A0A077ZD72_TRITR Loading...

Son of sevenless 2

AlphaFold DB , UniProt , Accession A0A077ZD72, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,298 aa.

						>A0A077ZD72_TRITR|A0A077ZD72
MCDANEPSNRQNSADCVKSAWRGVFAESLYRVTQDVHPGFGIQREALDHVEELIIRLLLDVAAKRPHSTADVEQHISKTFPAPLNAWAVKEAQEVLVKSHRRHRDRSAIFPLQRVHLLLRVSAPVGFIFCLLHECLGYKVDSQVTLFISSVLEYIAADILKSSNNYAQLTGNYVKNIRRNEITLQDLKVAMRADNVLMDLFYHDDELPIISFNAEDLVASKIGSISYEQTVKDLVHHETQFLREVNMIILVFRRSMMEFAEEVDLDAIFSNISDIYECTSKFLSFLEDTVEMYRDPDVPFIGNCFLEMAEGAEFEVYEKYMNDVLNPRCQEVLDNALRQPTVVQHLEVRYMLSFLFFSGYYITFQAQGNGYYLAVKHLLPKLLLRPVYHCLKYFEFLPVLIKLASCDEDKYDLVQTESLLMPLKSRLEFKCASLSKAKSGNCFDLRFIPGESNRFTSMKLLELRKSVDGWDDKNIGCNCVMFILEGKLKKCVFQKLTNSILSSSGEFCAFFFSPGADLLRLDTPRTRAHKTTERFVFLFDGVIVFCKPSPSRRSVGPGSEYRLKEFYLTRKIEVLEHDDADGTMLLLRISGYSLFILFLVSDLKYMFEIRQRDSQNSTVLLAQSAEEKSTWMAALLMLQTRSMLERMLASCLEEQKRIPLLLPSVEQYRFAEPDSDENIVLEDYTSSSGIPVVRGATLTKLIERLTYHIYPDTKFVRTFLTTFRSFCTQSELLNLLIERFDIPDPLEGTGGGSSLASSPVGTTMTPISSSLIDSIDSSCRLVDNDSLLRESVKRLRKEYIRPVRISVLKVIKQWIDRHWYDFDQDPDLLLHLEQFLKRIEDVHAMSKCSRSLQKFIDRKVSSVYSSTVAPDPPPLECYLAVLPEEYDLMTVRQSALISYNGKSVFTLFQLHPIEIARQITLLEFDLYRAVKPIELVGAAWTKKDKDKRSPQLLKLIQHSTKFTYWLEKCVVECGNINERVAVMNRILEIMCIFQELNNFTGLIEIYGVLESSAIHRLYHTWERLDQKLLRVFEEVKQVLSDAHHKLIRERLRSINPPCVPFFGMYLTNIIFLEEGNPIFLKMPLSSQSSEAESSTADLEKPTLISFAKCRKIADIIGEIQMYQDVAYCLIVEPTIRHFFESLNPLQGFSSKNDLEAYLYSRSMEIEPKDCDKPPNFRCPIDGSQLVLRHFSFRKAPLRKYTLKSPGIKPQKVPQHPRHKYPSTAPSLLFTPLINYGRDRQNSAATLPLRRTPNTAPASPTSKEASVFAIVEINPGKMHKSIASVTLRNGRATSSLAEN
					

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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	30.7	Very low	33.1	Very low	245 Å²	245	140.1 Å²	140.1	100%	1.207	76%	0.759	S	S	*	*				0	86.9	0	-79.4	-179.1	154.8	0	0	108.3
2	C	32.2	Very low	33.1	Very low	131 Å²	131	137.4 Å²	137.4	89%	0.885	74%	0.744	S	S	*	*			trans	-162	120.1	163.7	-86.5	0	0	0	0	104
3	D	30.4	Very low	33.4	Very low	160 Å²	160	129 Å²	129	86%	0.856	70%	0.702	S	S	*	*			trans	-62.3	131.4	-169.4	-86	-48.7	0	0	0	113.2	N5	D3-N5 VanDerWaalsContact C-N 3.28Å; D3-N5 PolarHBondContact O-N 3.18Å
4	A	36.5	Very low	34.5	Very low	101 Å²	101	123.3 Å²	123.3	84%	0.835	68%	0.681	S	S	*	*	S	Bend	trans	-84.8	23.9	-171.6	0	0	0	0	0	115
5	N	33.9	Very low	35.7	Very low	154 Å²	154	121.7 Å²	121.7	82%	0.824	67%	0.67	S	S	*	*			trans	-112.7	11.1	-168.8	-86.5	-15.3	0	0	0	116	D3	D3-N5 VanDerWaalsContact C-N 3.28Å; D3-N5 PolarHBondContact O-N 3.18Å
6	E	31.6	Very low	36.6	Very low	134 Å²	134	116.9 Å²	116.9	63%	0.626	65%	0.648	S	S	*	*			trans	-96.5	126.2	174.2	-94.7	-168.6	170	0	0	113.2	S8 N9	E6-S8 PolarHBondContact O-N 2.87Å; E6-S8 PolarHBondContact OE2-OG 3.12Å; E6-N9 PolarHBondContact O-N 2.73Å
