Å; V151-L636 HydrophobicContact CG2-CG 4.48Å; A632-L636 PolarHBondContact O-N 3.36Å; P633-L636 WeakPolarHBondContact O-CB 3.4Å; P633-L636 PolarHBondContact O-N 3.41Å; L636-Y638 VanDerWaalsContact C-N 3.32Å; L636-Y638 PolarHBondContact O-N 2.93Å; L636-I639 HydrophobicContact CD1-CG2 4.24Å; L636-I639 VanDerWaalsContact O-CG2 3.27Å; L636-I639 WeakPolarHBondContact O-CG2 3.42Å; L636-I639 PolarHBondContact O-N 3.3Å; L636-L640 HydrophobicContact CD1-CD1 4.13Å; L636-L640 HydrophobicContact CD1-CG 4.21Å; L636-L640 HydrophobicContact CG-CD1 3.97Å; L636-L640 HydrophobicContact CG-CG 4.5Å; L636-L640 WeakPolarHBondContact O-CB 3.38Å; L636-L640 VanDerWaalsContact O-CG 3.26Å; L636-L640 WeakPolarHBondContact O-CG 3.42Å; L636-L640 PolarHBondContact O-N 2.72Å
637	I	96.7	Very high	93.5	Very high	65 Å²	65	20.9 Å²	20.9	33%	0.333	11%	0.106	S	C	.	.	H	α-helix	trans	-60	-44	174.9	-65.3	168.7	0	0	0	110.6	F565 P633 F634 I639 L640 L641	F565-I637 HydrophobicContact CZ-CG2 4.08Å; P633-I637 WeakPolarHBondContact O-CG1 3.12Å; P633-I637 PolarHBondContact O-N 3.2Å; P633-I637 VanDerWaalsContact O-N 3.08Å; F634-I637 HydrophobicContact CD1-CD1 4.22Å; F634-I637 PolarHBondContact O-N 2.84Å; I637-I639 PolarHBondContact O-N 3.24Å; I637-L640 PolarHBondContact O-N 3.36Å; I637-L641 HydrophobicContact CG2-CD1 3.94Å; I637-L641 HydrophobicContact CG2-CG 4.37Å; I637-L641 WeakPolarHBondContact O-CG 3.28Å; I637-L641 PolarHBondContact O-N 3.38Å
638	Y	96.1	Very high	93.5	Very high	9 Å²	9	20.5 Å²	20.5	4%	0.035	10%	0.104	C	C	.	.	H	α-helix	trans	-53.7	-54.1	175.7	167.2	-94.7	0	0	0	111.8	A564 N568 V617 F634 G635 L636 L640 L641 K642	A564-Y638 HydrophobicContact CB-CD2 4.34Å; N568-Y638 PolarHBondContact ND2-O 3Å; V617-Y638 HydrophobicContact CB-CD1 4.15Å; V617-Y638 HydrophobicContact CB-CE1 3.66Å; V617-Y638 HydrophobicContact CB-CE2 4.39Å; V617-Y638 HydrophobicContact CG1-CD1 3.57Å; V617-Y638 HydrophobicContact CG1-CD2 4.1Å; V617-Y638 HydrophobicContact CG1-CE1 3.62Å; V617-Y638 HydrophobicContact CG1-CE2 4.18Å; V617-Y638 HydrophobicContact CG1-CG 3.84Å; V617-Y638 HydrophobicContact CG2-CE1 4.22Å; V617-Y638 HydrophobicContact CG2-CE2 4.14Å; F634-Y638 PolarHBondContact O-N 3.46Å; G635-Y638 WeakPolarHBondContact O-CB 3.43Å; G635-Y638 PolarHBondContact O-N 3.06Å; L636-Y638 VanDerWaalsContact C-N 3.32Å; L636-Y638 PolarHBondContact O-N 2.93Å; Y638-L640 VanDerWaalsContact C-N 3.33Å; Y638-L640 PolarHBondContact O-N 2.88Å; Y638-L641 PolarHBondContact O-N 2.91Å; Y638-K642 VanDerWaalsContact O-CB 3.27Å; Y638-K642 WeakPolarHBondContact O-CB 3.12Å; Y638-K642 PolarHBondContact O-N 3.48Å
639	I	96.3	Very high	93.5	Very high	2 Å²	2	20.6 Å²	20.6	1%	0.01	10%	0.104	C	C	.	.	H	α-helix	trans	-70.4	-31	-173.9	-163.2	70.4	0	0	0	112.1	I146 I147 L150 M614 G635 L636 I637 K642 H643	I146-I639 HydrophobicContact CG2-CD1 4.17Å; I146-I639 HydrophobicContact CG2-CG1 4.01Å; I147-I639 HydrophobicContact CB-CG2 4.48Å; I147-I639 HydrophobicContact CG1-CB 4.3Å; I147-I639 HydrophobicContact CG1-CG1 3.85Å; I147-I639 HydrophobicContact CG1-CG2 3.65Å; L150-I639 HydrophobicContact CD1-CB 4.1Å; L150-I639 HydrophobicContact CD1-CG2 3.64Å; M614-I639 HydrophobicContact CG-CD1 3.54Å; M614-I639 HydrophobicContact SD-CD1 3.73Å; G635-I639 PolarHBondContact O-N 3.47Å; G635-I639 VanDerWaalsContact O-N 3.09Å; L636-I639 HydrophobicContact CD1-CG2 4.24Å; L636-I639 VanDerWaalsContact O-CG2 3.27Å; L636-I639 WeakPolarHBondContact O-CG2 3.42Å; L636-I639 PolarHBondContact O-N 3.3Å; I637-I639 PolarHBondContact O-N 3.24Å; I639-K642 PolarHBondContact O-N 3.03Å; I639-H643 WeakPolarHBondContact O-CB 3.49Å; I639-H643 PolarHBondContact O-N 2.8Å
640	L	95.9	Very high	93.3	Very high	76 Å²	76	20.9 Å²	20.9	40%	0.398	11%	0.106	S	C	.	.	H	α-helix	trans	-65.8	-48.7	174.6	-74.4	170.2	0	0	0	111	I147 L636 I637 Y638 K642 H643 M644	I147-L640 HydrophobicContact CD1-CD2 4.18Å; I147-L640 HydrophobicContact CG1-CD2 4.34Å; I147-L640 HydrophobicContact CG2-CD2 3.79Å; L636-L640 HydrophobicContact CD1-CD1 4.13Å; L636-L640 HydrophobicContact CD1-CG 4.21Å; L636-L640 HydrophobicContact CG-CD1 3.97Å; L636-L640 HydrophobicContact CG-CG 4.5Å; L636-L640 WeakPolarHBondContact O-CB 3.38Å; L636-L640 VanDerWaalsContact O-CG 3.26Å; L636-L640 WeakPolarHBondContact O-CG 3.42Å; L636-L640 PolarHBondContact O-N 2.72Å; I637-L640 PolarHBondContact O-N 3.36Å; Y638-L640 VanDerWaalsContact C-N 3.33Å; Y638-L640 PolarHBondContact O-N 2.88Å; L640-K642 VanDerWaalsContact C-N 3.33Å; L640-H643 PolarHBondContact O-N 2.84Å; L640-M644 WeakPolarHBondContact O-CG 3.36Å; L640-M644 PolarHBondContact O-N 3.48Å; L640-M644 VanDerWaalsContact O-N 3.09Å
641	L	94.1	Very high	92.9	Very high	32 Å²	32	22 Å²	22	17%	0.168	11%	0.108	C	C	.	.	H	α-helix	trans	-63	-41.9	175.5	-70.9	177.4	0	0	0	111.2	F61 A564 F565 N568 I637 Y638 H643 M644 V645	F61-L641 HydrophobicContact CE1-CD2 4.43Å; F61-L641 HydrophobicContact CZ-CD1 4.44Å; F61-L641 HydrophobicContact CZ-CD2 4.19Å; A564-L641 VanDerWaalsContact O-CD1 3.3Å; A564-L641 WeakPolarHBondContact O-CD1 3.49Å; F565-L641 HydrophobicContact CD1-CD1 4Å; F565-L641 HydrophobicContact CE1-CD1 3.95Å; N568-L641 HydrophobicContact CB-CB 4.44Å; I637-L641 HydrophobicContact CG2-CD1 3.94Å; I637-L641 HydrophobicContact CG2-CG 4.37Å; I637-L641 WeakPolarHBondContact O-CG 3.28Å; I637-L641 PolarHBondContact O-N 3.38Å; Y638-L641 PolarHBondContact O-N 2.91Å; L641-H643 VanDerWaalsContact C-N 3.34Å; L641-H643 PolarHBondContact O-N 3.31Å; L641-M644 PolarHBondContact O-N 3.08Å; L641-V645 WeakPolarHBondContact O-CG2 3.31Å; L641-V645 PolarHBondContact O-N 3.08Å
642	K	94.8	Very high	92.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-58	-46.3	175.8	-175.7	64.4	173.5	127.2	0	111.6	N568 E571 Y638 I639 L640 M644 V645 D646	N568-K642 VanDerWaalsContact OD1-CA 3.22Å; N568-K642 WeakPolarHBondContact OD1-CA 3.34Å; N568-K642 WeakPolarHBondContact OD1-CB 3.39Å; N568-K642 VanDerWaalsContact OD1-CD 3.22Å; N568-K642 WeakPolarHBondContact OD1-CD 2.99Å; E571-K642 IonicContact OE1-NZ 3.62Å; E571-K642 WeakPolarHBondContact OE2-CE 3.43Å; E571-K642 IonicContact OE2-NZ 3.95Å; E571-K642 PolarHBondContact OE2-NZ 2.82Å; Y638-K642 VanDerWaalsContact O-CB 3.27Å; Y638-K642 WeakPolarHBondContact O-CB 3.12Å; Y638-K642 PolarHBondContact O-N 3.48Å; I639-K642 PolarHBondContact O-N 3.03Å; L640-K642 VanDerWaalsContact C-N 3.33Å; K642-M644 VanDerWaalsContact C-N 3.34Å; K642-M644 PolarHBondContact O-N 3.4Å; K642-V645 PolarHBondContact O-N 3.49Å; K642-D646 WeakPolarHBondContact CE-OD2 3.16Å; K642-D646 IonicContact NZ-OD1 3.07Å; K642-D646 PolarHBondContact NZ-OD1 3.31Å; K642-D646 IonicContact NZ-OD2 3.34Å; K642-D646 PolarHBondContact NZ-OD2 3.41Å; K642-D646 WeakPolarHBondContact O-CB 3.33Å; K642-D646 PolarHBondContact O-N 3.37Å
643	H	94.4	Very high	91.6	Very high	26 Å²	26	23.9 Å²	23.9	12%	0.12	12%	0.118	C	C	.	.	H	α-helix	trans	-61	-42.2	177.2	-177	63.3	0	0	0	112.5	Q143 I147 I639 L640 L641 R647	Q143-H643 PolarHBondContact OE1-ND1 3.4Å; I147-H643 HydrophobicContact CD1-CB 3.8Å; I639-H643 WeakPolarHBondContact O-CB 3.49Å; I639-H643 PolarHBondContact O-N 2.8Å; L640-H643 PolarHBondContact O-N 2.84Å; L641-H643 VanDerWaalsContact C-N 3.34Å; L641-H643 PolarHBondContact O-N 3.31Å; H643-R647 WeakPolarHBondContact O-CB 3.47Å; H643-R647 PolarHBondContact O-N 2.94Å
644	M	91.8	Very high	91	Very high	45 Å²	45	23.8 Å²	23.8	22%	0.222	11%	0.113	C	C	.	.	H	α-helix	trans	-65.8	-44.7	177	-69.4	-176.3	65.8	0	0	112.6	L117 F121 L640 L641 K642 H648	L117-M644 HydrophobicContact CD1-CE 3.97Å; F121-M644 HydrophobicContact CD2-CE 4.44Å; F121-M644 HydrophobicContact CE1-CE 3.94Å; F121-M644 HydrophobicContact CE1-SD 4.31Å; F121-M644 HydrophobicContact CE2-CE 3.43Å; F121-M644 VanDerWaalsContact CE2-CE 3.43Å; F121-M644 HydrophobicContact CZ-CE 3.13Å; F121-M644 HydrophobicContact CZ-SD 3.81Å; L640-M644 WeakPolarHBondContact O-CG 3.36Å; L640-M644 PolarHBondContact O-N 3.48Å; L640-M644 VanDerWaalsContact O-N 3.09Å; L641-M644 PolarHBondContact O-N 3.08Å; K642-M644 VanDerWaalsContact C-N 3.34Å; K642-M644 PolarHBondContact O-N 3.4Å; M644-H648 PolarHBondContact O-N 3.07Å; M644-H648 VanDerWaalsContact O-N 3.12Å
645	V	91.8	Very high	90.4	Very high	11 Å²	11	25 Å²	25	7%	0.067	12%	0.121	C	C	.	.	H	α-helix	trans	-67.4	-43.5	180	170.4	0	0	0	0	111.2	N568 E571 L572 L641 K642 H648 N649	N568-V645 HydrophobicContact CB-CG2 4.22Å; E571-V645 HydrophobicContact CB-CG1 4.32Å; L572-V645 HydrophobicContact CB-CG1 4.04Å; L572-V645 HydrophobicContact CB-CG2 4.44Å; L572-V645 HydrophobicContact CD1-CG1 4.22Å; L641-V645 WeakPolarHBondContact O-CG2 3.31Å; L641-V645 PolarHBondContact O-N 3.08Å; K642-V645 PolarHBondContact O-N 3.49Å; V645-H648 WeakPolarHBondContact O-CB 3.29Å; V645-H648 PolarHBondContact O-N 3.45Å; V645-N649 WeakPolarHBondContact O-CB 3.47Å; V645-N649 PolarHBondContact O-N 3.31Å
646	D	92.1	Very high	89.6	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-66	-41.2	177.9	-79.2	-24.8	0	0	0	112.4	Y139 Q143 Y605 K642 H648 N649 L650	Y139-D646 HydrophobicContact CE1-CB 3.92Å; Y139-D646 WeakPolarHBondContact CE1-OD2 3.38Å; Y139-D646 PolarHBondContact OH-OD2 3.23Å; Q143-D646 PolarHBondContact NE2-OD2 2.93Å; Y605-D646 PolarHBondContact OH-OD1 2.83Å; K642-D646 WeakPolarHBondContact CE-OD2 3.16Å; K642-D646 IonicContact NZ-OD1 3.07Å; K642-D646 PolarHBondContact NZ-OD1 3.31Å; K642-D646 IonicContact NZ-OD2 3.34Å; K642-D646 PolarHBondContact NZ-OD2 3.41Å; K642-D646 WeakPolarHBondContact O-CB 3.33Å; K642-D646 PolarHBondContact O-N 3.37Å; D646-H648 VanDerWaalsContact C-N 3.27Å; D646-H648 PolarHBondContact O-N 3.44Å; D646-N649 PolarHBondContact O-N 3.37Å; D646-L650 VanDerWaalsContact O-CB 3.3Å; D646-L650 WeakPolarHBondContact O-CB 3.39Å; D646-L650 WeakPolarHBondContact O-CG 3.15Å; D646-L650 PolarHBondContact O-N 3.4Å
647	R	90.6	Very high	88.6	Confident	33 Å²	33	27 Å²	27	13%	0.125	14%	0.137	C	C	.	.	H	α-helix	trans	-58.3	-42.2	174.6	-171.4	177.6	-166.4	-172.4	8	111.6	I120 L123 D125 I128 L140 H643 Y651	I120-R647 PolarHBondContact O-NH1 3.27Å; L123-R647 PolarHBondContact O-NH2 2.96Å; D125-R647 IonicContact OD1-NH2 3.51Å; D125-R647 PolarHBondContact OD1-NH2 3.39Å; I128-R647 HydrophobicContact CD1-CG 4.03Å; L140-R647 HydrophobicContact CD1-CG 4.36Å; L140-R647 HydrophobicContact CD2-CB 4.14Å; H643-R647 WeakPolarHBondContact O-CB 3.47Å; H643-R647 PolarHBondContact O-N 2.94Å; R647-Y651 PolarHBondContact O-N 3.18Å
648	H	87	Confident	87.6	Confident	3 Å²	3	27.6 Å²	27.6	1%	0.014	14%	0.137	C	C	.	.	H	α-helix	trans	-63	-52.1	174.9	-178.6	63.2	0	0	0	112	F68 R72 I120 M644 V645 D646 Y651 F652	F68-H648 AromaticContact CZ-NE2 3.58Å; R72-H648 PolarHBondContact NH1-CE1 2.75Å; I120-H648 HydrophobicContact CD1-CB 3.66Å; I120-H648 HydrophobicContact CG1-CB 3.97Å; M644-H648 PolarHBondContact O-N 3.07Å; M644-H648 VanDerWaalsContact O-N 3.12Å; V645-H648 WeakPolarHBondContact O-CB 3.29Å; V645-H648 PolarHBondContact O-N 3.45Å; D646-H648 VanDerWaalsContact C-N 3.27Å; D646-H648 PolarHBondContact O-N 3.44Å; H648-Y651 PolarHBondContact O-N 3.5Å; H648-F652 AromaticContact CE1-CD2 3.15Å; H648-F652 WeakPolarHBondContact CE1-CD2 3.38Å; H648-F652 AromaticContact CE1-CE2 3.73Å; H648-F652 AromaticContact CE1-CG 3.8Å; H648-F652 AromaticContact ND1-CD2 3.19Å; H648-F652 WeakPolarHBondContact ND1-CD2 3.3Å; H648-F652 AromaticContact ND1-CE2 3.54Å; H648-F652 WeakPolarHBondContact O-CD2 3.24Å; H648-F652 PolarHBondContact O-N 3.4Å
649	N	87.9	Confident	86.7	Confident	4 Å²	4	28 Å²	28	2%	0.021	14%	0.14	C	C	.	.	H	α-helix	trans	-62.1	-47.5	-176.7	-83	-15.6	0	0	0	111.6	E571 V645 D646 Y651 V653 Y654	E571-N649 PolarHBondContact O-ND2 2.98Å; V645-N649 WeakPolarHBondContact O-CB 3.47Å; V645-N649 PolarHBondContact O-N 3.31Å; D646-N649 PolarHBondContact O-N 3.37Å; N649-Y651 VanDerWaalsContact C-N 3.29Å; N649-Y651 PolarHBondContact O-N 3.43Å; N649-V653 VanDerWaalsContact O-CB 3.23Å; N649-V653 WeakPolarHBondContact O-CB 3.32Å; N649-V653 PolarHBondContact O-N 2.84Å; N649-Y654 HydrophobicContact CB-CD2 4.09Å; N649-Y654 HydrophobicContact CB-CE2 3.9Å; N649-Y654 WeakPolarHBondContact O-CD2 3.21Å; N649-Y654 PolarHBondContact O-N 2.77Å
650	L	87.2	Confident	85.8	Confident	7 Å²	7	32.2 Å²	32.2	4%	0.037	16%	0.159	C	C	.	.	H	α-helix	trans	-56.8	-42.7	178.8	-79.3	165.9	0	0	0	112.3	C132 A136 Y139 L140 Y605 F607 D646	C132-L650 PolarHBondContact SG-O 3.34Å; A136-L650 HydrophobicContact CB-CD1 4.39Å; A136-L650 HydrophobicContact CB-CD2 4.24Å; Y139-L650 HydrophobicContact CD1-CD1 3.97Å; Y139-L650 HydrophobicContact CE1-CD1 4.45Å; L140-L650 HydrophobicContact CD1-CD1 4.3Å; L140-L650 HydrophobicContact CD2-CD1 4.07Å; L140-L650 HydrophobicContact CG-CD1 4.04Å; Y605-L650 HydrophobicContact CD1-CD2 3.56Å; Y605-L650 HydrophobicContact CD1-CG 4.48Å; Y605-L650 HydrophobicContact CD2-CD2 3.73Å; Y605-L650 HydrophobicContact CD2-CG 4.24Å; Y605-L650 HydrophobicContact CE1-CD2 3.89Å; Y605-L650 HydrophobicContact CE1-CG 4.37Å; Y605-L650 HydrophobicContact CE2-CD2 4.05Å; Y605-L650 HydrophobicContact CE2-CG 4.13Å; Y605-L650 HydrophobicContact CG-CD2 3.45Å; Y605-L650 VanDerWaalsContact CG-CD2 3.45Å; Y605-L650 HydrophobicContact CG-CG 4.39Å; F607-L650 HydrophobicContact CZ-CD2 4.3Å; D646-L650 VanDerWaalsContact O-CB 3.3Å; D646-L650 WeakPolarHBondContact O-CB 3.39Å; D646-L650 WeakPolarHBondContact O-CG 3.15Å; D646-L650 PolarHBondContact O-N 3.4Å
651	Y	84.2	Confident	84.8	Confident	45 Å²	45	31.8 Å²	31.8	18%	0.176	15%	0.154	C	C	.	.	H	α-helix	trans	-74.9	-52.1	-176.9	-171.9	-97.1	0	0	0	112.9	R80 L123 I128 W131 R647 H648 N649	R80-Y651 PolarHBondContact NH1-O 3.1Å; L123-Y651 HydrophobicContact CD1-CD1 4.3Å; L123-Y651 HydrophobicContact CD1-CG 4.4Å; L123-Y651 HydrophobicContact CD2-CD1 3.83Å; L123-Y651 HydrophobicContact CD2-CD2 3.37Å; L123-Y651 HydrophobicContact CD2-CE1 3.89Å; L123-Y651 HydrophobicContact CD2-CE2 3.43Å; L123-Y651 VanDerWaalsContact CD2-CE2 3.43Å; L123-Y651 HydrophobicContact CD2-CG 3.57Å; I128-Y651 HydrophobicContact CG1-CD2 4.2Å; W131-Y651 HydrophobicContact CB-CE2 4.32Å; W131-Y651 HydrophobicContact CG-CE2 4.43Å; R647-Y651 PolarHBondContact O-N 3.18Å; H648-Y651 PolarHBondContact O-N 3.5Å; N649-Y651 VanDerWaalsContact C-N 3.29Å; N649-Y651 PolarHBondContact O-N 3.43Å
652	F	80.3	Confident	84.1	Confident	31 Å²	31	31.4 Å²	31.4	14%	0.136	16%	0.158	C	C	.	.	H	α-helix	trans	-92.1	-22.1	-167.5	-69.6	-71.6	0	0	0	114.5	I81 L123 H648	I81-F652 HydrophobicContact CD1-CB 4.08Å; I81-F652 HydrophobicContact CD1-CD1 3.56Å; I81-F652 HydrophobicContact CD1-CE1 4.45Å; I81-F652 HydrophobicContact CD1-CG 4.24Å; I81-F652 HydrophobicContact CG1-CB 4.49Å; I81-F652 HydrophobicContact CG1-CD1 4.18Å; L123-F652 HydrophobicContact CD1-CE2 3.98Å; L123-F652 HydrophobicContact CD1-CZ 4.31Å; H648-F652 AromaticContact CE1-CD2 3.15Å; H648-F652 WeakPolarHBondContact CE1-CD2 3.38Å; H648-F652 AromaticContact CE1-CE2 3.73Å; H648-F652 AromaticContact CE1-CG 3.8Å; H648-F652 AromaticContact ND1-CD2 3.19Å; H648-F652 WeakPolarHBondContact ND1-CD2 3.3Å; H648-F652 AromaticContact ND1-CE2 3.54Å; H648-F652 WeakPolarHBondContact O-CD2 3.24Å; H648-F652 PolarHBondContact O-N 3.4Å
653	V	78.8	Confident	83.7	Confident	10 Å²	10	31.5 Å²	31.5	6%	0.061	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-51.5	-164.9	167.9	0	0	0	0	112.6	R80 N649	R80-V653 WeakPolarHBondContact CB-O 3.05Å; R80-V653 PolarHBondContact N-O 2.84Å; R80-V653 VanDerWaalsContact N-O 3.11Å; N649-V653 VanDerWaalsContact O-CB 3.23Å; N649-V653 WeakPolarHBondContact O-CB 3.32Å; N649-V653 PolarHBondContact O-N 2.84Å
654	Y	82.7	Confident	83.3	Confident	32 Å²	32	30.3 Å²	30.3	13%	0.125	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-93.3	151.4	-165.2	-71.2	-84	0	0	0	111.9	R80 F603 Y605 N649	R80-Y654 WeakPolarHBondContact CD-O 3.48Å; F603-Y654 HydrophobicContact CB-CD1 4.49Å; F603-Y654 HydrophobicContact CB-CE1 4.44Å; F603-Y654 WeakPolarHBondContact O-CD1 3.26Å; Y605-Y654 HydrophobicContact CD2-CD1 4.14Å; Y605-Y654 AromaticContact CD2-CD2 3.49Å; Y605-Y654 HydrophobicContact CD2-CD2 3.49Å; Y605-Y654 VanDerWaalsContact CD2-CD2 3.49Å; Y605-Y654 HydrophobicContact CD2-CE1 4.33Å; Y605-Y654 AromaticContact CD2-CE2 3.73Å; Y605-Y654 HydrophobicContact CD2-CE2 3.73Å; Y605-Y654 AromaticContact CD2-CG 3.71Å; Y605-Y654 HydrophobicContact CD2-CG 3.71Å; Y605-Y654 HydrophobicContact CE2-CD2 4.17Å; Y605-Y654 HydrophobicContact CE2-CE2 4.1Å; Y605-Y654 HydrophobicContact CG-CG 4.36Å; N649-Y654 HydrophobicContact CB-CD2 4.09Å; N649-Y654 HydrophobicContact CB-CE2 3.9Å; N649-Y654 WeakPolarHBondContact O-CD2 3.21Å; N649-Y654 PolarHBondContact O-N 2.77Å
655	L	81.9	Confident	82.9	Confident	61 Å²	61	29.1 Å²	29.1	32%	0.319	15%	0.147	S	C	.	.	B	Isolated β-bridge	trans	-77.3	147.3	169.9	-72.5	156.7	0	0	0	109.9	L83 A602 F603 Q604 A657	L83-L655 HydrophobicContact CD1-CD2 4.41Å; A602-L655 HydrophobicContact CB-CD1 3.59Å; A602-L655 HydrophobicContact CB-CG 3.82Å; A602-L655 WeakPolarHBondContact O-CD1 3.41Å; F603-L655 PolarHBondContact O-N 2.97Å; Q604-L655 HydrophobicContact CG-CB 4.38Å; L655-A657 PolarHBondContact O-N 2.89Å
656	P	79.6	Confident	82.6	Confident	64 Å²	64	29.1 Å²	29.1	42%	0.416	15%	0.148	S	C	.	.	P	Polyproline II helix	trans	-57.4	137.2	170.4	26	-33.6	0	0	0	109.6	C132	C132-P656 WeakPolarHBondContact O-CB 3.41Å
657	A	76.8	Confident	82.6	Confident	11 Å²	11	29.1 Å²	29.1	9%	0.091	15%	0.148	C	C	.	.			trans	-116.9	135.3	170.4	0	0	0	0	0	107.5	Q604 F607 L655 L659	Q604-A657 HydrophobicContact CB-CB 4.28Å; F607-A657 HydrophobicContact CE2-CB 4.19Å; L655-A657 PolarHBondContact O-N 2.89Å; A657-L659 HydrophobicContact CB-CG 4.5Å
658	K	75	Confident	82.5	Confident	78 Å²	78	27.5 Å²	27.5	34%	0.339	14%	0.142	S	C	.	.			trans	-98	110.4	172.7	-165.8	-179.3	-171.7	-173.3	0	107.1	E223 D402	E223-K658 WeakPolarHBondContact OE1-CE 3.24Å; E223-K658 IonicContact OE1-NZ 3.56Å; E223-K658 PolarHBondContact OE1-NZ 3.36Å; E223-K658 IonicContact OE2-NZ 2.7Å; E223-K658 PolarHBondContact OE2-NZ 3.35Å; D402-K658 IonicContact OD1-NZ 3.43Å; D402-K658 WeakPolarHBondContact OD2-CE 3.49Å; D402-K658 IonicContact OD2-NZ 3.62Å; D402-K658 PolarHBondContact OD2-NZ 3.03Å
659	L	76.5	Confident	82.5	Confident	17 Å²	17	31.1 Å²	31.1	9%	0.089	16%	0.161	C	C	.	.			trans	-115.6	154.6	-179.2	-66.2	172.3	0	0	0	110.7	D135 S496 F607 A657 I663	D135-L659 PolarHBondContact OD2-N 2.87Å; S496-L659 WeakPolarHBondContact OG-CA 3.34Å; S496-L659 WeakPolarHBondContact OG-CD2 3.49Å; F607-L659 HydrophobicContact CB-CD1 3.86Å; F607-L659 HydrophobicContact CD2-CD1 3.29Å; F607-L659 HydrophobicContact CD2-CG 4.47Å; F607-L659 HydrophobicContact CE2-CD1 4.01Å; F607-L659 HydrophobicContact CG-CD1 3.78Å; A657-L659 HydrophobicContact CB-CG 4.5Å; L659-I663 HydrophobicContact CB-CG2 4.47Å; L659-I663 HydrophobicContact CD1-CD1 4.18Å; L659-I663 HydrophobicContact CD1-CG2 4.44Å
660	E	77.8	Confident	82.7	Confident	91 Å²	91	31.7 Å²	31.7	43%	0.425	16%	0.164	S	C	.	.			trans	-71.9	145.9	169	-66.7	-169.4	167.7	0	0	111.1	A401 S496 G662 I663	A401-E660 WeakPolarHBondContact CB-OE1 3.11Å; S496-E660 PolarHBondContact OG-N 3.25Å; E660-G662 PolarHBondContact O-N 3.46Å; E660-I663 PolarHBondContact O-N 2.85Å
661	K	76.5	Confident	82.9	Confident	66 Å²	66	31.4 Å²	31.4	29%	0.287	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-23.3	179.6	67.2	-169.4	178.2	-170.7	0	115.8	Y220 E222 I663 H664 F665 Y728	Y220-K661 HydrophobicContact CD2-CB 3.86Å; Y220-K661 HydrophobicContact CE1-CB 4.21Å; Y220-K661 HydrophobicContact CE2-CB 3.45Å; Y220-K661 VanDerWaalsContact CE2-CB 3.45Å; Y220-K661 HydrophobicContact CG-CB 4.38Å; E222-K661 IonicContact OE1-NZ 3Å; K661-I663 PolarHBondContact O-N 3.31Å; K661-I663 VanDerWaalsContact O-N 3.12Å; K661-H664 PolarHBondContact O-N 3.47Å; K661-F665 HydrophobicContact CB-CD2 4.28Å; K661-F665 HydrophobicContact CB-CE2 3.87Å; K661-F665 HydrophobicContact CD-CE2 4.05Å; K661-F665 HydrophobicContact CG-CD2 4.24Å; K661-F665 HydrophobicContact CG-CE2 3.86Å; K661-F665 WeakPolarHBondContact O-CD2 3.36Å; K661-F665 PolarHBondContact O-N 3.3Å; K661-Y728 PolarHBondContact NZ-OH 3.08Å
662	G	78.7	Confident	83.2	Confident	25 Å²	25	30.8 Å²	30.8	26%	0.258	16%	0.162	S	C	.	.	H	α-helix	trans	-54.7	-32.2	-175.6	0	0	0	0	0	113.7	E660 F665 A666	E660-G662 PolarHBondContact O-N 3.46Å; G662-F665 PolarHBondContact O-N 3.34Å; G662-A666 VanDerWaalsContact O-CB 3.3Å; G662-A666 WeakPolarHBondContact O-CB 3.17Å; G662-A666 PolarHBondContact O-N 2.95Å
663	I	85.5	Confident	83.7	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-66	-43	-179.8	-165.4	173.1	0	0	0	112.8	N499 M503 F607 Y611 L659 E660 K661 F665 A666 A667	N499-I663 HydrophobicContact CB-CD1 3.75Å; M503-I663 HydrophobicContact SD-CG1 4.4Å; F607-I663 HydrophobicContact CB-CD1 3.69Å; Y611-I663 HydrophobicContact CD2-CD1 4.39Å; Y611-I663 HydrophobicContact CD2-CG1 4.29Å; Y611-I663 HydrophobicContact CE2-CG1 4.38Å; L659-I663 HydrophobicContact CB-CG2 4.47Å; L659-I663 HydrophobicContact CD1-CD1 4.18Å; L659-I663 HydrophobicContact CD1-CG2 4.44Å; E660-I663 PolarHBondContact O-N 2.85Å; K661-I663 PolarHBondContact O-N 3.31Å; K661-I663 VanDerWaalsContact O-N 3.12Å; I663-F665 PolarHBondContact O-N 3.02Å; I663-A666 PolarHBondContact O-N 3.42Å; I663-A667 PolarHBondContact O-N 2.84Å