7	P	36.1	Very low	37.8	Very low	102 Å²	102	111.1 Å²	111.1	66%	0.662	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-17.8	-179	24.4	-31.7	0	0	0	114	N9 R10	P7-N9 VanDerWaalsContact C-N 3.28Å; P7-N9 PolarHBondContact O-N 3.14Å; P7-R10 PolarHBondContact O-N 3.47Å
8	S	32.8	Very low	39.1	Very low	67 Å²	67	109.5 Å²	109.5	47%	0.469	60%	0.602	S	S	.	*	H	α-helix	trans	-64.5	-26.4	176.4	48.9	0	0	0	0	113.6	E6	E6-S8 PolarHBondContact O-N 2.87Å; E6-S8 PolarHBondContact OE2-OG 3.12Å
9	N	32.5	Very low	40.4	Very low	109 Å²	109	107.7 Å²	107.7	58%	0.583	60%	0.598	S	S	*	*	H	α-helix	trans	-82.5	-15.7	179.2	-99.5	-19.4	0	0	0	114.3	E6 P7 S13	E6-N9 PolarHBondContact O-N 2.73Å; P7-N9 VanDerWaalsContact C-N 3.28Å; P7-N9 PolarHBondContact O-N 3.14Å; N9-S13 PolarHBondContact O-N 3.09Å
10	R	32	Very low	41.7	Very low	196 Å²	196	104.5 Å²	104.5	74%	0.74	59%	0.586	S	S	*	*	H	α-helix	trans	-75.8	-28.9	177.4	-74.4	-174.4	-176.9	174.7	1.7	113.5	P7 S13 A14	P7-R10 PolarHBondContact O-N 3.47Å; R10-S13 PolarHBondContact O-OG 2.88Å; R10-A14 PolarHBondContact O-N 2.96Å
11	Q	35	Very low	43.2	Very low	142 Å²	142	99.6 Å²	99.6	66%	0.664	56%	0.558	S	S	*	*	H	α-helix	trans	-68.2	-44.9	174.9	-127.9	87.8	15.8	0	0	110.4	S13 A14 D15	Q11-S13 VanDerWaalsContact C-N 3.28Å; Q11-S13 PolarHBondContact O-N 3.28Å; Q11-A14 PolarHBondContact O-N 3.31Å; Q11-D15 PolarHBondContact O-N 3.33Å
12	N	33.1	Very low	45.3	Very low	108 Å²	108	96.7 Å²	96.7	58%	0.578	53%	0.534	S	S	*	.	H	α-helix	trans	-65.9	-27.9	178.5	-70.8	-22.2	0	0	0	113	C16	N12-C16 PolarHBondContact O-N 3.26Å
13	S	36.9	Very low	47.3	Very low	28 Å²	28	92.6 Å²	92.6	20%	0.196	51%	0.514	C	S	.	.	H	α-helix	trans	-73.3	-41.2	176.9	69	0	0	0	0	112.7	N9 R10 Q11 C16 V17	N9-S13 PolarHBondContact O-N 3.09Å; R10-S13 PolarHBondContact O-OG 2.88Å; Q11-S13 VanDerWaalsContact C-N 3.28Å; Q11-S13 PolarHBondContact O-N 3.28Å; S13-C16 PolarHBondContact O-N 3.32Å; S13-V17 PolarHBondContact O-N 3.26Å
14	A	48.9	Very low	49.7	Very low	49 Å²	49	86 Å²	86	41%	0.405	48%	0.479	S	S	.	.	H	α-helix	trans	-65.7	-38.8	179.1	0	0	0	0	0	112.4	R10 Q11 C16 V17 K18	R10-A14 PolarHBondContact O-N 2.96Å; Q11-A14 PolarHBondContact O-N 3.31Å; A14-C16 VanDerWaalsContact C-N 3.34Å; A14-C16 PolarHBondContact O-N 3Å; A14-V17 PolarHBondContact O-N 2.89Å; A14-K18 WeakPolarHBondContact O-CG 3.31Å; A14-K18 PolarHBondContact O-N 2.65Å; A14-K18 VanDerWaalsContact O-N 3.1Å
15	D	52.8	Low	52	Low	99 Å²	99	81.2 Å²	81.2	53%	0.529	44%	0.44	S	S	.	.	H	α-helix	trans	-66.9	-34.7	178.3	-73.9	-25.2	0	0	0	112.5	Q11 S19	Q11-D15 PolarHBondContact O-N 3.33Å; D15-S19 PolarHBondContact O-N 3.16Å; D15-S19 VanDerWaalsContact O-N 3.08Å