664	H	86.6	Confident	84.3	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-67.1	-39.2	-179.5	-62.8	-84.4	0	0	0	111.1	D135 H138 I218 Y220 Y611 K661 A667 V668	D135-H664 PolarHBondContact O-CE1 2.84Å; D135-H664 IonicContact OD1-NE2 2.63Å; D135-H664 PolarHBondContact OD1-NE2 3.29Å; H138-H664 VanDerWaalsContact CB-CE1 3.46Å; H138-H664 WeakPolarHBondContact CB-CE1 3.35Å; I218-H664 HydrophobicContact CD1-CB 4.41Å; Y220-H664 PolarHBondContact OH-CD2 2.84Å; Y220-H664 PolarHBondContact OH-NE2 3.09Å; Y611-H664 AromaticContact CZ-ND1 3.88Å; Y611-H664 PolarHBondContact OH-CE1 3.45Å; Y611-H664 VanDerWaalsContact OH-CE1 3.3Å; Y611-H664 PolarHBondContact OH-ND1 3.48Å; K661-H664 PolarHBondContact O-N 3.47Å; H664-A667 WeakPolarHBondContact O-CB 3.27Å; H664-A667 PolarHBondContact O-N 2.05Å; H664-V668 WeakPolarHBondContact O-CG2 3.3Å; H664-V668 PolarHBondContact O-N 2.93Å; H664-V668 VanDerWaalsContact O-N 3.09Å
665	F	83.2	Confident	84.7	Confident	19 Å²	19	28.9 Å²	28.9	8%	0.083	16%	0.159	C	C	.	.	H	α-helix	trans	-67.4	-39.2	174	-68.1	-66.1	0	0	0	112.5	T215 K661 G662 I663 A667 V668 N669 L726 Y728	T215-F665 HydrophobicContact CG2-CD1 3.93Å; T215-F665 HydrophobicContact CG2-CE1 3.43Å; T215-F665 VanDerWaalsContact CG2-CE1 3.43Å; K661-F665 HydrophobicContact CB-CD2 4.28Å; K661-F665 HydrophobicContact CB-CE2 3.87Å; K661-F665 HydrophobicContact CD-CE2 4.05Å; K661-F665 HydrophobicContact CG-CD2 4.24Å; K661-F665 HydrophobicContact CG-CE2 3.86Å; K661-F665 WeakPolarHBondContact O-CD2 3.36Å; K661-F665 PolarHBondContact O-N 3.3Å; G662-F665 PolarHBondContact O-N 3.34Å; I663-F665 PolarHBondContact O-N 3.02Å; F665-A667 VanDerWaalsContact C-N 3.29Å; F665-A667 PolarHBondContact O-N 3.33Å; F665-V668 PolarHBondContact O-N 3.37Å; F665-N669 PolarHBondContact O-N 3.44Å; F665-L726 HydrophobicContact CB-CD2 3.79Å; F665-L726 HydrophobicContact CD1-CB 4.45Å; F665-L726 HydrophobicContact CD1-CD2 3.39Å; F665-L726 HydrophobicContact CD1-CG 3.86Å; F665-L726 HydrophobicContact CE1-CB 4.47Å; F665-L726 HydrophobicContact CE1-CD2 4.13Å; F665-L726 HydrophobicContact CE1-CG 4.34Å; F665-L726 HydrophobicContact CG-CD2 3.77Å; F665-Y728 AromaticContact CZ-CD1 3.95Å; F665-Y728 HydrophobicContact CZ-CD1 3.95Å; F665-Y728 HydrophobicContact CZ-CG 4.47Å
666	A	86.8	Confident	85.1	Confident	11 Å²	11	27.8 Å²	27.8	9%	0.091	15%	0.154	C	C	.	.	H	α-helix	trans	-63.6	-37.9	175.5	0	0	0	0	0	111.2	Q500 M503 G662 I663 N669 Q670	Q500-A666 HydrophobicContact CG-CB 4.18Å; M503-A666 HydrophobicContact CE-CB 3.24Å; G662-A666 VanDerWaalsContact O-CB 3.3Å; G662-A666 WeakPolarHBondContact O-CB 3.17Å; G662-A666 PolarHBondContact O-N 2.95Å; I663-A666 PolarHBondContact O-N 3.42Å; A666-N669 PolarHBondContact O-N 3.32Å; A666-Q670 WeakPolarHBondContact O-CG 3.07Å; A666-Q670 PolarHBondContact O-N 3.26Å
667	A	90.4	Very high	85.6	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63	-41.7	173.8	0	0	0	0	0	112.3	F142 M503 Y611 L615 I663 H664 F665 Q670 A671	F142-A667 HydrophobicContact CE1-CB 4.41Å; F142-A667 HydrophobicContact CZ-CB 4.2Å; M503-A667 HydrophobicContact SD-CB 4.09Å; Y611-A667 HydrophobicContact CD1-CB 3.54Å; Y611-A667 HydrophobicContact CD2-CB 4.37Å; Y611-A667 HydrophobicContact CE1-CB 3.61Å; Y611-A667 HydrophobicContact CE2-CB 4.44Å; Y611-A667 HydrophobicContact CG-CB 3.95Å; L615-A667 HydrophobicContact CD1-CB 4.12Å; I663-A667 PolarHBondContact O-N 2.84Å; H664-A667 WeakPolarHBondContact O-CB 3.27Å; H664-A667 PolarHBondContact O-N 2.05Å; F665-A667 VanDerWaalsContact C-N 3.29Å; F665-A667 PolarHBondContact O-N 3.33Å; A667-Q670 PolarHBondContact O-N 3.47Å; A667-A671 PolarHBondContact O-N 3.43Å
668	V	89.8	Confident	86.2	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.9	-46.1	173.6	171.2	0	0	0	0	111.3	F142 M211 H664 F665 Q670 A671 L672	F142-V668 HydrophobicContact CD2-CG2 4.31Å; F142-V668 HydrophobicContact CE2-CG2 3.96Å; M211-V668 HydrophobicContact CB-CG1 3.96Å; M211-V668 HydrophobicContact CG-CG1 4.31Å; M211-V668 HydrophobicContact SD-CG1 4.32Å; M211-V668 HydrophobicContact SD-CG2 4.46Å; H664-V668 WeakPolarHBondContact O-CG2 3.3Å; H664-V668 PolarHBondContact O-N 2.93Å; H664-V668 VanDerWaalsContact O-N 3.09Å; F665-V668 PolarHBondContact O-N 3.37Å; V668-Q670 VanDerWaalsContact C-N 3.3Å; V668-Q670 PolarHBondContact O-N 2.86Å; V668-A671 PolarHBondContact O-N 3.09Å; V668-L672 HydrophobicContact CG1-CD1 4.32Å; V668-L672 WeakPolarHBondContact O-CG 3.38Å; V668-L672 PolarHBondContact O-N 3.29Å
669	N	87	Confident	86.9	Confident	78 Å²	78	22.8 Å²	22.8	42%	0.417	13%	0.125	S	C	.	.	H	α-helix	trans	-61.9	-38.4	177.9	-71	-21.8	0	0	0	112.2	F665 A666 L672 A673	F665-N669 PolarHBondContact O-N 3.44Å; A666-N669 PolarHBondContact O-N 3.32Å; N669-L672 PolarHBondContact O-N 2.97Å; N669-A673 PolarHBondContact O-N 3.12Å
670	Q	90.6	Very high	87.5	Confident	17 Å²	17	26.3 Å²	26.3	8%	0.079	14%	0.14	C	C	.	.	H	α-helix	trans	-68.8	-38.2	174.6	-73.9	178.7	0.6	0	0	112.4	Y507 L615 A666 A667 V668 L672 A673	Y507-Q670 HydrophobicContact CD1-CB 4.45Å; Y507-Q670 HydrophobicContact CD1-CG 4.02Å; Y507-Q670 HydrophobicContact CE1-CB 4.16Å; Y507-Q670 HydrophobicContact CE1-CG 4.1Å; Y507-Q670 PolarHBondContact OH-O 2.89Å; L615-Q670 HydrophobicContact CD1-CB 3.84Å; A666-Q670 WeakPolarHBondContact O-CG 3.07Å; A666-Q670 PolarHBondContact O-N 3.26Å; A667-Q670 PolarHBondContact O-N 3.47Å; V668-Q670 VanDerWaalsContact C-N 3.3Å; V668-Q670 PolarHBondContact O-N 2.86Å; Q670-L672 VanDerWaalsContact C-N 3.28Å; Q670-L672 PolarHBondContact O-N 3.08Å; Q670-A673 VanDerWaalsContact O-CB 3.3Å; Q670-A673 WeakPolarHBondContact O-CB 3.33Å; Q670-A673 PolarHBondContact O-N 3.16Å
671	A	92	Very high	87.7	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.9	-36.5	173	0	0	0	0	0	112.2	F142 M211 L615 F618 A667 V668 A673 A674 P675	F142-A671 HydrophobicContact CE2-CB 4.45Å; F142-A671 HydrophobicContact CZ-CB 4.04Å; M211-A671 HydrophobicContact CG-CB 4.44Å; M211-A671 HydrophobicContact SD-CB 3.8Å; L615-A671 HydrophobicContact CD2-CB 3.82Å; F618-A671 HydrophobicContact CE1-CB 4.26Å; A667-A671 PolarHBondContact O-N 3.43Å; V668-A671 PolarHBondContact O-N 3.09Å; A671-A673 PolarHBondContact O-N 3.24Å; A671-A674 WeakPolarHBondContact O-CB 3.39Å; A671-A674 PolarHBondContact O-N 2.97Å; A671-P675 WeakPolarHBondContact O-CD 3.32Å
672	L	91	Very high	88.1	Confident	32 Å²	32	19.7 Å²	19.7	17%	0.168	11%	0.11	C	C	.	.	H	α-helix	trans	-67.4	-21.8	174.4	-67.8	172.7	0	0	0	113.2	T207 V208 M211 V668 N669 Q670 A674 P675 P725	T207-L672 HydrophobicContact CG2-CD2 4.33Å; V208-L672 HydrophobicContact CB-CD2 4.46Å; V208-L672 HydrophobicContact CG2-CD2 3.86Å; M211-L672 HydrophobicContact CB-CD2 4.05Å; M211-L672 HydrophobicContact CB-CG 4.48Å; M211-L672 HydrophobicContact CG-CD2 3.98Å; M211-L672 HydrophobicContact CG-CG 4.3Å; V668-L672 HydrophobicContact CG1-CD1 4.32Å; V668-L672 WeakPolarHBondContact O-CG 3.38Å; V668-L672 PolarHBondContact O-N 3.29Å; N669-L672 PolarHBondContact O-N 2.97Å; Q670-L672 VanDerWaalsContact C-N 3.28Å; Q670-L672 PolarHBondContact O-N 3.08Å; L672-A674 VanDerWaalsContact C-N 3.32Å; L672-P675 WeakPolarHBondContact O-CD 3.35Å; L672-P675 WeakPolarHBondContact O-CG 3.22Å; L672-P725 HydrophobicContact CD1-CG 4.41Å
673	A	89.8	Confident	88.5	Confident	31 Å²	31	20.4 Å²	20.4	26%	0.256	11%	0.105	S	C	.	.	H	α-helix	trans	-71.5	-27	175	0	0	0	0	0	112.7	N669 Q670 A671 I676 L677	N669-A673 PolarHBondContact O-N 3.12Å; Q670-A673 VanDerWaalsContact O-CB 3.3Å; Q670-A673 WeakPolarHBondContact O-CB 3.33Å; Q670-A673 PolarHBondContact O-N 3.16Å; A671-A673 PolarHBondContact O-N 3.24Å; A673-I676 PolarHBondContact O-N 2.93Å; A673-L677 WeakPolarHBondContact O-CG 3.4Å; A673-L677 PolarHBondContact O-N 3.37Å
674	A	91.9	Very high	88.3	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-58.3	-52	-178.6	0	0	0	0	0	114.5	F618 T619 M622 A671 L672 I676 L677 C678	F618-A674 HydrophobicContact CD1-CB 3.98Å; F618-A674 HydrophobicContact CE1-CB 3.71Å; T619-A674 HydrophobicContact CG2-CB 4.18Å; M622-A674 HydrophobicContact CB-CB 4Å; M622-A674 HydrophobicContact CG-CB 4.06Å; A671-A674 WeakPolarHBondContact O-CB 3.39Å; A671-A674 PolarHBondContact O-N 2.97Å; L672-A674 VanDerWaalsContact C-N 3.32Å; A674-I676 VanDerWaalsContact C-N 3.29Å; A674-I676 PolarHBondContact O-N 2.89Å; A674-L677 PolarHBondContact O-N 3.49Å; A674-C678 PolarHBondContact O-N 3.08Å
675	P	91.5	Very high	87.9	Confident	2 Å²	2	23 Å²	23	1%	0.013	12%	0.116	C	C	.	.	H	α-helix	trans	-67.1	-28	176	26.5	-36.3	0	0	0	113.2	L204 T207 A671 L672 C678 L679	L204-P675 HydrophobicContact CB-CB 4.28Å; L204-P675 HydrophobicContact CD1-CB 3.98Å; L204-P675 HydrophobicContact CD1-CG 3.88Å; T207-P675 HydrophobicContact CG2-CG 4.04Å; A671-P675 WeakPolarHBondContact O-CD 3.32Å; L672-P675 WeakPolarHBondContact O-CD 3.35Å; L672-P675 WeakPolarHBondContact O-CG 3.22Å; P675-C678 WeakPolarHBondContact O-CB 3.31Å; P675-C678 PolarHBondContact O-N 3.28Å; P675-L679 WeakPolarHBondContact O-CG 3.24Å; P675-L679 PolarHBondContact O-N 3.27Å
676	I	90.8	Very high	87.6	Confident	39 Å²	39	22.3 Å²	22.3	20%	0.2	11%	0.114	C	C	.	.	H	α-helix	trans	-67.1	-43.8	174.6	-59.8	171.6	0	0	0	110	L204 A673 A674 C678 L679 F680 L704	L204-I676 HydrophobicContact CD1-CG1 4.41Å; A673-I676 PolarHBondContact O-N 2.93Å; A674-I676 VanDerWaalsContact C-N 3.29Å; A674-I676 PolarHBondContact O-N 2.89Å; I676-C678 VanDerWaalsContact C-N 3.32Å; I676-C678 PolarHBondContact O-N 3.43Å; I676-L679 PolarHBondContact O-N 3.04Å; I676-F680 PolarHBondContact O-N 3.46Å; I676-L704 HydrophobicContact CG2-CD1 4.29Å
677	L	88.6	Confident	87.3	Confident	43 Å²	43	23.9 Å²	23.9	23%	0.225	12%	0.119	C	C	.	.	H	α-helix	trans	-63	-38.5	173.3	-73.5	171.6	0	0	0	111.8	I511 T619 A673 A674 F680 W681	I511-L677 HydrophobicContact CD1-CD1 3.94Å; I511-L677 HydrophobicContact CG2-CD1 4.45Å; T619-L677 HydrophobicContact CG2-CD1 3.6Å; A673-L677 WeakPolarHBondContact O-CG 3.4Å; A673-L677 PolarHBondContact O-N 3.37Å; A674-L677 PolarHBondContact O-N 3.49Å; L677-F680 PolarHBondContact O-N 3.13Å; L677-W681 WeakPolarHBondContact O-CB 3.47Å; L677-W681 PolarHBondContact O-N 3.37Å
678	C	89.8	Confident	86.4	Confident	3 Å²	3	25 Å²	25	2%	0.02	13%	0.125	C	C	.	.	H	α-helix	trans	-58.9	-46.7	172.5	-176.1	0	0	0	0	112	M622 A674 P675 I676 F680 W681 L682	M622-C678 PolarHBondContact O-SG 3.45Å; A674-C678 PolarHBondContact O-N 3.08Å; P675-C678 WeakPolarHBondContact O-CB 3.31Å; P675-C678 PolarHBondContact O-N 3.28Å; I676-C678 VanDerWaalsContact C-N 3.32Å; I676-C678 PolarHBondContact O-N 3.43Å; C678-F680 PolarHBondContact O-N 3.17Å; C678-W681 PolarHBondContact O-N 3.14Å; C678-L682 WeakPolarHBondContact O-CG 3.29Å; C678-L682 PolarHBondContact O-N 2.86Å
679	L	90.8	Very high	85.5	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-61.9	-42.7	175.9	-74	168.7	0	0	0	112.2	A200 L204 P675 I676 W681 L682 Y683 V703 L704 T707	A200-L679 HydrophobicContact CB-CD2 3.59Å; A200-L679 HydrophobicContact CB-CG 4.5Å; L204-L679 HydrophobicContact CD2-CD1 4.18Å; P675-L679 WeakPolarHBondContact O-CG 3.24Å; P675-L679 PolarHBondContact O-N 3.27Å; I676-L679 PolarHBondContact O-N 3.04Å; L679-W681 VanDerWaalsContact C-N 3.33Å; L679-W681 PolarHBondContact O-N 3.17Å; L679-L682 PolarHBondContact O-N 3.44Å; L679-Y683 WeakPolarHBondContact O-CB 3.46Å; L679-Y683 PolarHBondContact O-N 2.9Å; L679-V703 HydrophobicContact CD1-CG1 4.17Å; L679-V703 HydrophobicContact CD2-CG1 4.3Å; L679-L704 HydrophobicContact CB-CD1 4.08Å; L679-T707 HydrophobicContact CD1-CG2 4.26Å
680	F	88.4	Confident	84.9	Confident	92 Å²	92	26.2 Å²	26.2	40%	0.404	13%	0.127	S	C	.	.	H	α-helix	trans	-59.3	-44.9	174.6	174	-96.6	0	0	0	111.6	I676 L677 C678 Y683 F684 L704	I676-F680 PolarHBondContact O-N 3.46Å; L677-F680 PolarHBondContact O-N 3.13Å; C678-F680 PolarHBondContact O-N 3.17Å; F680-Y683 PolarHBondContact O-N 3.07Å; F680-F684 WeakPolarHBondContact O-CB 3.45Å; F680-F684 PolarHBondContact O-N 3.24Å; F680-L704 HydrophobicContact CB-CD1 4.29Å; F680-L704 HydrophobicContact CB-CD2 4.33Å; F680-L704 HydrophobicContact CD2-CD2 4.15Å
681	W	82.6	Confident	84	Confident	11 Å²	11	25.9 Å²	25.9	4%	0.042	13%	0.128	C	C	.	.	H	α-helix	trans	-66.8	-40.2	178.5	-77.5	128.8	0	0	0	113.2	L515 I516 L520 F548 L677 C678 L679 F684 F685	L515-W681 HydrophobicContact CG-CZ2 4.4Å; I516-W681 HydrophobicContact CG1-CZ2 4.21Å; L520-W681 HydrophobicContact CD2-CH2 4.06Å; L520-W681 HydrophobicContact CD2-CZ3 4Å; L520-W681 HydrophobicContact CG-CH2 4.12Å; F548-W681 HydrophobicContact CE1-CE3 4.4Å; F548-W681 AromaticContact CE2-CE3 3.73Å; F548-W681 HydrophobicContact CE2-CE3 3.73Å; F548-W681 AromaticContact CE2-CZ3 3.72Å; F548-W681 HydrophobicContact CE2-CZ3 3.72Å; F548-W681 AromaticContact CZ-CD2 3.89Å; F548-W681 HydrophobicContact CZ-CD2 3.89Å; F548-W681 AromaticContact CZ-CE3 3.27Å; F548-W681 HydrophobicContact CZ-CE3 3.27Å; F548-W681 HydrophobicContact CZ-CH2 4.24Å; F548-W681 AromaticContact CZ-CZ3 3.47Å; F548-W681 HydrophobicContact CZ-CZ3 3.47Å; F548-W681 VanDerWaalsContact CZ-CZ3 3.47Å; L677-W681 WeakPolarHBondContact O-CB 3.47Å; L677-W681 PolarHBondContact O-N 3.37Å; C678-W681 PolarHBondContact O-N 3.14Å; L679-W681 VanDerWaalsContact C-N 3.33Å; L679-W681 PolarHBondContact O-N 3.17Å; W681-F684 HydrophobicContact CE3-CB 4.44Å; W681-F684 HydrophobicContact CE3-CD1 4.2Å; W681-F684 HydrophobicContact CZ3-CD1 4.15Å; W681-F684 PolarHBondContact O-N 3.26Å; W681-F685 WeakPolarHBondContact O-CB 3.3Å; W681-F685 PolarHBondContact O-N 3.07Å
682	L	85.2	Confident	83.1	Confident	7 Å²	7	28 Å²	28	4%	0.037	14%	0.139	C	C	.	.	H	α-helix	trans	-66.2	-40.1	174.8	-75.4	172.8	0	0	0	112.1	A200 I626 T627 C678 L679 F685 S686	A200-L682 HydrophobicContact CB-CD1 3.42Å; A200-L682 VanDerWaalsContact CB-CD1 3.42Å; I626-L682 HydrophobicContact CB-CD1 4.31Å; I626-L682 HydrophobicContact CB-CD2 4.47Å; I626-L682 HydrophobicContact CD1-CD1 3.81Å; I626-L682 HydrophobicContact CG2-CD1 3.99Å; I626-L682 HydrophobicContact CG2-CD2 3.92Å; T627-L682 HydrophobicContact CG2-CD2 3.76Å; C678-L682 WeakPolarHBondContact O-CG 3.29Å; C678-L682 PolarHBondContact O-N 2.86Å; L679-L682 PolarHBondContact O-N 3.44Å; L682-F685 PolarHBondContact O-N 3.44Å; L682-S686 WeakPolarHBondContact O-CB 3.4Å; L682-S686 PolarHBondContact O-N 3.41Å
683	Y	86.5	Confident	82.3	Confident	40 Å²	40	33.6 Å²	33.6	16%	0.157	16%	0.162	C	C	.	.	H	α-helix	trans	-59.2	-48.5	172	165.2	-105.6	0	0	0	110.8	L679 F680 F685 S686 F687 F701 L704	L679-Y683 WeakPolarHBondContact O-CB 3.46Å; L679-Y683 PolarHBondContact O-N 2.9Å; F680-Y683 PolarHBondContact O-N 3.07Å; Y683-F685 PolarHBondContact O-N 3.22Å; Y683-S686 PolarHBondContact O-N 3.02Å; Y683-F687 VanDerWaalsContact O-CB 3.3Å; Y683-F687 WeakPolarHBondContact O-CB 3.48Å; Y683-F687 PolarHBondContact O-N 3.32Å; Y683-F701 HydrophobicContact CD2-CB 3.81Å; Y683-F701 HydrophobicContact CD2-CD2 4.35Å; Y683-F701 HydrophobicContact CE1-CD2 4.43Å; Y683-F701 HydrophobicContact CE2-CB 3.64Å; Y683-F701 AromaticContact CE2-CD2 3.78Å; Y683-F701 HydrophobicContact CE2-CD2 3.78Å; Y683-F701 HydrophobicContact CE2-CG 4.08Å; Y683-F701 AromaticContact CZ-CD2 3.82Å; Y683-L704 HydrophobicContact CD1-CD2 4.32Å; Y683-L704 HydrophobicContact CG-CD2 4.44Å
684	F	81.2	Confident	81.7	Confident	33 Å²	33	32.9 Å²	32.9	15%	0.145	16%	0.156	C	C	.	.	H	α-helix	trans	-61.3	-45.3	179.4	-178.1	-99.1	0	0	0	112	L520 V547 F548 F680 W681 F687 L688	L520-F684 HydrophobicContact CD2-CE1 4.15Å; L520-F684 HydrophobicContact CD2-CZ 4.06Å; V547-F684 HydrophobicContact CB-CE1 4.44Å; V547-F684 HydrophobicContact CG1-CE1 3.75Å; V547-F684 HydrophobicContact CG1-CZ 4.31Å; F548-F684 HydrophobicContact CD2-CD1 4.16Å; F548-F684 HydrophobicContact CD2-CE1 4.18Å; F548-F684 AromaticContact CE2-CD1 3.57Å; F548-F684 HydrophobicContact CE2-CD1 3.57Å; F548-F684 AromaticContact CE2-CE1 3.75Å; F548-F684 HydrophobicContact CE2-CE1 3.75Å; F680-F684 WeakPolarHBondContact O-CB 3.45Å; F680-F684 PolarHBondContact O-N 3.24Å; W681-F684 HydrophobicContact CE3-CB 4.44Å; W681-F684 HydrophobicContact CE3-CD1 4.2Å; W681-F684 HydrophobicContact CZ3-CD1 4.15Å; W681-F684 PolarHBondContact O-N 3.26Å; F684-F687 PolarHBondContact O-N 3.44Å; F684-L688 HydrophobicContact CD1-CD1 3.91Å; F684-L688 HydrophobicContact CE1-CD1 3.32Å; F684-L688 HydrophobicContact CE1-CG 4.2Å; F684-L688 HydrophobicContact CE2-CD1 4.37Å; F684-L688 HydrophobicContact CZ-CD1 3.6Å; F684-L688 HydrophobicContact CZ-CD2 4.45Å; F684-L688 HydrophobicContact CZ-CG 4.19Å; F684-L688 WeakPolarHBondContact O-CG 3.44Å; F684-L688 PolarHBondContact O-N 3.28Å
685	F	77.2	Confident	81.4	Confident	23 Å²	23	36.9 Å²	36.9	10%	0.101	18%	0.182	C	C	.	.	H	α-helix	trans	-59.5	-47.3	174.3	176.5	-96	0	0	0	111.9	I183 F548 W681 L682 Y683 F687 L688 R689	I183-F685 HydrophobicContact CD1-CD1 4.15Å; I183-F685 HydrophobicContact CD1-CE1 3.74Å; I183-F685 HydrophobicContact CG1-CE1 3.91Å; I183-F685 HydrophobicContact CG1-CZ 4.29Å; I183-F685 HydrophobicContact CG2-CD1 4.5Å; I183-F685 HydrophobicContact CG2-CE1 3.86Å; I183-F685 HydrophobicContact CG2-CE2 4.07Å; I183-F685 HydrophobicContact CG2-CZ 3.61Å; F548-F685 HydrophobicContact CB-CD2 4.18Å; F548-F685 HydrophobicContact CG-CD2 4.44Å; W681-F685 WeakPolarHBondContact O-CB 3.3Å; W681-F685 PolarHBondContact O-N 3.07Å; L682-F685 PolarHBondContact O-N 3.44Å; Y683-F685 PolarHBondContact O-N 3.22Å; F685-F687 VanDerWaalsContact C-N 3.34Å; F685-F687 PolarHBondContact O-N 3.46Å; F685-L688 PolarHBondContact O-N 3.26Å; F685-R689 WeakPolarHBondContact O-CB 3.45Å; F685-R689 PolarHBondContact O-N 2.87Å; F685-R689 VanDerWaalsContact O-N 3.09Å
686	S	78.6	Confident	80.9	Confident	5 Å²	5	37 Å²	37	4%	0.035	18%	0.183	C	C	.	.	H	α-helix	trans	-65.3	-39.5	-179.3	-165	0	0	0	0	111.1	L682 Y683 R689 L690 T697	L682-S686 WeakPolarHBondContact O-CB 3.4Å; L682-S686 PolarHBondContact O-N 3.41Å; Y683-S686 PolarHBondContact O-N 3.02Å; S686-R689 PolarHBondContact O-N 3.16Å; S686-L690 WeakPolarHBondContact O-CB 3.44Å; S686-L690 PolarHBondContact O-N 2.88Å; S686-L690 WeakPolarHBondContact OG-CD1 3.46Å; S686-T697 WeakPolarHBondContact O-CG2 3.47Å; S686-T697 WeakPolarHBondContact OG-CG2 3.29Å
687	F	79.3	Confident	80.5	Confident	45 Å²	45	35.3 Å²	35.3	20%	0.197	17%	0.174	C	C	.	.	H	α-helix	trans	-61.4	-47.2	175.8	165.9	-108	0	0	0	112.3	Y683 F684 F685 R689 G691 M692	Y683-F687 VanDerWaalsContact O-CB 3.3Å; Y683-F687 WeakPolarHBondContact O-CB 3.48Å; Y683-F687 PolarHBondContact O-N 3.32Å; F684-F687 PolarHBondContact O-N 3.44Å; F685-F687 VanDerWaalsContact C-N 3.34Å; F685-F687 PolarHBondContact O-N 3.46Å; F687-R689 VanDerWaalsContact C-N 3.33Å; F687-R689 PolarHBondContact O-N 2.8Å; F687-G691 VanDerWaalsContact O-CA 3.26Å; F687-G691 WeakPolarHBondContact O-CA 3.37Å; F687-G691 PolarHBondContact O-N 2.88Å; F687-G691 VanDerWaalsContact O-N 3.1Å; F687-M692 HydrophobicContact CD2-CG 3.65Å; F687-M692 HydrophobicContact CD2-SD 3.22Å; F687-M692 WeakPolarHBondContact CD2-SD 3.34Å; F687-M692 HydrophobicContact CE2-CG 3.46Å; F687-M692 VanDerWaalsContact CE2-CG 3.46Å; F687-M692 HydrophobicContact CE2-SD 3.43Å; F687-M692 WeakPolarHBondContact CE2-SD 3.46Å; F687-M692 HydrophobicContact CG-SD 4.34Å
688	L	71.9	Confident	80.5	Confident	24 Å²	24	37.3 Å²	37.3	13%	0.126	19%	0.185	C	C	.	.	H	α-helix	trans	-64.2	-39.4	179	-71.4	178.5	0	0	0	111.9	L23 L544 V547 F684 F685	L23-L688 HydrophobicContact CD1-CD2 4.44Å; L544-L688 HydrophobicContact CB-CD2 3.79Å; L544-L688 HydrophobicContact CD1-CD2 4.47Å; V547-L688 HydrophobicContact CB-CD1 4.06Å; F684-L688 HydrophobicContact CD1-CD1 3.91Å; F684-L688 HydrophobicContact CE1-CD1 3.32Å; F684-L688 HydrophobicContact CE1-CG 4.2Å; F684-L688 HydrophobicContact CE2-CD1 4.37Å; F684-L688 HydrophobicContact CZ-CD1 3.6Å; F684-L688 HydrophobicContact CZ-CD2 4.45Å; F684-L688 HydrophobicContact CZ-CG 4.19Å; F684-L688 WeakPolarHBondContact O-CG 3.44Å; F684-L688 PolarHBondContact O-N 3.28Å; F685-L688 PolarHBondContact O-N 3.26Å
689	R	71.6	Confident	80.4	Confident	56 Å²	56	40.7 Å²	40.7	21%	0.211	20%	0.199	C	C	.	.	H	α-helix	trans	-88.9	-42.6	-171	-164.1	-178.2	-168.7	179.1	11.2	114.7	I183 A184 L186 T188 F685 S686 F687	I183-R689 PolarHBondContact O-NH1 2.99Å; A184-R689 PolarHBondContact O-NH2 3.47Å; L186-R689 PolarHBondContact O-NH1 3.29Å; L186-R689 VanDerWaalsContact O-NH1 3.12Å; L186-R689 PolarHBondContact O-NH2 2.7Å; T188-R689 HydrophobicContact CG2-CG 3.76Å; F685-R689 WeakPolarHBondContact O-CB 3.45Å; F685-R689 PolarHBondContact O-N 2.87Å; F685-R689 VanDerWaalsContact O-N 3.09Å; S686-R689 PolarHBondContact O-N 3.16Å; F687-R689 VanDerWaalsContact C-N 3.33Å; F687-R689 PolarHBondContact O-N 2.8Å
690	L	72.7	Confident	80.1	Confident	46 Å²	46	40.7 Å²	40.7	24%	0.241	20%	0.199	C	C	.	.	H	α-helix	trans	-106.6	-14.9	-175.2	-60.9	114.4	0	0	0	113.3	T188 I193 S686 A694 T697	T188-L690 WeakPolarHBondContact O-CD2 3.29Å; I193-L690 HydrophobicContact CD1-CD1 4.22Å; I193-L690 HydrophobicContact CD1-CD2 4.08Å; I193-L690 HydrophobicContact CG2-CD1 4.37Å; S686-L690 WeakPolarHBondContact O-CB 3.44Å; S686-L690 PolarHBondContact O-N 2.88Å; S686-L690 WeakPolarHBondContact OG-CD1 3.46Å; L690-A694 HydrophobicContact CB-CB 3.55Å; L690-A694 HydrophobicContact CD2-CB 4.25Å; L690-A694 HydrophobicContact CG-CB 4.49Å; L690-T697 HydrophobicContact CB-CG2 4.34Å
691	G	72.3	Confident	80.2	Confident	11 Å²	11	40.3 Å²	40.3	11%	0.113	20%	0.198	C	C	.	.			trans	77.2	168.4	-175	0	0	0	0	0	114.3	F687 K693 A694 T697	F687-G691 VanDerWaalsContact O-CA 3.26Å; F687-G691 WeakPolarHBondContact O-CA 3.37Å; F687-G691 PolarHBondContact O-N 2.88Å; F687-G691 VanDerWaalsContact O-N 3.1Å; G691-K693 PolarHBondContact O-N 3.12Å; G691-K693 VanDerWaalsContact O-N 3.14Å; G691-A694 PolarHBondContact O-N 2.94Å; G691-T697 VanDerWaalsContact O-CG2 3.27Å; G691-T697 WeakPolarHBondContact O-CG2 3.36Å; G691-T697 PolarHBondContact O-OG1 2.98Å