16	C	50.7	Low	54.2	Low	46 Å²	46	75 Å²	75	31%	0.311	41%	0.41	S	S	.	.	H	α-helix	trans	-67.6	-43.3	177.3	-168.3	0	0	0	0	111.9	N12 S13 A14 S19 L131	N12-C16 PolarHBondContact O-N 3.26Å; S13-C16 PolarHBondContact O-N 3.32Å; A14-C16 VanDerWaalsContact C-N 3.34Å; A14-C16 PolarHBondContact O-N 3Å; C16-S19 PolarHBondContact O-N 3.29Å; C16-S19 PolarHBondContact O-OG 2.85Å; C16-L131 HydrophobicContact CB-CD1 4.42Å
17	V	56.5	Low	56.3	Low	17 Å²	17	74.2 Å²	74.2	10%	0.103	41%	0.406	C	S	.	.	H	α-helix	trans	-64.8	-44.7	176.6	178.2	0	0	0	0	111	S13 A14 S19 A20 W21 L59	S13-V17 PolarHBondContact O-N 3.26Å; A14-V17 PolarHBondContact O-N 2.89Å; V17-S19 PolarHBondContact O-N 2.91Å; V17-A20 PolarHBondContact O-N 2.73Å; V17-W21 VanDerWaalsContact O-CD1 3.28Å; V17-L59 HydrophobicContact CG1-CD1 4.45Å; V17-L59 HydrophobicContact CG1-CD2 4.07Å
18	K	60.9	Low	58.5	Low	83 Å²	83	69.9 Å²	69.9	36%	0.361	38%	0.378	S	S	.	.	H	α-helix	trans	-58.5	-36	175.8	-74.4	-176.1	176.4	-165.5	0	112.4	A14 A20 W21 R22 E52	A14-K18 WeakPolarHBondContact O-CG 3.31Å; A14-K18 PolarHBondContact O-N 2.65Å; A14-K18 VanDerWaalsContact O-N 3.1Å; K18-A20 VanDerWaalsContact C-N 3.31Å; K18-A20 PolarHBondContact O-N 3.33Å; K18-W21 PolarHBondContact O-N 3.14Å; K18-R22 PolarHBondContact O-N 3.02Å; K18-E52 IonicContact NZ-OE1 3.1Å; K18-E52 PolarHBondContact NZ-OE1 2.9Å
19	S	64.7	Low	60.9	Low	75 Å²	75	66.7 Å²	66.7	52%	0.524	36%	0.356	S	S	.	.	H	α-helix	trans	-64.5	-31.1	179.9	77.5	0	0	0	0	114.1	D15 C16 V17	D15-S19 PolarHBondContact O-N 3.16Å; D15-S19 VanDerWaalsContact O-N 3.08Å; C16-S19 PolarHBondContact O-N 3.29Å; C16-S19 PolarHBondContact O-OG 2.85Å; V17-S19 PolarHBondContact O-N 2.91Å
20	A	66.6	Low	63.1	Low	43 Å²	43	62.4 Å²	62.4	36%	0.355	33%	0.332	S	S	.	.	H	α-helix	trans	-74.8	-24.1	-179.7	0	0	0	0	0	113.5	V17 K18	V17-A20 PolarHBondContact O-N 2.73Å; K18-A20 VanDerWaalsContact C-N 3.31Å; K18-A20 PolarHBondContact O-N 3.33Å
21	W	73.2	Confident	65.3	Low	2 Å²	2	57.6 Å²	57.6	1%	0.008	31%	0.314	C	S	.	.	H	α-helix	trans	-95.4	-14.7	-179.1	-69.4	100.9	0	0	0	114	V17 K18 G23 V24 F25 I55 L58 L118 L119	V17-W21 VanDerWaalsContact O-CD1 3.28Å; K18-W21 PolarHBondContact O-N 3.14Å; W21-G23 PolarHBondContact O-N 2.96Å; W21-V24 WeakPolarHBondContact O-CB 3.21Å; W21-V24 VanDerWaalsContact O-CG2 3.32Å; W21-V24 WeakPolarHBondContact O-CG2 3.38Å; W21-V24 PolarHBondContact O-N 2.85Å; W21-F25 AromaticContact CE3-CE2 4Å; W21-F25 HydrophobicContact CE3-CE2 4Å; W21-F25 HydrophobicContact CE3-CZ 4.31Å; W21-F25 HydrophobicContact CZ3-CE2 4.38Å; W21-F25 HydrophobicContact CZ3-CZ 4.23Å; W21-I55 HydrophobicContact CB-CD1 3.65Å; W21-I55 HydrophobicContact