692	M	73.3	Confident	80.5	Confident	45 Å²	45	45 Å²	45	22%	0.222	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-20.6	-175	-69.6	-64.8	-65.9	0	0	115.1	W10 F687 L698	W10-M692 HydrophobicContact CH2-CE 3.97Å; F687-M692 HydrophobicContact CD2-CG 3.65Å; F687-M692 HydrophobicContact CD2-SD 3.22Å; F687-M692 WeakPolarHBondContact CD2-SD 3.34Å; F687-M692 HydrophobicContact CE2-CG 3.46Å; F687-M692 VanDerWaalsContact CE2-CG 3.46Å; F687-M692 HydrophobicContact CE2-SD 3.43Å; F687-M692 WeakPolarHBondContact CE2-SD 3.46Å; F687-M692 HydrophobicContact CG-SD 4.34Å; M692-L698 WeakPolarHBondContact O-CD2 3.36Å; M692-L698 WeakPolarHBondContact O-CG 3.46Å
693	K	74	Confident	80.7	Confident	149 Å²	149	45.6 Å²	45.6	65%	0.648	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-12.1	-173.8	-64.4	-171.5	178.1	-176.2	0	113.2	G691	G691-K693 PolarHBondContact O-N 3.12Å; G691-K693 VanDerWaalsContact O-N 3.14Å
694	A	78.6	Confident	80.9	Confident	16 Å²	16	44.2 Å²	44.2	13%	0.132	22%	0.222	C	C	.	.	S	Bend	trans	-68	135.3	179.5	0	0	0	0	0	110.5	L690 G691 A696 T697 L698	L690-A694 HydrophobicContact CB-CB 3.55Å; L690-A694 HydrophobicContact CD2-CB 4.25Å; L690-A694 HydrophobicContact CG-CB 4.49Å; G691-A694 PolarHBondContact O-N 2.94Å; A694-A696 PolarHBondContact O-N 3.25Å; A694-T697 HydrophobicContact CB-CG2 4.3Å; A694-T697 PolarHBondContact N-OG1 2.64Å; A694-T697 PolarHBondContact O-N 3.46Å; A694-T697 VanDerWaalsContact O-N 3.09Å; A694-T697 PolarHBondContact O-OG1 3.3Å; A694-L698 PolarHBondContact O-N 2.71Å; A694-L698 VanDerWaalsContact O-N 3.15Å
695	P	84.2	Confident	81.3	Confident	84 Å²	84	46.1 Å²	46.1	55%	0.545	23%	0.234	S	C	.	.	H	α-helix	trans	-65	-26.5	-177.3	22.8	-31.3	0	0	0	112.8	W194 F699	W194-P695 HydrophobicContact CH2-CB 4.26Å; W194-P695 WeakPolarHBondContact CH2-O 3.48Å; W194-P695 HydrophobicContact CZ2-CB 3.76Å; W194-P695 HydrophobicContact CZ2-CG 4.05Å; P695-F699 WeakPolarHBondContact O-CB 3.26Å; P695-F699 PolarHBondContact O-N 3.08Å
696	A	80.7	Confident	81.8	Confident	5 Å²	5	50.3 Å²	50.3	4%	0.041	26%	0.256	C	S	.	.	H	α-helix	trans	-67.6	-37.4	171.9	0	0	0	0	0	113.5	W194 A694 T700	W194-A696 HydrophobicContact CD2-CB 4.39Å; W194-A696 HydrophobicContact CZ2-CB 4.33Å; A694-A696 PolarHBondContact O-N 3.25Å; A696-T700 WeakPolarHBondContact O-CG2 3.29Å; A696-T700 PolarHBondContact O-N 3.45Å; A696-T700 PolarHBondContact O-OG1 3.24Å
697	T	84.1	Confident	82.2	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.012	26%	0.26	C	S	.	.	H	α-helix	trans	-69	-40.2	175.4	50	0	0	0	0	111.4	S686 L690 G691 A694 T700 F701	S686-T697 WeakPolarHBondContact O-CG2 3.47Å; S686-T697 WeakPolarHBondContact OG-CG2 3.29Å; L690-T697 HydrophobicContact CB-CG2 4.34Å; G691-T697 VanDerWaalsContact O-CG2 3.27Å; G691-T697 WeakPolarHBondContact O-CG2 3.36Å; G691-T697 PolarHBondContact O-OG1 2.98Å; A694-T697 HydrophobicContact CB-CG2 4.3Å; A694-T697 PolarHBondContact N-OG1 2.64Å; A694-T697 PolarHBondContact O-N 3.46Å; A694-T697 VanDerWaalsContact O-N 3.09Å; A694-T697 PolarHBondContact O-OG1 3.3Å; T697-T700 WeakPolarHBondContact CA-OG1 3.46Å; T697-T700 PolarHBondContact O-OG1 3.03Å; T697-F701 VanDerWaalsContact O-CB 3.26Å; T697-F701 WeakPolarHBondContact O-CB 3.32Å; T697-F701 PolarHBondContact O-N 2.95Å
698	L	87.3	Confident	82.5	Confident	85 Å²	85	52.1 Å²	52.1	45%	0.445	27%	0.267	S	S	.	.	H	α-helix	trans	-65.1	-41	175.8	-67.8	174.4	0	0	0	112	M692 A694 F701 L702	M692-L698 WeakPolarHBondContact O-CD2 3.36Å; M692-L698 WeakPolarHBondContact O-CG 3.46Å; A694-L698 PolarHBondContact O-N 2.71Å; A694-L698 VanDerWaalsContact O-N 3.15Å; L698-F701 PolarHBondContact O-N 3.33Å; L698-L702 WeakPolarHBondContact O-CB 3.37Å; L698-L702 PolarHBondContact O-N 2.95Å
699	F	88.1	Confident	83.1	Confident	74 Å²	74	55.5 Å²	55.5	33%	0.325	29%	0.285	S	S	.	.	H	α-helix	trans	-67.8	-47	178.1	-178.3	-107.9	0	0	0	112.2	W194 T197 P695 F701 L702 V703	W194-F699 HydrophobicContact CE3-CD1 4.43Å; W194-F699 HydrophobicContact CH2-CB 3.95Å; W194-F699 HydrophobicContact CH2-CG 4.41Å; W194-F699 HydrophobicContact CZ3-CB 3.77Å; W194-F699 AromaticContact CZ3-CD1 3.8Å; W194-F699 HydrophobicContact CZ3-CD1 3.8Å; W194-F699 AromaticContact CZ3-CG 3.81Å; W194-F699 HydrophobicContact CZ3-CG 3.81Å; T197-F699 HydrophobicContact CG2-CD1 3.44Å; T197-F699 VanDerWaalsContact CG2-CD1 3.44Å; T197-F699 HydrophobicContact CG2-CE1 3.73Å; P695-F699 WeakPolarHBondContact O-CB 3.26Å; P695-F699 PolarHBondContact O-N 3.08Å; F699-F701 VanDerWaalsContact C-N 3.3Å; F699-F701 PolarHBondContact O-N 3.08Å; F699-L702 PolarHBondContact O-N 3.37Å; F699-V703 HydrophobicContact CD1-CG2 4.44Å; F699-V703 HydrophobicContact CD2-CG2 4.45Å; F699-V703 HydrophobicContact CE1-CG2 4.03Å; F699-V703 HydrophobicContact CE2-CG2 4.05Å; F699-V703 HydrophobicContact CZ-CG2 3.81Å; F699-V703 WeakPolarHBondContact O-CG2 3.42Å; F699-V703 PolarHBondContact O-N 3.27Å
700	T	85.4	Confident	83.6	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.006	30%	0.298	C	S	.	.	H	α-helix	trans	-57.7	-42.7	173.8	46.1	0	0	0	0	111.8	T197 A696 T697 V703 L704	T197-T700 HydrophobicContact CG2-CG2 3.31Å; T197-T700 WeakPolarHBondContact OG1-CG2 3.43Å; A696-T700 WeakPolarHBondContact O-CG2 3.29Å; A696-T700 PolarHBondContact O-N 3.45Å; A696-T700 PolarHBondContact O-OG1 3.24Å; T697-T700 WeakPolarHBondContact CA-OG1 3.46Å; T697-T700 PolarHBondContact O-OG1 3.03Å; T700-V703 PolarHBondContact O-N 3.36Å; T700-L704 VanDerWaalsContact O-CB 3.29Å; T700-L704 WeakPolarHBondContact O-CB 3.48Å; T700-L704 PolarHBondContact O-N 2.92Å
701	F	88.8	Confident	83.8	Confident	85 Å²	85	57 Å²	57	37%	0.373	30%	0.304	S	S	.	.	H	α-helix	trans	-62.3	-46	175.8	179.5	-107.8	0	0	0	112.6	Y683 T697 L698 F699 V703 L704 L705	Y683-F701 HydrophobicContact CD2-CB 3.81Å; Y683-F701 HydrophobicContact CD2-CD2 4.35Å; Y683-F701 HydrophobicContact CE1-CD2 4.43Å; Y683-F701 HydrophobicContact CE2-CB 3.64Å; Y683-F701 AromaticContact CE2-CD2 3.78Å; Y683-F701 HydrophobicContact CE2-CD2 3.78Å; Y683-F701 HydrophobicContact CE2-CG 4.08Å; Y683-F701 AromaticContact CZ-CD2 3.82Å; T697-F701 VanDerWaalsContact O-CB 3.26Å; T697-F701 WeakPolarHBondContact O-CB 3.32Å; T697-F701 PolarHBondContact O-N 2.95Å; L698-F701 PolarHBondContact O-N 3.33Å; F699-F701 VanDerWaalsContact C-N 3.3Å; F699-F701 PolarHBondContact O-N 3.08Å; F701-V703 PolarHBondContact O-N 2.83Å; F701-L704 PolarHBondContact O-N 3.08Å; F701-L705 HydrophobicContact CE1-CD2 4.48Å; F701-L705 WeakPolarHBondContact O-CB 3.27Å; F701-L705 PolarHBondContact O-N 3.36Å
702	L	90.2	Very high	84	Confident	108 Å²	108	60.8 Å²	60.8	57%	0.565	32%	0.321	S	S	*	.	H	α-helix	trans	-61.4	-45.1	178.8	-178.7	69.4	0	0	0	111.3	L698 F699 L705 L706	L698-L702 WeakPolarHBondContact O-CB 3.37Å; L698-L702 PolarHBondContact O-N 2.95Å; F699-L702 PolarHBondContact O-N 3.37Å; L702-L705 PolarHBondContact O-N 2.89Å; L702-L706 WeakPolarHBondContact O-CB 3.17Å; L702-L706 PolarHBondContact O-N 2.85Å
703	V	89.1	Confident	84	Confident	20 Å²	20	59.9 Å²	59.9	12%	0.121	32%	0.321	C	S	.	.	H	α-helix	trans	-62.4	-47.4	176.1	172.6	0	0	0	0	110.2	V201 L679 F699 T700 F701 L705 L706 T707	V201-V703 HydrophobicContact CG2-CG1 3.94Å; V201-V703 HydrophobicContact CG2-CG2 4.24Å; L679-V703 HydrophobicContact CD1-CG1 4.17Å; L679-V703 HydrophobicContact CD2-CG1 4.3Å; F699-V703 HydrophobicContact CD1-CG2 4.44Å; F699-V703 HydrophobicContact CD2-CG2 4.45Å; F699-V703 HydrophobicContact CE1-CG2 4.03Å; F699-V703 HydrophobicContact CE2-CG2 4.05Å; F699-V703 HydrophobicContact CZ-CG2 3.81Å; F699-V703 WeakPolarHBondContact O-CG2 3.42Å; F699-V703 PolarHBondContact O-N 3.27Å; T700-V703 PolarHBondContact O-N 3.36Å; F701-V703 PolarHBondContact O-N 2.83Å; V703-L705 VanDerWaalsContact C-N 3.35Å; V703-L705 PolarHBondContact O-N 3.2Å; V703-L706 PolarHBondContact O-N 3.07Å; V703-T707 HydrophobicContact CG1-CG2 4.33Å; V703-T707 VanDerWaalsContact O-CG2 3.3Å; V703-T707 WeakPolarHBondContact O-CG2 3.19Å; V703-T707 PolarHBondContact O-N 3.12Å; V703-T707 PolarHBondContact O-OG1 2.81Å
704	L	89.7	Confident	83.7	Confident	11 Å²	11	55.9 Å²	55.9	6%	0.058	30%	0.304	C	S	.	.	H	α-helix	trans	-59	-46.5	178.1	-178.6	65.5	0	0	0	111.1	I676 L679 F680 Y683 T700 F701 L706 T707 I708	I676-L704 HydrophobicContact CG2-CD1 4.29Å; L679-L704 HydrophobicContact CB-CD1 4.08Å; F680-L704 HydrophobicContact CB-CD1 4.29Å; F680-L704 HydrophobicContact CB-CD2 4.33Å; F680-L704 HydrophobicContact CD2-CD2 4.15Å; Y683-L704 HydrophobicContact CD1-CD2 4.32Å; Y683-L704 HydrophobicContact CG-CD2 4.44Å; T700-L704 VanDerWaalsContact O-CB 3.29Å; T700-L704 WeakPolarHBondContact O-CB 3.48Å; T700-L704 PolarHBondContact O-N 2.92Å; F701-L704 PolarHBondContact O-N 3.08Å; L704-L706 PolarHBondContact O-N 3.37Å; L704-T707 WeakPolarHBondContact CA-OG1 3.34Å; L704-T707 PolarHBondContact O-N 2.97Å; L704-T707 PolarHBondContact O-OG1 3.01Å; L704-I708 HydrophobicContact CD1-CD1 4.11Å; L704-I708 HydrophobicContact CD1-CG1 4.48Å; L704-I708 HydrophobicContact CG-CD1 3.93Å; L704-I708 VanDerWaalsContact O-CG1 3.3Å; L704-I708 WeakPolarHBondContact O-CG1 3.38Å; L704-I708 PolarHBondContact O-N 3.46Å
705	L	89.5	Confident	83.1	Confident	74 Å²	74	60.4 Å²	60.4	39%	0.387	33%	0.33	S	S	.	.	H	α-helix	trans	-61.1	-44.8	177	-177	66.7	0	0	0	111.6	F701 L702 V703 T707 I708 L709	F701-L705 HydrophobicContact CE1-CD2 4.48Å; F701-L705 WeakPolarHBondContact O-CB 3.27Å; F701-L705 PolarHBondContact O-N 3.36Å; L702-L705 PolarHBondContact O-N 2.89Å; V703-L705 VanDerWaalsContact C-N 3.35Å; V703-L705 PolarHBondContact O-N 3.2Å; L705-T707 PolarHBondContact O-N 3.3Å; L705-I708 PolarHBondContact O-N 2.95Å; L705-L709 HydrophobicContact CD1-CD1 4.41Å; L705-L709 HydrophobicContact CD1-CG 4.49Å; L705-L709 HydrophobicContact CG-CD1 3.97Å; L705-L709 HydrophobicContact CG-CG 4.47Å; L705-L709 WeakPolarHBondContact O-CB 3.4Å; L705-L709 VanDerWaalsContact O-CG 3.26Å; L705-L709 WeakPolarHBondContact O-CG 3.44Å; L705-L709 PolarHBondContact O-N 3.49Å
706	L	88.8	Confident	81.9	Confident	110 Å²	110	60.5 Å²	60.5	58%	0.576	33%	0.332	S	S	*	.	H	α-helix	trans	-61.5	-44.5	177.1	-178	66.3	0	0	0	111.1	L702 V703 L704 L709 V710	L702-L706 WeakPolarHBondContact O-CB 3.17Å; L702-L706 PolarHBondContact O-N 2.85Å; V703-L706 PolarHBondContact O-N 3.07Å; L704-L706 PolarHBondContact O-N 3.37Å; L706-L709 PolarHBondContact O-N 3.37Å; L706-V710 WeakPolarHBondContact O-CB 3.43Å; L706-V710 VanDerWaalsContact O-CG2 3.26Å; L706-V710 WeakPolarHBondContact O-CG2 3.33Å; L706-V710 PolarHBondContact O-N 3.21Å
707	T	86.8	Confident	80.7	Confident	17 Å²	17	68.1 Å²	68.1	10%	0.104	36%	0.364	C	S	.	.	H	α-helix	trans	-62.8	-43.9	177.5	58.3	0	0	0	0	111.8	L204 L679 V703 L704 L705 V710 C711	L204-T707 HydrophobicContact CD2-CG2 3.41Å; L204-T707 VanDerWaalsContact CD2-CG2 3.41Å; L679-T707 HydrophobicContact CD1-CG2 4.26Å; V703-T707 HydrophobicContact CG1-CG2 4.33Å; V703-T707 VanDerWaalsContact O-CG2 3.3Å; V703-T707 WeakPolarHBondContact O-CG2 3.19Å; V703-T707 PolarHBondContact O-N 3.12Å; V703-T707 PolarHBondContact O-OG1 2.81Å; L704-T707 WeakPolarHBondContact CA-OG1 3.34Å; L704-T707 PolarHBondContact O-N 2.97Å; L704-T707 PolarHBondContact O-OG1 3.01Å; L705-T707 PolarHBondContact O-N 3.3Å; T707-V710 PolarHBondContact O-N 3.33Å; T707-C711 WeakPolarHBondContact O-CB 3.32Å; T707-C711 PolarHBondContact O-N 2.93Å; T707-C711 PolarHBondContact O-SG 3Å