CB-CG1 3.94Å; W21-I55 HydrophobicContact CB-CG2 4.09Å; W21-I55 HydrophobicContact CG-CG2 4.34Å; W21-L58 HydrophobicContact CD2-CD2 4.28Å; W21-L58 HydrophobicContact CE3-CD2 3.88Å; W21-L58 HydrophobicContact CH2-CD2 3.56Å; W21-L58 HydrophobicContact CZ2-CD2 3.97Å; W21-L58 HydrophobicContact CZ3-CD2 3.5Å; W21-L118 HydrophobicContact CD2-CD1 4.23Å; W21-L118 HydrophobicContact CE3-CD1 3.68Å; W21-L118 HydrophobicContact CH2-CB 3.42Å; W21-L118 VanDerWaalsContact CH2-CB 3.42Å; W21-L118 HydrophobicContact CH2-CD1 3.95Å; W21-L118 HydrophobicContact CH2-CG 4.33Å; W21-L118 HydrophobicContact CZ2-CB 3.76Å; W21-L118 HydrophobicContact CZ2-CD1 4.47Å; W21-L118 HydrophobicContact CZ3-CB 3.92Å; W21-L118 HydrophobicContact CZ3-CD1 3.53Å; W21-L118 HydrophobicContact CZ3-CG 4.38Å; W21-L119 HydrophobicContact CH2-CD2 4.39Å; W21-L119 HydrophobicContact CH2-CG 4.43Å; W21-L119 HydrophobicContact CZ2-CD2 4.5Å
22	R	73.4	Confident	67.3	Low	184 Å²	184	51 Å²	51	69%	0.694	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	130.4	180	-82.6	-176.5	-177.4	-123.2	1.4	111.7	K18 V24	K18-R22 PolarHBondContact O-N 3.02Å; R22-V24 VanDerWaalsContact C-N 3.26Å; R22-V24 PolarHBondContact O-N 2.83Å
23	G	75.2	Confident	69.3	Low	46 Å²	46	45.8 Å²	45.8	47%	0.474	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	1.6	179.5	0	0	0	0	0	115.1	W21 E51	W21-G23 PolarHBondContact O-N 2.96Å; G23-E51 WeakPolarHBondContact CA-OE1 3.43Å; G23-E51 VanDerWaalsContact N-CD 3.34Å; G23-E51 PolarHBondContact N-OE1 2.92Å; G23-E51 VanDerWaalsContact N-OE1 3.08Å; G23-E51 PolarHBondContact N-OE2 3.1Å
24	V	80.4	Confident	71	Confident	20 Å²	20	45.7 Å²	45.7	12%	0.121	25%	0.252	C	S	.	.	S	Bend	trans	-70.5	-38.5	176.8	174.8	0	0	0	0	110.7	W21 R22 E51 P111 L118	W21-V24 WeakPolarHBondContact O-CB 3.21Å; W21-V24 VanDerWaalsContact O-CG2 3.32Å; W21-V24 WeakPolarHBondContact O-CG2 3.38Å; W21-V24 PolarHBondContact O-N 2.85Å; R22-V24 VanDerWaalsContact C-N 3.26Å; R22-V24 PolarHBondContact O-N 2.83Å; V24-E51 PolarHBondContact N-OE1 3.29Å; V24-P111 HydrophobicContact CG1-CG 4.07Å; V24-L118 HydrophobicContact CG1-CD1 4.32Å; V24-L118 HydrophobicContact CG2-CD1 3.96Å
25	F	84.1	Confident	72	Confident	1 Å²	1	48.4 Å²	48.4	0%	0.004	26%	0.259	C	S	.	.	S	Bend	trans	-101.7	-13.3	-175.4	-60.4	-71.7	0	0	0	113.3	W21 E27 S28 L29 E51 I54 I55 L58 F110 V115	W21-F25 AromaticContact CE3-CE2 4Å; W21-F25 HydrophobicContact CE3-CE2 4Å; W21-F25 HydrophobicContact CE3-CZ 4.31Å; W21-F25 HydrophobicContact CZ3-CE2 4.38Å; W21-F25 HydrophobicContact CZ3-CZ 4.23Å; F25-E27 PolarHBondContact O-N 3.34Å; F25-S28 CarbonylContact O-C 3.54Å; F25-S28 PolarHBondContact O-N 3.23Å; F25-L29 HydrophobicContact CB-CD1 3.9Å; F25-L29 HydrophobicContact CB-CG 4.05Å; F25-L29 WeakPolarHBondContact O-CB 3.47Å; F25-L29 WeakPolarHBondContact O-CG 3.49Å; F25-L29 PolarHBondContact O-N 2.97Å; F25-E51 WeakPolarHBondContact CA-OE1 3.27Å; F25-E51 HydrophobicContact CB-CG 4.21Å; F25-E51 HydrophobicContact CD2-CG 4.41Å; F25-E51 PolarHBondContact N-OE1 2.98Å; F25-I54 HydrophobicContact CD2-CG2 4.4Å; F25-I54 HydrophobicContact CE2-CG2 4.46Å; F25-I55 HydrophobicContact CD2-CG1 4.1Å; F25-I55 HydrophobicContact CE2-CG1 4.07Å; F25-L58 HydrophobicContact CE2-CD2 4.34Å; F25-L58 HydrophobicContact CZ-CD2 4.13Å; F25-F110 AromaticContact CD1-CD2 3.55Å; F25-F110 HydrophobicContact CD1-CD2 3.55Å; F25-F110 AromaticContact CD1-CE2 3.62Å; F25-F110 HydrophobicContact CD1-CE2 3.62Å; F25-F110 HydrophobicContact CD1-CG 4.17Å; F25-F110 HydrophobicContact CD1-CZ 4.3Å; F25-F110 AromaticContact CE1-CD2 3.54Å; F25-F110 HydrophobicContact CE1-CD2 3.54Å; F25-F110 AromaticContact CE1-CE2 3.86Å; F25-F110 HydrophobicContact CE1-CE2 3.86Å; F25-F110 HydrophobicContact CE1-CG 4.38Å; F25-F110 HydrophobicContact CG-CE2 4.45Å; F25-V115 HydrophobicContact CE1-CG2 3.73Å; F25-V115 HydrophobicContact CZ-CG2 3.96Å
26	A	80	Confident	72.8	Confident	25 Å²	25	45 Å²	45	21%	0.207	24%	0.242	C	C	.	.	H	α-helix	trans	-47.4	-50.6	-175.8	0	0	0	0	0	114.2	L29 Y30 L47 E51	A26-L29 PolarHBondContact O-N 3.2Å; A26-Y30 PolarHBondContact O-N 3.48Å; A26-L47 HydrophobicContact CB-CD2 4.19Å; A26-E51 PolarHBondContact N-OE1 3.47Å; A26-E51 VanDerWaalsContact N-OE1 3.13Å
27	E	76.7	Confident	73.6	Confident	117 Å²	117	43.4 Å²	43.4	55%	0.547	23%	0.23	S	C	.	.	H	α-helix	trans	-66.2	-43.9	178.9	-173.4	-179.3	177.9	0	0	112.2	F25 Y30 R31	F25-E27 PolarHBondContact O-N 3.34Å; E27-Y30 WeakPolarHBondContact O-CB 3.44Å; E27-Y30 PolarHBondContact O-N 3.36Å; E27-R31 WeakPolarHBondContact O-CG 3.18Å; E27-R31 PolarHBondContact O-N 3.46Å
28	S	82.6	Confident	74	Confident	10 Å²	10	45.4 Å²	45.4	7%	0.07	24%	0.244	C	C	.	.	H	α-helix	trans	-65.1	-39.5	177.8	-65.1	0	0	0	0	112.3	F25 Y30 R31 V32 I109 P111	F25-S28 CarbonylContact O-C 3.54Å; F25-S28 PolarHBondContact O-N 3.23Å; S28-Y30 VanDerWaalsContact C-N 3.34Å; S28-R31 PolarHBondContact O-N 3.01Å; S28-V32 WeakPolarHBondContact O-CG2 3.34Å; S28-V32 PolarHBondContact O-N 2.93Å; S28-I109 WeakPolarHBondContact CB-O 3.12Å; S28-I109 WeakPolarHBondContact O-CG2 3.38Å; S28-I109 PolarHBondContact OG-O 3.12Å; S28-P111 WeakPolarHBondContact OG-CD 3.45Å