708	I	86.1	Confident	79.2	Confident	71 Å²	71	69.4 Å²	69.4	36%	0.364	38%	0.379	S	S	.	.	H	α-helix	trans	-63.2	-43.7	176	-67.6	168.1	0	0	0	110.7	L704 L705 V710 C711 L712	L704-I708 HydrophobicContact CD1-CD1 4.11Å; L704-I708 HydrophobicContact CD1-CG1 4.48Å; L704-I708 HydrophobicContact CG-CD1 3.93Å; L704-I708 VanDerWaalsContact O-CG1 3.3Å; L704-I708 WeakPolarHBondContact O-CG1 3.38Å; L704-I708 PolarHBondContact O-N 3.46Å; L705-I708 PolarHBondContact O-N 2.95Å; I708-V710 VanDerWaalsContact C-N 3.35Å; I708-V710 PolarHBondContact O-N 3.37Å; I708-C711 PolarHBondContact O-N 3.2Å; I708-L712 HydrophobicContact CG2-CD1 3.8Å; I708-L712 HydrophobicContact CG2-CG 4.24Å; I708-L712 WeakPolarHBondContact O-CB 3.4Å; I708-L712 VanDerWaalsContact O-CG 3.32Å; I708-L712 WeakPolarHBondContact O-CG 3.3Å; I708-L712 PolarHBondContact O-N 2.84Å
709	L	84.8	Confident	77.1	Confident	96 Å²	96	68.7 Å²	68.7	50%	0.503	38%	0.38	S	S	.	.	H	α-helix	trans	-62.2	-40.6	176.6	-76.1	168.7	0	0	0	111.9	L705 L706 L712 A713	L705-L709 HydrophobicContact CD1-CD1 4.41Å; L705-L709 HydrophobicContact CD1-CG 4.49Å; L705-L709 HydrophobicContact CG-CD1 3.97Å; L705-L709 HydrophobicContact CG-CG 4.47Å; L705-L709 WeakPolarHBondContact O-CB 3.4Å; L705-L709 VanDerWaalsContact O-CG 3.26Å; L705-L709 WeakPolarHBondContact O-CG 3.44Å; L705-L709 PolarHBondContact O-N 3.49Å; L706-L709 PolarHBondContact O-N 3.37Å; L709-L712 PolarHBondContact O-N 3.15Å; L709-A713 WeakPolarHBondContact O-CB 2.89Å; L709-A713 PolarHBondContact O-N 3.12Å
710	V	81.3	Confident	75.2	Confident	80 Å²	80	71.3 Å²	71.3	49%	0.485	39%	0.391	S	S	.	.	H	α-helix	trans	-64.4	-43.2	174.6	170.3	0	0	0	0	110.7	L706 T707 I708 A713 H714	L706-V710 WeakPolarHBondContact O-CB 3.43Å; L706-V710 VanDerWaalsContact O-CG2 3.26Å; L706-V710 WeakPolarHBondContact O-CG2 3.33Å; L706-V710 PolarHBondContact O-N 3.21Å; T707-V710 PolarHBondContact O-N 3.33Å; I708-V710 VanDerWaalsContact C-N 3.35Å; I708-V710 PolarHBondContact O-N 3.37Å; V710-A713 PolarHBondContact O-N 3.42Å; V710-H714 WeakPolarHBondContact O-CB 3.36Å; V710-H714 PolarHBondContact O-N 2.79Å
711	C	77	Confident	73.3	Confident	54 Å²	54	78.3 Å²	78.3	37%	0.365	42%	0.422	S	S	.	.	H	α-helix	trans	-62.7	-43.2	175	-71.1	0	0	0	0	112.3	T707 I708 H714 T715	T707-C711 WeakPolarHBondContact O-CB 3.32Å; T707-C711 PolarHBondContact O-N 2.93Å; T707-C711 PolarHBondContact O-SG 3Å; I708-C711 PolarHBondContact O-N 3.2Å; C711-H714 PolarHBondContact O-N 2.93Å; C711-T715 WeakPolarHBondContact O-CB 3.25Å; C711-T715 PolarHBondContact O-N 3.39Å; C711-T715 PolarHBondContact O-OG1 3.32Å
712	L	76.6	Confident	71.2	Confident	90 Å²	90	81.7 Å²	81.7	47%	0.471	44%	0.438	S	S	.	.	H	α-helix	trans	-68.5	-41.2	176.9	-72.3	171.5	0	0	0	111.6	I708 L709 H714 T715 C716	I708-L712 HydrophobicContact CG2-CD1 3.8Å; I708-L712 HydrophobicContact CG2-CG 4.24Å; I708-L712 WeakPolarHBondContact O-CB 3.4Å; I708-L712 VanDerWaalsContact O-CG 3.32Å; I708-L712 WeakPolarHBondContact O-CG 3.3Å; I708-L712 PolarHBondContact O-N 2.84Å; L709-L712 PolarHBondContact O-N 3.15Å; L712-H714 VanDerWaalsContact C-N 3.27Å; L712-H714 PolarHBondContact O-N 3.14Å; L712-T715 PolarHBondContact O-N 2.87Å; L712-C716 WeakPolarHBondContact O-CB 3.25Å; L712-C716 PolarHBondContact O-N 3.37Å
713	A	72.4	Confident	68.8	Low	25 Å²	25	81.6 Å²	81.6	21%	0.207	44%	0.438	C	S	.	.	H	α-helix	trans	-60.7	-39.7	175.4	0	0	0	0	0	111.6	L709 V710 F717 G718	L709-A713 WeakPolarHBondContact O-CB 2.89Å; L709-A713 PolarHBondContact O-N 3.12Å; V710-A713 PolarHBondContact O-N 3.42Å; A713-F717 WeakPolarHBondContact O-CB 3.48Å; A713-F717 PolarHBondContact O-N 2.87Å; A713-F717 VanDerWaalsContact O-N 3.15Å; A713-G718 PolarHBondContact O-N 3Å
714	H	68.1	Low	66.6	Low	66 Å²	66	81.2 Å²	81.2	31%	0.306	44%	0.436	S	S	.	.	H	α-helix	trans	-67.4	-49.1	174.5	178.9	-89.5	0	0	0	112	V710 C711 L712 G718 S724	V710-H714 WeakPolarHBondContact O-CB 3.36Å; V710-H714 PolarHBondContact O-N 2.79Å; C711-H714 PolarHBondContact O-N 2.93Å; L712-H714 VanDerWaalsContact C-N 3.27Å; L712-H714 PolarHBondContact O-N 3.14Å; H714-G718 PolarHBondContact O-N 3.04Å; H714-S724 PolarHBondContact NE2-OG 2.88Å; H714-S724 VanDerWaalsContact NE2-OG 3.12Å
715	T	66.6	Low	64.2	Low	110 Å²	110	81.4 Å²	81.4	68%	0.675	44%	0.438	S	S	*	.	H	α-helix	trans	-71.8	-41.4	-174.5	-47.4	0	0	0	0	112.6	C711 L712	C711-T715 WeakPolarHBondContact O-CB 3.25Å; C711-T715 PolarHBondContact O-N 3.39Å; C711-T715 PolarHBondContact O-OG1 3.32Å; L712-T715 PolarHBondContact O-N 2.87Å
716	C	59	Low	62.3	Low	87 Å²	87	80.1 Å²	80.1	59%	0.588	43%	0.431	S	S	*	.	H	α-helix	trans	-91.5	-35	-173.1	-62.4	0	0	0	0	113.8	L712	L712-C716 WeakPolarHBondContact O-CB 3.25Å; L712-C716 PolarHBondContact O-N 3.37Å
717	F	55.7	Low	60.2	Low	164 Å²	164	79.1 Å²	79.1	72%	0.719	43%	0.426	S	S	*	.	H	α-helix	trans	-113.6	-10.9	-171.7	-62.4	-80.3	0	0	0	114	A713 C719	A713-F717 WeakPolarHBondContact O-CB 3.48Å; A713-F717 PolarHBondContact O-N 2.87Å; A713-F717 VanDerWaalsContact O-N 3.15Å; F717-C719 HydrophobicContact CB-CB 4.37Å; F717-C719 PolarHBondContact O-N 3.26Å
718	G	53.2	Low	58.4	Low	30 Å²	30	80.9 Å²	80.9	31%	0.309	43%	0.431	S	S	.	.			trans	60.6	8.4	-174.6	0	0	0	0	0	114	A713 H714 K721	A713-G718 PolarHBondContact O-N 3Å; H714-G718 PolarHBondContact O-N 3.04Å; G718-K721 PolarHBondContact O-N 3.44Å
719	C	42.6	Very low	56.4	Low	69 Å²	69	85.7 Å²	85.7	47%	0.466	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	140.9	171.1	-72.5	0	0	0	0	108.3	F717	F717-C719 HydrophobicContact CB-CB 4.37Å; F717-C719 PolarHBondContact O-N 3.26Å
720	F	46.9	Very low	54.5	Low	130 Å²	130	83.7 Å²	83.7	57%	0.57	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.9	26.2	-174.6	-47.9	-77.1	0	0	0	116.6	H722 L723 S724	F720-H722 PolarHBondContact O-N 3.4Å; F720-L723 HydrophobicContact CB-CB 4.34Å; F720-L723 HydrophobicContact CB-CD1 4.24Å; F720-L723 HydrophobicContact CD1-CD1 3.82Å; F720-L723 HydrophobicContact CG-CD1 4.34Å; F720-L723 PolarHBondContact O-N 2.98Å; F720-S724 PolarHBondContact O-N 2.62Å
721	K	46.1	Very low	52.7	Low	148 Å²	148	85.5 Å²	85.5	64%	0.643	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-46.2	-32.2	166.9	-96.5	179.9	178.7	178.2	0	113.5	G718 S724 N727	G718-K721 PolarHBondContact O-N 3.44Å; K721-S724 VanDerWaalsContact O-CB 3.24Å; K721-S724 WeakPolarHBondContact O-CB 3.28Å; K721-S724 PolarHBondContact O-N 3.17Å; K721-N727 PolarHBondContact O-ND2 3.44Å
722	H	44	Very low	51	Low	156 Å²	156	90.1 Å²	90.1	72%	0.722	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-69.4	-28.8	177.4	-174.1	-87.1	0	0	0	114.9	F720 S724	F720-H722 PolarHBondContact O-N 3.4Å; H722-S724 VanDerWaalsContact C-N 3.31Å
723	L	40.9	Very low	49.2	Very low	106 Å²	106	89.4 Å²	89.4	56%	0.555	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-86.9	-7	174.6	-71	167.9	0	0	0	112.2	F720	F720-L723 HydrophobicContact CB-CB 4.34Å; F720-L723 HydrophobicContact CB-CD1 4.24Å; F720-L723 HydrophobicContact CD1-CD1 3.82Å; F720-L723 HydrophobicContact CG-CD1 4.34Å; F720-L723 PolarHBondContact O-N 2.98Å
724	S	41.9	Very low	47.5	Very low	11 Å²	11	92.6 Å²	92.6	8%	0.077	49%	0.488	C	S	.	.			trans	-69.4	135.1	-178.4	-165.8	0	0	0	0	110.9	H714 F720 K721 H722 L726	H714-S724 PolarHBondContact NE2-OG 2.88Å; H714-S724 VanDerWaalsContact NE2-OG 3.12Å; F720-S724 PolarHBondContact O-N 2.62Å; K721-S724 VanDerWaalsContact O-CB 3.24Å; K721-S724 WeakPolarHBondContact O-CB 3.28Å; K721-S724 PolarHBondContact O-N 3.17Å; H722-S724 VanDerWaalsContact C-N 3.31Å; S724-L726 PolarHBondContact O-N 3.23Å; S724-L726 WeakPolarHBondContact OG-CD1 3.5Å; S724-L726 PolarHBondContact OG-N 3.36Å
725	P	40.6	Very low	46	Very low	15 Å²	15	93.4 Å²	93.4	10%	0.097	50%	0.501	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-21.6	168.5	26	-33.1	0	0	0	112.1	R212 T215 L672 N727	R212-P725 VanDerWaalsContact CA-CB 3.45Å; R212-P725 HydrophobicContact CB-CB 3.82Å; R212-P725 HydrophobicContact CG-CB 4.21Å; T215-P725 WeakPolarHBondContact CB-O 3.32Å; T215-P725 WeakPolarHBondContact CG2-O 3.46Å; L672-P725 HydrophobicContact CD1-CG 4.41Å; P725-N727 VanDerWaalsContact C-N 3.29Å; P725-N727 PolarHBondContact O-N 2.98Å; P725-N727 VanDerWaalsContact O-N 3.16Å
726	L	48.8	Very low	44.4	Very low	48 Å²	48	95.3 Å²	95.3	25%	0.251	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	9.2	-172.9	-69	107.7	0	0	0	116.8	F665 S724 Y728	F665-L726 HydrophobicContact CB-CD2 3.79Å; F665-L726 HydrophobicContact CD1-CB 4.45Å; F665-L726 HydrophobicContact CD1-CD2 3.39Å; F665-L726 HydrophobicContact CD1-CG 3.86Å; F665-L726 HydrophobicContact CE1-CB 4.47Å; F665-L726 HydrophobicContact CE1-CD2 4.13Å; F665-L726 HydrophobicContact CE1-CG 4.34Å; F665-L726 HydrophobicContact CG-CD2 3.77Å; S724-L726 PolarHBondContact O-N 3.23Å; S724-L726 WeakPolarHBondContact OG-CD1 3.5Å; S724-L726 PolarHBondContact OG-N 3.36Å; L726-Y728 PolarHBondContact O-N 3.49Å; L726-Y728 VanDerWaalsContact O-N 3.15Å
727	N	45.2	Very low	43.4	Very low	88 Å²	88	100.6 Å²	100.6	47%	0.471	52%	0.52	S	S	.	.			trans	-82.8	90.6	172.2	-69.9	-32.8	0	0	0	110	K721 P725	K721-N727 PolarHBondContact O-ND2 3.44Å; P725-N727 VanDerWaalsContact C-N 3.29Å; P725-N727 PolarHBondContact O-N 2.98Å; P725-N727 VanDerWaalsContact O-N 3.16Å
728	Y	49.5	Very low	42.4	Very low	54 Å²	54	95.8 Å²	95.8	21%	0.212	52%	0.516	C	S	.	.			trans	-84.4	147.5	171.6	73.3	-84.4	0	0	0	110.5	E222 K661 F665 L726 T730	E222-Y728 PolarHBondContact OE1-OH 3.42Å; K661-Y728 PolarHBondContact NZ-OH 3.08Å; F665-Y728 AromaticContact CZ-CD1 3.95Å; F665-Y728 HydrophobicContact CZ-CD1 3.95Å; F665-Y728 HydrophobicContact CZ-CG 4.47Å; L726-Y728 PolarHBondContact O-N 3.49Å; L726-Y728 VanDerWaalsContact O-N 3.15Å; Y728-T730 HydrophobicContact CE2-CG2 4.45Å; Y728-T730 WeakPolarHBondContact CE2-OG1 3.19Å; Y728-T730 PolarHBondContact O-N 3.28Å
729	K	43.4	Very low	41.4	Very low	173 Å²	173	99.7 Å²	99.7	75%	0.752	54%	0.539	S	S	*	.			trans	-82.7	111.1	173.6	-156.6	174.4	-175.3	-177.7	0	107.3	E731	K729-E731 PolarHBondContact O-N 2.71Å
730	T	45	Very low	40.8	Very low	54 Å²	54	105.1 Å²	105.1	33%	0.331	56%	0.558	S	S	.	*			trans	-77.6	114	169.3	-47.9	0	0	0	0	106.7	E222 Y728 E732	E222-T730 VanDerWaalsContact OE2-CG2 3.31Å; E222-T730 WeakPolarHBondContact OE2-CG2 3.38Å; Y728-T730 HydrophobicContact CE2-CG2 4.45Å; Y728-T730 WeakPolarHBondContact CE2-OG1 3.19Å; Y728-T730 PolarHBondContact O-N 3.28Å; T730-E732 PolarHBondContact O-N 3.17Å