29	L	83.6	Confident	74	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-66.6	-36.2	176.3	-73.3	172.7	0	0	0	111.8	F25 A26 V32 T33 L47 V50 E51 I54 F110 A156	F25-L29 HydrophobicContact CB-CD1 3.9Å; F25-L29 HydrophobicContact CB-CG 4.05Å; F25-L29 WeakPolarHBondContact O-CB 3.47Å; F25-L29 WeakPolarHBondContact O-CG 3.49Å; F25-L29 PolarHBondContact O-N 2.97Å; A26-L29 PolarHBondContact O-N 3.2Å; L29-V32 PolarHBondContact O-N 3.02Å; L29-T33 PolarHBondContact O-N 2.76Å; L29-T33 PolarHBondContact O-OG1 2.85Å; L29-L47 HydrophobicContact CB-CD1 3.5Å; L29-L47 VanDerWaalsContact CB-CD1 3.5Å; L29-L47 HydrophobicContact CD1-CD1 4.47Å; L29-V50 HydrophobicContact CD1-CB 4.46Å; L29-V50 HydrophobicContact CD1-CG1 4.13Å; L29-V50 HydrophobicContact CD2-CG1 3.83Å; L29-E51 HydrophobicContact CD1-CB 3.72Å; L29-E51 HydrophobicContact CD1-CG 4.41Å; L29-I54 HydrophobicContact CD2-CG1 4.45Å; L29-F110 HydrophobicContact CD2-CE1 4.2Å; L29-F110 HydrophobicContact CD2-CZ 3.89Å; L29-A156 HydrophobicContact CD2-CB 3.56Å
30	Y	78	Confident	74.1	Confident	19 Å²	19	40.5 Å²	40.5	8%	0.075	22%	0.215	C	C	.	.	H	α-helix	trans	-62.9	-44	171.8	-175	-86.8	0	0	0	111.1	A26 E27 S28 T33 Q34 I42 Y684 S686 G689	A26-Y30 PolarHBondContact O-N 3.48Å; E27-Y30 WeakPolarHBondContact O-CB 3.44Å; E27-Y30 PolarHBondContact O-N 3.36Å; S28-Y30 VanDerWaalsContact C-N 3.34Å; Y30-T33 WeakPolarHBondContact O-CA 3.07Å; Y30-T33 VanDerWaalsContact O-CB 3.26Å; Y30-T33 WeakPolarHBondContact O-CB 3.44Å; Y30-T33 PolarHBondContact O-N 3.41Å; Y30-T33 VanDerWaalsContact O-N 3.1Å; Y30-Q34 HydrophobicContact CD1-CG 4.17Å; Y30-Q34 HydrophobicContact CE1-CG 3.77Å; Y30-Q34 PolarHBondContact O-N 2.8Å; Y30-I42 HydrophobicContact CD2-CG2 3.81Å; Y30-I42 HydrophobicContact CE2-CG2 4.32Å; Y30-Y684 HydrophobicContact CD1-CD1 4.04Å; Y30-Y684 HydrophobicContact CD1-CG 4.12Å; Y30-Y684 AromaticContact CE1-CD1 3.63Å; Y30-Y684 HydrophobicContact CE1-CD1 3.63Å; Y30-Y684 HydrophobicContact CE1-CG 4.02Å; Y30-S686 PolarHBondContact OH-O 3.21Å; Y30-G689 WeakPolarHBondContact OH-CA 3.47Å; Y30-G689 PolarHBondContact OH-N 3.3Å; Y30-G689 PolarHBondContact OH-O 2.79Å
31	R	77.2	Confident	74.2	Confident	95 Å²	95	38.5 Å²	38.5	36%	0.358	20%	0.198	S	C	.	.	H	α-helix	trans	-62.9	-43.8	175.1	-69.7	-178.4	64.8	-163.7	-3.5	112.5	E27 S28 T33 Q34 D35 I109	E27-R31 WeakPolarHBondContact O-CG 3.18Å; E27-R31 PolarHBondContact O-N 3.46Å; S28-R31 PolarHBondContact O-N 3.01Å; R31-T33 PolarHBondContact O-N 2.92Å; R31-Q34 PolarHBondContact O-N 2.84Å; R31-D35 PolarHBondContact O-N 3.19Å; R31-I109 HydrophobicContact CB-CG2 3.71Å
32	V	77.4	Confident	74.3	Confident	3 Å²	3	39 Å²	39	2%	0.018	20%	0.2	C	C	.	.	H	α-helix	trans	-58.2	-38.3	171.9	174.4	0	0	0	0	110.6	S28 L29 D35 V36 I109 F110 E153 A157 L160	S28-V32 WeakPolarHBondContact O-CG2 3.34Å; S28-V32 PolarHBondContact O-N 2.93Å; L29-V32 PolarHBondContact O-N 3.02Å; V32-D35 PolarHBondContact O-N 2.96Å; V32-V36 HydrophobicContact CG1-CG2 4.16Å; V32-V36 VanDerWaalsContact O-CB 3.27Å; V32-V36 WeakPolarHBondContact O-CB 3.38Å; V32-V36 WeakPolarHBondContact O-CG2 3.36Å; V32-V36 PolarHBondContact O-N 3.38Å; V32-I109 HydrophobicContact CG2-CB 4.33Å; V32-I109 HydrophobicContact CG2-CD1 3.92Å; V32-I109 HydrophobicContact CG2-CG2 4Å; V32-F110 HydrophobicContact CG2-CE1 4.01Å; V32-E153 HydrophobicContact CG2-CG 4.26Å; V32-A157 HydrophobicContact CG1-CB 3.74Å; V32-L160 HydrophobicContact CB-CD1 4.31Å; V32-L160 HydrophobicContact CG1-CD1 3.82Å
33	T	76.6	Confident	74.5	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.6	-42.2	175.2	-54	0	0	0	0	111.5	L29 Y30 R31 V36 H37 I42 L160 I182	L29-T33 PolarHBondContact O-N 2.76Å; L29-T33 PolarHBondContact O-OG1 2.85Å; Y30-T33 WeakPolarHBondContact O-CA 3.07Å; Y30-T33 VanDerWaalsContact O-CB 3.26Å; Y30-T33 WeakPolarHBondContact O-CB 3.44Å; Y30-T33 PolarHBondContact O-N 3.41Å; Y30-T33 VanDerWaalsContact O-N 3.1Å; R31-T33 PolarHBondContact O-N 2.92Å; T33-V36 PolarHBondContact O-N 2.83Å; T33-H37 CarbonylContact O-C 3.11Å; T33-H37 WeakPolarHBondContact O-CA 3.35Å; T33-H37 PolarHBondContact O-N 2.99Å; T33-I42 HydrophobicContact CG2-CB 4.2Å; T33-I42 HydrophobicContact CG2-CG2 4.31Å; T33-L160 WeakPolarHBondContact OG1-CD1 3.35Å; T33-I182 HydrophobicContact CG2-CD1 4.01Å
34	Q	70.8	Confident	74.8	Confident	25 Å²	25	39.8 Å²	39.8	12%	0.117	19%	0.191	C	C	.	.	H	α-helix	trans	-69.3	-35.7	176.5	-65.3	-48.3	-49.1	0	0	113.2	Y30 R31 V36 H37 P38 G39 F40 G689	Y30-Q34 HydrophobicContact CD1-CG 4.17Å; Y30-Q34 HydrophobicContact CE1-CG 3.77Å; Y30-Q34 PolarHBondContact O-N 2.8Å; R31-Q34 PolarHBondContact O-N 2.84Å; Q34-V36 VanDerWaalsContact C-N 3.3Å; Q34-H37 CarbonylContact O-C 3.6Å; Q34-P38 WeakPolarHBondContact O-CA 3.33Å; Q34-P38 WeakPolarHBondContact O-CD 3.45Å; Q34-P38 VanDerWaalsContact O-CG 3.3Å; Q34-P38 WeakPolarHBondContact O-CG 3.24Å; Q34-G39 VanDerWaalsContact OE1-N 3.12Å; Q34-F40 PolarHBondContact NE2-O 2.85Å; Q34-G689 PolarHBondContact NE2-O 3.02Å; Q34-G689 PolarHBondContact OE1-O 2.84Å
35	D	71.7	Confident	74.8	Confident	107 Å²	107	45 Å²	45	57%	0.572	21%	0.214	S	C	*	.	H	α-helix	trans	-68.6	-34.7	176.6	-71.4	-11.5	0	0	0	111.4	R31 V32 I109	R31-D35 PolarHBondContact O-N 3.19Å; V32-D35 PolarHBondContact O-N 2.96Å; D35-I109 WeakPolarHBondContact OD2-CD1 3.48Å