731	E	42.7	Very low	40.2	Very low	117 Å²	117	103.4 Å²	103.4	55%	0.547	57%	0.567	S	S	.	*			trans	-77.9	109.8	163.2	-75.6	178.3	-164.2	0	0	105.8	K219 K729	K219-E731 IonicContact NZ-OE1 2.71Å; K219-E731 PolarHBondContact NZ-OE1 3.4Å; K219-E731 VanDerWaalsContact NZ-OE1 3.15Å; K729-E731 PolarHBondContact O-N 2.71Å
732	E	41.9	Very low	39.6	Very low	151 Å²	151	105.9 Å²	105.9	71%	0.706	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-61.6	131.2	160.4	-64.3	-164.9	146.7	0	0	106	T730 A734	T730-E732 PolarHBondContact O-N 3.17Å; E732-A734 PolarHBondContact O-N 3.18Å
733	P	39.6	Very low	38.8	Very low	75 Å²	75	102.3 Å²	102.3	49%	0.487	58%	0.579	S	S	.	*	P	Polyproline II helix	trans	-52.8	119.8	171.3	22.8	-30.5	0	0	0	105.7	S735	P733-S735 PolarHBondContact O-N 3.39Å
734	A	34.8	Very low	38.1	Very low	92 Å²	92	106.2 Å²	106.2	76%	0.76	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-46.8	122.3	176.3	0	0	0	0	0	105.9	E732 D736	E732-A734 PolarHBondContact O-N 3.18Å; A734-D736 VanDerWaalsContact C-N 3.26Å; A734-D736 PolarHBondContact O-N 2.82Å
735	S	37.5	Very low	37.3	Very low	83 Å²	83	114.4 Å²	114.4	58%	0.58	63%	0.633	S	S	*	*			trans	-50.9	101.3	170.8	166.9	0	0	0	0	106.2	P733 K737	P733-S735 PolarHBondContact O-N 3.39Å; S735-K737 PolarHBondContact O-N 3.42Å; S735-K737 VanDerWaalsContact OG-CD 3.31Å; S735-K737 WeakPolarHBondContact OG-CD 3.38Å; S735-K737 WeakPolarHBondContact OG-CG 3.33Å
736	D	33.8	Very low	36.8	Very low	151 Å²	151	118.3 Å²	118.3	81%	0.807	66%	0.659	S	S	*	*			trans	-70.2	67.6	167.5	-123.6	-6.1	0	0	0	106.4	A734 G738	A734-D736 VanDerWaalsContact C-N 3.26Å; A734-D736 PolarHBondContact O-N 2.82Å; D736-G738 PolarHBondContact O-N 3.05Å
737	K	36.6	Very low	36	Very low	198 Å²	198	121.1 Å²	121.1	86%	0.861	68%	0.68	S	S	*	*			trans	-77.1	71.2	170.1	-101	172.4	-172.5	-171.8	0	105.8	S735	S735-K737 PolarHBondContact O-N 3.42Å; S735-K737 VanDerWaalsContact OG-CD 3.31Å; S735-K737 WeakPolarHBondContact OG-CD 3.38Å; S735-K737 WeakPolarHBondContact OG-CG 3.33Å
738	G	35.4	Very low	35.8	Very low	62 Å²	62	122.7 Å²	122.7	64%	0.639	70%	0.695	S	S	*	*	S	Bend	trans	153.6	64.9	176	0	0	0	0	0	113.5	D736	D736-G738 PolarHBondContact O-N 3.05Å
739	S	31.6	Very low	35.7	Very low	113 Å²	113	128.3 Å²	128.3	79%	0.79	72%	0.72	S	S	*	*			trans	152.2	54.6	141.1	-169.7	0	0	0	0	112.2
740	E	29.8	Very low	36.5	Very low	183 Å²	183	122.2 Å²	122.2	86%	0.855	70%	0.698	S	S	*	*			trans	-124.9	64	158	-74.4	-169.7	165.1	0	0	108.5
741	A	34.9	Very low	37.4	Very low	93 Å²	93	120.9 Å²	120.9	77%	0.769	69%	0.69	S	S	*	*	S	Bend	trans	-90.7	122.5	154.5	0	0	0	0	0	106.7
742	E	33.7	Very low	39	Very low	200 Å²	200	115.5 Å²	115.5	94%	0.935	67%	0.665	S	S	*	*			trans	65.3	63	170	-62.1	-179.8	156.3	0	0	116.8
743	A	27.3	Very low	40.7	Very low	82 Å²	82	109.1 Å²	109.1	68%	0.678	64%	0.636	S	S	*	*			trans	-102.4	120.2	148.7	0	0	0	0	0	108.4	M745	A743-M745 PolarHBondContact O-N 3.46Å; A743-M745 VanDerWaalsContact O-N 3.14Å
744	H	26.3	Very low	41.9	Very low	188 Å²	188	106.1 Å²	106.1	87%	0.87	62%	0.617	S	S	*	*			trans	-43.2	119	174.7	-89.7	-71.4	0	0	0	111.4	P746	H744-P746 VanDerWaalsContact O-CD 3.27Å; H744-P746 WeakPolarHBondContact O-CD 3.46Å
745	M	25.5	Very low	43.3	Very low	182 Å²	182	110.3 Å²	110.3	90%	0.897	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-57.3	117.9	170.1	-144.7	-165.6	-128.5	0	0	107.8	A743	A743-M745 PolarHBondContact O-N 3.46Å; A743-M745 VanDerWaalsContact O-N 3.14Å
746	P	29.3	Very low	44.3	Very low	98 Å²	98	109.1 Å²	109.1	64%	0.636	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-59.4	156.8	165.4	-13.8	28.2	0	0	0	108.5	H744	H744-P746 VanDerWaalsContact O-CD 3.27Å; H744-P746 WeakPolarHBondContact O-CD 3.46Å
747	P	33.3	Very low	45.6	Very low	106 Å²	106	104.2 Å²	104.2	69%	0.688	57%	0.573	S	S	*	*	S	Bend	trans	-51.5	152.5	175.3	24.1	-33.9	0	0	0	110.5	F749	P747-F749 PolarHBondContact O-N 3.04Å
748	P	40.6	Very low	46.7	Very low	121 Å²	121	97.2 Å²	97.2	79%	0.786	55%	0.545	S	S	*	.			trans	-59.7	102.5	-173.5	24.6	-32.7	0	0	0	109.3	T750	P748-T750 PolarHBondContact O-N 3.18Å
749	F	46.9	Very low	47.6	Very low	172 Å²	172	95.8 Å²	95.8	75%	0.754	53%	0.53	S	S	*	.			trans	-76	96.5	176.7	-148.2	-87.1	0	0	0	106	P747 P751	P747-F749 PolarHBondContact O-N 3.04Å; F749-P751 WeakPolarHBondContact O-CD 3.27Å; F749-P751 VanDerWaalsContact O-N 3.08Å
750	T	59.4	Low	48.8	Very low	46 Å²	46	91 Å²	91	28%	0.282	50%	0.495	S	S	.	.			trans	-68.8	100	175	53.3	0	0	0	0	108.1	P748 Y752	P748-T750 PolarHBondContact O-N 3.18Å; T750-Y752 VanDerWaalsContact C-N 3.35Å; T750-Y752 PolarHBondContact O-N 3.01Å
751	P	64.4	Low	50	Low	26 Å²	26	84.6 Å²	84.6	17%	0.169	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-25.9	-163.9	16.4	-6.9	0	0	0	112.1	L225 P403 F749 V753	L225-P751 HydrophobicContact CD1-CG 3.8Å; L225-P751 HydrophobicContact CD2-CB 3.6Å; L225-P751 HydrophobicContact CD2-CG 3.62Å; L225-P751 HydrophobicContact CG-CG 4.14Å; P403-P751 VanDerWaalsContact CB-O 3.31Å; P403-P751 WeakPolarHBondContact CB-O 3.26Å; P403-P751 HydrophobicContact CG-CB 4.12Å; F749-P751 WeakPolarHBondContact O-CD 3.27Å; F749-P751 VanDerWaalsContact O-N 3.08Å; P751-V753 VanDerWaalsContact C-N 3.32Å; P751-V753 PolarHBondContact O-N 2.73Å
752	Y	76.9	Confident	50.5	Low	3 Å²	3	84 Å²	84	1%	0.012	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	39.8	-176.3	-70.2	-80.7	0	0	0	113.1	T229 Q261 F351 A400 A401 P403 I406 W408 T750	T229-Y752 HydrophobicContact CG2-CD2 3.79Å; T229-Y752 HydrophobicContact CG2-CE2 3.52Å; T229-Y752 HydrophobicContact CG2-CG 4.46Å; T229-Y752 WeakPolarHBondContact OG1-CE2 3.14Å; Q261-Y752 WeakPolarHBondContact CG-O 3.3Å; F351-Y752 HydrophobicContact CB-CD1 4.43Å; F351-Y752 HydrophobicContact CB-CG 4.05Å; F351-Y752 AromaticContact CD1-CD1 3.6Å; F351-Y752 HydrophobicContact CD1-CD1 3.6Å; F351-Y752 HydrophobicContact CD1-CE1 4.02Å; F351-Y752 HydrophobicContact CD1-CG 4.07Å; F351-Y752 HydrophobicContact CD2-CD1 4.29Å; F351-Y752 HydrophobicContact CD2-CG 4.43Å; F351-Y752 AromaticContact CE1-CD1 3.85Å; F351-Y752 HydrophobicContact CE1-CD1 3.85Å; F351-Y752 HydrophobicContact CE1-CE1 4.15Å; F351-Y752 AromaticContact CG-CD1 3.85Å; F351-Y752 HydrophobicContact CG-CD1 3.85Å; F351-Y752 AromaticContact CG-CG 3.93Å; F351-Y752 HydrophobicContact CG-CG 3.93Å; F351-Y752 HydrophobicContact CZ-CD1 4.32Å; A400-Y752 HydrophobicContact CB-CE1 3.77Å; A401-Y752 VanDerWaalsContact O-CE1 3.25Å; A401-Y752 WeakPolarHBondContact O-CE1 3.28Å; A401-Y752 PolarHBondContact O-OH 3.34Å; P403-Y752 HydrophobicContact CG-CD1 4.12Å; P403-Y752 HydrophobicContact CG-CE1 3.8Å; P403-Y752 HydrophobicContact CG-CE2 4.3Å; I406-Y752 HydrophobicContact CD1-CD1 3.84Å; I406-Y752 HydrophobicContact CD1-CE1 3.84Å; W408-Y752 VanDerWaalsContact CH2-O 3.27Å; W408-Y752 WeakPolarHBondContact CH2-O 3.41Å; T750-Y752 VanDerWaalsContact C-N 3.35Å; T750-Y752 PolarHBondContact O-N 3.01Å
753	V	76.3	Confident	51.4	Low	18 Å²	18	78.1 Å²	78.1	11%	0.109	44%	0.437	C	S	.	.	S	Bend	trans	-119.4	137.3	172	-178.5	0	0	0	0	108.4	Q261 P751 R755 L757 N758	Q261-V753 HydrophobicContact CG-CG2 4.02Å; P751-V753 VanDerWaalsContact C-N 3.32Å; P751-V753 PolarHBondContact O-N 2.73Å; V753-R755 PolarHBondContact O-N 3.36Å; V753-R755 VanDerWaalsContact O-N 3.08Å; V753-L757 HydrophobicContact CG1-CB 3.92Å; V753-L757 HydrophobicContact CG1-CD1 4.21Å; V753-N758 VanDerWaalsContact CG1-OD1 3.24Å; V753-N758 WeakPolarHBondContact CG1-OD1 3.5Å
754	P	66.4	Low	52.6	Low	11 Å²	11	80.6 Å²	80.6	7%	0.071	43%	0.429	C	S	.	.			trans	-48.6	121.2	171.4	-26.1	29.5	0	0	0	111	V266 W408 I756 L757	V266-P754 HydrophobicContact CG2-CG 4.13Å; W408-P754 HydrophobicContact CD2-CB 4.45Å; W408-P754 HydrophobicContact CD2-CG 3.79Å; W408-P754 HydrophobicContact CE3-CG 3.68Å; W408-P754 HydrophobicContact CG-CB 4.49Å; W408-P754 HydrophobicContact CG-CG 4.19Å; W408-P754 HydrophobicContact CZ3-CG 4.2Å; P754-I756 PolarHBondContact O-N 3.31Å; P754-L757 HydrophobicContact CB-CD1 4.05Å; P754-L757 HydrophobicContact CB-CG 4.24Å; P754-L757 HydrophobicContact CG-CD1 3.84Å; P754-L757 WeakPolarHBondContact O-CB 3.27Å; P754-L757 PolarHBondContact O-N 3.29Å
755	R	63.6	Low	53.2	Low	180 Å²	180	76.4 Å²	76.4	68%	0.679	42%	0.417	S	S	*	.	H	α-helix	trans	-47.9	-31.8	-176.7	-74.2	-175.7	169.9	166.6	-0.9	114.4	E404 V753 L757 N758 G759	E404-R755 IonicContact OE1-CZ 2.9Å; E404-R755 IonicContact OE1-NH1 3.01Å; E404-R755 PolarHBondContact OE1-NH1 3.37Å; E404-R755 IonicContact OE1-NH2 3.6Å; E404-R755 PolarHBondContact OE1-NH2 3.09Å; V753-R755 PolarHBondContact O-N 3.36Å; V753-R755 VanDerWaalsContact O-N 3.08Å; R755-L757 VanDerWaalsContact C-N 3.34Å; R755-N758 PolarHBondContact O-N 3.45Å; R755-G759 PolarHBondContact O-N 2.87Å
756	I	59.4	Low	53.7	Low	58 Å²	58	71.7 Å²	71.7	30%	0.297	41%	0.406	S	S	.	.	H	α-helix	trans	-64.7	-38.2	179.8	-67.6	169.8	0	0	0	111.7	I270 C273 P754 G759 L760	I270-I756 HydrophobicContact CB-CD1 4.27Å; I270-I756 HydrophobicContact CG1-CD1 4.21Å; I270-I756 HydrophobicContact CG2-CD1 3.87Å; C273-I756 HydrophobicContact CB-CB 4.47Å; C273-I756 HydrophobicContact CB-CD1 4.4Å; C273-I756 HydrophobicContact CB-CG2 3.16Å; C273-I756 WeakPolarHBondContact SG-CG2 3.3Å; P754-I756 PolarHBondContact O-N 3.31Å; I756-G759 PolarHBondContact O-N 2.82Å; I756-L760 HydrophobicContact CG2-CD1 4.28Å; I756-L760 WeakPolarHBondContact O-CG 3.33Å; I756-L760 PolarHBondContact O-N 3.22Å; I756-L760 VanDerWaalsContact O-N 3.07Å
757	L	60.4	Low	53.8	Low	48 Å²	48	74.1 Å²	74.1	25%	0.251	41%	0.413	S	S	.	.	H	α-helix	trans	-70.2	-38.3	177.1	-67.2	173.7	0	0	0	111.5	V266 L269 V753 P754 R755 G759 L760 A761	V266-L757 HydrophobicContact CG1-CD1 4.32Å; L269-L757 HydrophobicContact CD2-CD2 3.5Å; L269-L757 VanDerWaalsContact CD2-CD2 3.5Å; V753-L757 HydrophobicContact CG1-CB 3.92Å; V753-L757 HydrophobicContact CG1-CD1 4.21Å; P754-L757 HydrophobicContact CB-CD1 4.05Å; P754-L757 HydrophobicContact CB-CG 4.24Å; P754-L757 HydrophobicContact CG-CD1 3.84Å; P754-L757 WeakPolarHBondContact O-CB 3.27Å; P754-L757 PolarHBondContact O-N 3.29Å; R755-L757 VanDerWaalsContact C-N 3.34Å; L757-G759 VanDerWaalsContact C-N 3.31Å; L757-G759 PolarHBondContact O-N 3.04Å; L757-L760 HydrophobicContact CD2-CD1 4.32Å; L757-L760 PolarHBondContact O-N 2.93Å; L757-A761 WeakPolarHBondContact O-CB 3.34Å; L757-A761 PolarHBondContact O-N 3.39Å
758	N	59	Low	53.3	Low	51 Å²	51	71.8 Å²	71.8	27%	0.273	40%	0.4	S	S	.	.	H	α-helix	trans	-64.2	-37.9	173.6	-69	0.1	0	0	0	111.5	V753 R755 A761 S762	V753-N758 VanDerWaalsContact CG1-OD1 3.24Å; V753-N758 WeakPolarHBondContact CG1-OD1 3.5Å; R755-N758 PolarHBondContact O-N 3.45Å; N758-A761 PolarHBondContact O-N 2.81Å; N758-S762 WeakPolarHBondContact O-CB 3.41Å; N758-S762 PolarHBondContact O-N 3.17Å
759	G	54.3	Low	52.8	Low	32 Å²	32	72 Å²	72	33%	0.33	40%	0.401	S	S	.	.	H	α-helix	trans	-62.5	-43.6	173.8	0	0	0	0	0	112.7	R755 I756 L757 S762 E763	R755-G759 PolarHBondContact O-N 2.87Å; I756-G759 PolarHBondContact O-N 2.82Å; L757-G759 VanDerWaalsContact C-N 3.31Å; L757-G759 PolarHBondContact O-N 3.04Å; G759-S762 PolarHBondContact O-N 3.34Å; G759-E763 WeakPolarHBondContact O-CB 3.37Å; G759-E763 WeakPolarHBondContact O-CG 3.32Å; G759-E763 PolarHBondContact O-N 3.16Å
760	L	57.2	Low	51.9	Low	12 Å²	12	72.2 Å²	72.2	6%	0.063	40%	0.404	C	S	.	.	H	α-helix	trans	-64.2	-41.2	175.5	-71.2	163	0	0	0	112.3	I335 E339 I756 L757 R764	I335-L760 HydrophobicContact CG2-CD1 4.33Å; I335-L760 HydrophobicContact CG2-CD2 4.36Å; E339-L760 WeakPolarHBondContact OE1-CD1 3.4Å; I756-L760 HydrophobicContact CG2-CD1 4.28Å; I756-L760 WeakPolarHBondContact O-CG 3.33Å; I756-L760 PolarHBondContact O-N 3.22Å; I756-L760 VanDerWaalsContact O-N 3.07Å; L757-L760 HydrophobicContact CD2-CD1 4.32Å; L757-L760 PolarHBondContact O-N 2.93Å; L760-R764 WeakPolarHBondContact O-CB 3.2Å; L760-R764 WeakPolarHBondContact O-CG 3.34Å; L760-R764 PolarHBondContact O-N 3.03Å
761	A	54.6	Low	50.3	Low	50 Å²	50	78.8 Å²	78.8	41%	0.413	43%	0.432	S	S	.	.	H	α-helix	trans	-65.6	-43.1	175.9	0	0	0	0	0	111.8	L757 N758 R764 T765	L757-A761 WeakPolarHBondContact O-CB 3.34Å; L757-A761 PolarHBondContact O-N 3.39Å; N758-A761 PolarHBondContact O-N 2.81Å; A761-R764 PolarHBondContact O-N 3.06Å; A761-T765 PolarHBondContact O-N 3.27Å; A761-T765 PolarHBondContact O-OG1 3.43Å
762	S	46.4	Very low	48.3	Very low	80 Å²	80	85.4 Å²	85.4	56%	0.559	46%	0.46	S	S	*	.	H	α-helix	trans	-66.6	-39.8	176.7	-169.1	0	0	0	0	112.1	N758 G759 T765 A766	N758-S762 WeakPolarHBondContact O-CB 3.41Å; N758-S762 PolarHBondContact O-N 3.17Å; G759-S762 PolarHBondContact O-N 3.34Å; S762-T765 PolarHBondContact O-N 3.26Å; S762-A766 WeakPolarHBondContact O-CB 3.29Å; S762-A766 PolarHBondContact O-N 3.13Å
763	E	51.9	Low	45.9	Very low	77 Å²	77	94.4 Å²	94.4	36%	0.36	50%	0.503	S	S	.	.	H	α-helix	trans	-64.9	-41.5	174.2	-80.8	174.3	-179.9	0	0	111.5	R276 G759 T765 A766 L767	R276-E763 IonicContact CZ-OE2 3.26Å; R276-E763 VanDerWaalsContact CZ-OE2 3.29Å; R276-E763 IonicContact NH1-OE2 2.8Å; R276-E763 PolarHBondContact NH1-OE2 3.14Å; R276-E763 VanDerWaalsContact NH2-CD 3.31Å; R276-E763 IonicContact NH2-OE1 3.5Å; R276-E763 PolarHBondContact NH2-OE1 2.89Å; R276-E763 IonicContact NH2-OE2 2.88Å; R276-E763 PolarHBondContact NH2-OE2 3.36Å; G759-E763 WeakPolarHBondContact O-CB 3.37Å; G759-E763 WeakPolarHBondContact O-CG 3.32Å; G759-E763 PolarHBondContact O-N 3.16Å; E763-T765 VanDerWaalsContact C-N 3.31Å; E763-T765 PolarHBondContact O-N 3.47Å; E763-A766 PolarHBondContact O-N 3.41Å; E763-L767 VanDerWaalsContact O-CB 3.28Å; E763-L767 WeakPolarHBondContact O-CB 3.25Å; E763-L767 WeakPolarHBondContact O-CD1 3.28Å; E763-L767 VanDerWaalsContact O-CG 3.29Å; E763-L767 WeakPolarHBondContact O-CG 3.46Å; E763-L767 PolarHBondContact O-N 3.34Å
764	R	53.4	Low	43.4	Very low	134 Å²	134	99.3 Å²	99.3	51%	0.506	53%	0.532	S	S	.	.	H	α-helix	trans	-61.4	-39.6	172.5	-80.8	-179.9	-178.7	155.7	9.1	112.4	E339 L760 A761 A766 L767 S768	E339-R764 IonicContact OE1-NH2 3.41Å; E339-R764 PolarHBondContact OE1-NH2 3.23Å; E339-R764 IonicContact OE2-CZ 3.18Å; E339-R764 IonicContact OE2-NH1 2.86Å; E339-R764 PolarHBondContact OE2-NH1 2.91Å; E339-R764 IonicContact OE2-NH2 2.64Å; E339-R764 PolarHBondContact OE2-NH2 3.22Å; L760-R764 WeakPolarHBondContact O-CB 3.2Å; L760-R764 WeakPolarHBondContact O-CG 3.34Å; L760-R764 PolarHBondContact O-N 3.03Å; A761-R764 PolarHBondContact O-N 3.06Å; R764-A766 VanDerWaalsContact C-N 3.34Å; R764-L767 PolarHBondContact O-N 2.84Å; R764-S768 PolarHBondContact O-N 2.67Å
765	T	38.7	Very low	41.5	Very low	100 Å²	100	109.9 Å²	109.9	61%	0.613	57%	0.573	S	S	*	*	H	α-helix	trans	-67.7	-37.8	177.7	-47.9	0	0	0	0	110.7	A761 S762 E763 S768	A761-T765 PolarHBondContact O-N 3.27Å; A761-T765 PolarHBondContact O-OG1 3.43Å; S762-T765 PolarHBondContact O-N 3.26Å; E763-T765 VanDerWaalsContact C-N 3.31Å; E763-T765 PolarHBondContact O-N 3.47Å; T765-S768 PolarHBondContact O-OG 3.33Å
766	A	35.3	Very low	39.8	Very low	82 Å²	82	105 Å²	105	68%	0.678	58%	0.578	S	S	*	*	H	α-helix	trans	-73.3	-27.8	175.1	0	0	0	0	0	114.1	S762 E763 R764	S762-A766 WeakPolarHBondContact O-CB 3.29Å; S762-A766 PolarHBondContact O-N 3.13Å; E763-A766 PolarHBondContact O-N 3.41Å; R764-A766 VanDerWaalsContact C-N 3.34Å
767	L	30.8	Very low	38.2	Very low	149 Å²	149	107.1 Å²	107.1	78%	0.78	61%	0.605	S	S	*	*	H	α-helix	trans	-90.6	-11.9	177.2	-73	164.4	0	0	0	113.3	E763 R764	E763-L767 VanDerWaalsContact O-CB 3.28Å; E763-L767 WeakPolarHBondContact O-CB 3.25Å; E763-L767 WeakPolarHBondContact O-CD1 3.28Å; E763-L767 VanDerWaalsContact O-CG 3.29Å; E763-L767 WeakPolarHBondContact O-CG 3.46Å; E763-L767 PolarHBondContact O-N 3.34Å; R764-L767 PolarHBondContact O-N 2.84Å
768	S	24.4	Very low	36.8	Very low	58 Å²	58	112.2 Å²	112.2	41%	0.406	63%	0.631	S	S	.	*	S	Bend	trans	-64.5	130.4	163.7	75.6	0	0	0	0	107.5	R764 T765 Q770	R764-S768 PolarHBondContact O-N 2.67Å; T765-S768 PolarHBondContact O-OG 3.33Å; S768-Q770 PolarHBondContact O-N 2.71Å
769	P	29.1	Very low	35.2	Very low	124 Å²	124	118.2 Å²	118.2	81%	0.805	66%	0.657	S	S	*	*			trans	-58.9	113.5	-178	21	-27.2	0	0	0	107.3	Q771	P769-Q771 PolarHBondContact O-N 2.92Å
770	Q	27.3	Very low	33.8	Very low	177 Å²	177	123.6 Å²	123.6	83%	0.827	68%	0.678	S	S	*	*			trans	-45.2	115.5	168.1	-92.1	-178.3	-23.9	0	0	106.6	S768 Q772	S768-Q770 PolarHBondContact O-N 2.71Å; Q770-Q772 PolarHBondContact O-N 3.45Å
771	Q	25.8	Very low	32.4	Very low	185 Å²	185	131.2 Å²	131.2	86%	0.864	72%	0.717	S	S	*	*			trans	-62.7	87.4	164.8	-163.5	163.9	3.1	0	0	105.6	P769 Q773	P769-Q771 PolarHBondContact O-N 2.92Å; Q771-Q773 PolarHBondContact O-N 3.27Å
772	Q	24.2	Very low	31	Very low	165 Å²	165	134.4 Å²	134.4	77%	0.771	74%	0.736	S	S	*	*			trans	-49.5	110.3	164.3	-113.2	166.7	-27.1	0	0	105.3	Q770 T774	Q770-Q772 PolarHBondContact O-N 3.45Å; Q772-T774 PolarHBondContact O-N 3.03Å; Q772-T774 PolarHBondContact O-OG1 3.2Å
773	Q	24.9	Very low	30	Very low	192 Å²	192	133.7 Å²	133.7	90%	0.897	74%	0.742	S	S	*	*			trans	-63.9	86.7	165.5	-79.4	-179.4	-27.9	0	0	107	Q771 Y775	Q771-Q773 PolarHBondContact O-N 3.27Å; Q773-Y775 PolarHBondContact O-N 2.78Å
774	T	24	Very low	28.7	Very low	120 Å²	120	137 Å²	137	74%	0.736	77%	0.767	S	S	*	*			trans	-79.6	115	169.3	-35.8	0	0	0	0	107	Q772	Q772-T774 PolarHBondContact O-N 3.03Å; Q772-T774 PolarHBondContact O-OG1 3.2Å
775	Y	27.1	Very low	27.5	Very low	233 Å²	233	138.3 Å²	138.3	91%	0.914	78%	0.783	S	S	*	*			trans	-52.9	139.8	164.6	-98.7	-100.3	0	0	0	109.5	Q773	Q773-Y775 PolarHBondContact O-N 2.78Å
776	G	27.8	Very low	27	Very low	77 Å²	77	139.5 Å²	139.5	79%	0.794	79%	0.792	S	S	*	*			trans	-60.3	150.6	-155.4	0	0	0	0	0	117.9
777	A	26	Very low	26.6	Very low	104 Å²	104	139.4 Å²	139.4	86%	0.86	80%	0.799	S	S	*	*			trans	-158	138.2	144.2	0	0	0	0	0	108.9
778	I	29.8	Very low	26.5	Very low	155 Å²	155	141.1 Å²	141.1	80%	0.795	80%	0.803	S	S	*	*			trans	-70	131.7	-176.7	-65.1	161.9	0	0	0	110.4
779	H	25.6	Very low	26.5	Very low	177 Å²	177	145 Å²	145	82%	0.819	83%	0.829	S	S	*	*				175.7	141.6	123.3	-104.9	-81.5	0	0	0	113.2
780	N	26.6	Very low	26.4	Very low	145 Å²	145	146.8 Å²	146.8	78%	0.775	83%	0.831	S	S	*	*			trans	-49	148.6	171	-76.3	-26.2	0	0	0	114.2
781	I	26.4	Very low	26.4	Very low	171 Å²	171	143.1 Å²	143.1	88%	0.877	83%	0.831	S	S	*	*				-166.7	137.1	125.9	-90.1	145.7	0	0	0	110
782	S	26	Very low	26.5	Very low	118 Å²	118	143.7 Å²	143.7	83%	0.825	83%	0.834	S	S	*	*			trans	-58.6	143.3	175.4	171.5	0	0	0	0	114
783	G	24.9	Very low	26.5	Very low	65 Å²	65	141.5 Å²	141.5	67%	0.67	84%	0.836	S	S	*	*			trans	-176.2	101.1	169.4	0	0	0	0	0	113.5
784	T	25.1	Very low	26.6	Very low	145 Å²	145	137.8 Å²	137.8	89%	0.89	83%	0.831	S	S	*	*			trans	-47.7	135.8	171.2	26.5	0	0	0	0	115.2
785	I	26.9	Very low	26.8	Very low	163 Å²	163	141.3 Å²	141.3	84%	0.836	84%	0.842	S	S	*	*			trans	-113.4	128.6	164.1	-59.9	175.6	0	0	0	108.2
786	P	29.8	Very low	26.8	Very low	124 Å²	124	134 Å²	134	81%	0.805	84%	0.837	S	S	*	*			trans	-96	144.3	177	33.8	-28.7	0	0	0	113.5
787	G	26.3	Very low	26.7	Very low	81 Å²	81	135.7 Å²	135.7	84%	0.835	84%	0.837	S	S	*	*			trans	108.8	81.7	135.7	0	0	0	0	0	118.3
788	Q	29.1	Very low	26.9	Very low	184 Å²	184	137.7 Å²	137.7	86%	0.86	84%	0.838	S	S	*	*			trans	-81.9	138.7	154.8	-81.2	175.5	-29.8	0	0	110.2	L790	Q788-L790 PolarHBondContact O-N 3.37Å
789	C	23.3	Very low	26.8	Very low	141 Å²	141	135 Å²	135	95%	0.953	84%	0.84	S	S	*	*			trans	-59.9	112.1	168.5	-83.8	0	0	0	0	110.6
790	L	27.8	Very low	26.9	Very low	160 Å²	160	131.6 Å²	131.6	84%	0.838	84%	0.841	S	S	*	*			trans	-108.7	124.1	166.6	-96.4	157.1	0	0	0	109	Q788 Q792	Q788-L790 PolarHBondContact O-N 3.37Å; L790-Q792 PolarHBondContact O-N 3.2Å
791	A	27.9	Very low	27.1	Very low	101 Å²	101	129.2 Å²	129.2	84%	0.835	84%	0.842	S	S	*	*			trans	-64.4	126.3	173.2	0	0	0	0	0	110.4
792	Q	26.6	Very low	27.8	Very low	197 Å²	197	127.1 Å²	127.1	92%	0.921	84%	0.84	S	S	*	*			trans	-85	121.8	166.5	-82.8	176.3	-26.7	0	0	109.5	L790	L790-Q792 PolarHBondContact O-N 3.2Å
793	S	25.5	Very low	28	Very low	119 Å²	119	131 Å²	131	83%	0.832	85%	0.845	S	S	*	*			trans	-110.9	123.2	156.6	60.8	0	0	0	0	108.5
794	S	26.9	Very low	28.3	Very low	113 Å²	113	137.2 Å²	137.2	79%	0.79	86%	0.856	S	S	*	*			trans	-93.4	137.2	-179.8	51.3	0	0	0	0	113.2
795	M	28.4	Very low	28.7	Very low	194 Å²	194	138.9 Å²	138.9	96%	0.956	89%	0.885	S	S	*	*			trans	69.6	115.8	144.6	-76.3	-175.1	166.1	0	0	121.9
796	G	25.1	Very low	28.7	Very low	79 Å²	79	137.7 Å²	137.7	81%	0.814	89%	0.888	S	S	*	*				144.4	101.4	110.9	0	0	0	0	0	117.5
797	S	26.3	Very low	28.7	Very low	113 Å²	113	138.4 Å²	138.4	79%	0.79	89%	0.892	S	S	*	*			trans	-172.7	106.5	139.6	69.4	0	0	0	0	109.7
798	V	29.8	Very low	28.8	Very low	147 Å²	147	141.6 Å²	141.6	89%	0.891	90%	0.895	S	S	*	*				65	118.2	100.7	-177.9	0	0	0	0	114.2
799	A	28.5	Very low	28.8	Very low	99 Å²	99	139.1 Å²	139.1	82%	0.818	90%	0.897	S	S	*	*			trans	-69.9	149.8	-178.4	0	0	0	0	0	113.9
800	A	28.2	Very low	29.1	Very low	104 Å²	104	139 Å²	139	86%	0.86	89%	0.894	S	S	*	*			trans	-138.1	122.4	158.5	0	0	0	0	0	109.3
801	A	29.4	Very low	29.2	Very low	96 Å²	96	137.6 Å²	137.6	79%	0.793	90%	0.897	S	S	*	*			trans	-81.8	160.7	167	0	0	0	0	0	109.9
802	P	42.2	Very low	29.3	Very low	127 Å²	127	140.2 Å²	140.2	83%	0.825	90%	0.902	S	S	*	*			trans	-89.7	154.6	-167.4	36.1	-31.7	0	0	0	111.7
803	Q	29.4	Very low	29.5	Very low	199 Å²	199	135.8 Å²	135.8	93%	0.93	90%	0.9	S	S	*	*			trans	-137.6	133.7	160.6	-110.3	175.9	-14.8	0	0	111.2
804	E	31.6	Very low	29.9	Very low	195 Å²	195	137.3 Å²	137.3	91%	0.911	91%	0.906	S	S	*	*			trans	-60.4	162.6	172.3	-65.6	171.9	132.4	0	0	112.9
805	A	32.8	Very low	30.1	Very low	181 Å²	181	139.5 Å²	139.5	100%	1.496	92%	0.917	S	S	*	*			trans	90	0	174.6	0	0	0	0	0	116.4

Retrieved 805 of 805 residues in 2718.9 ms (Link to these results)

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