36	V	69.3	Low	74.7	Confident	28 Å²	28	44.9 Å²	44.9	17%	0.17	21%	0.214	C	C	.	.	H	α-helix	trans	-81.6	-43.5	179.5	173.1	0	0	0	0	111.6	V32 T33 Q34 A157 L160 K161	V32-V36 HydrophobicContact CG1-CG2 4.16Å; V32-V36 VanDerWaalsContact O-CB 3.27Å; V32-V36 WeakPolarHBondContact O-CB 3.38Å; V32-V36 WeakPolarHBondContact O-CG2 3.36Å; V32-V36 PolarHBondContact O-N 3.38Å; T33-V36 PolarHBondContact O-N 2.83Å; Q34-V36 VanDerWaalsContact C-N 3.3Å; V36-A157 HydrophobicContact CG2-CB 4.02Å; V36-L160 HydrophobicContact CG1-CB 4.49Å; V36-K161 HydrophobicContact CB-CG 4.4Å; V36-K161 HydrophobicContact CG1-CB 4.21Å; V36-K161 HydrophobicContact CG1-CD 4.5Å; V36-K161 HydrophobicContact CG1-CG 3.34Å; V36-K161 HydrophobicContact CG2-CG 4.12Å
37	H	67.3	Low	74.9	Confident	12 Å²	12	44.6 Å²	44.6	6%	0.056	21%	0.209	C	C	.	.	S	Bend	trans	-132.4	79.5	-178.8	-56.6	-46.6	0	0	0	110.6	T33 Q34 G39 F40 L160 N164	T33-H37 CarbonylContact O-C 3.11Å; T33-H37 WeakPolarHBondContact O-CA 3.35Å; T33-H37 PolarHBondContact O-N 2.99Å; Q34-H37 CarbonylContact O-C 3.6Å; H37-G39 PolarHBondContact O-N 3.43Å; H37-F40 HydrophobicContact CB-CB 3.89Å; H37-F40 HydrophobicContact CB-CD2 3.84Å; H37-F40 HydrophobicContact CB-CG 4.07Å; H37-F40 PolarHBondContact O-N 3.48Å; H37-L160 PolarHBondContact NE2-O 3.48Å; H37-N164 WeakPolarHBondContact CE1-CB 3.47Å; H37-N164 VanDerWaalsContact CE1-CG 3.48Å; H37-N164 PolarHBondContact CE1-ND2 2.87Å; H37-N164 PolarHBondContact ND1-ND2 2.84Å; H37-N164 WeakPolarHBondContact NE2-CB 3.3Å
38	P	64.6	Low	75.3	Confident	59 Å²	59	42.4 Å²	42.4	38%	0.383	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	126.8	178.8	-24.2	32.3	0	0	0	111.9	Q34 I709 Y710	Q34-P38 WeakPolarHBondContact O-CA 3.33Å; Q34-P38 WeakPolarHBondContact O-CD 3.45Å; Q34-P38 VanDerWaalsContact O-CG 3.3Å; Q34-P38 WeakPolarHBondContact O-CG 3.24Å; P38-I709 HydrophobicContact CB-CG2 3.42Å; P38-I709 VanDerWaalsContact CB-CG2 3.42Å; P38-I709 HydrophobicContact CG-CG2 3.97Å; P38-Y710 HydrophobicContact CB-CD1 4.43Å
39	G	61.4	Low	75.5	Confident	7 Å²	7	43.3 Å²	43.3	7%	0.072	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.4	5	177.4	0	0	0	0	0	115.4	Q34 H37	Q34-G39 VanDerWaalsContact OE1-N 3.12Å; H37-G39 PolarHBondContact O-N 3.43Å
40	F	66.1	Low	75.6	Confident	48 Å²	48	43.3 Å²	43.3	21%	0.211	20%	0.204	C	C	.	.			trans	-100.3	127.7	171.5	-75.9	-95.7	0	0	0	111.2	Q34 H37 I177	Q34-F40 PolarHBondContact NE2-O 2.85Å; H37-F40 HydrophobicContact CB-CB 3.89Å; H37-F40 HydrophobicContact CB-CD2 3.84Å; H37-F40 HydrophobicContact CB-CG 4.07Å; H37-F40 PolarHBondContact O-N 3.48Å; F40-I177 HydrophobicContact CE1-CB 4.19Å; F40-I177 HydrophobicContact CE1-CG1 4.36Å; F40-I177 HydrophobicContact CE1-CG2 3.6Å; F40-I177 HydrophobicContact CZ-CG2 3.65Å
41	G	68.3	Low	76.1	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	165.8	165.7	0	0	0	0	0	112.7	N180 E181 I182 S687	G41-N180 WeakPolarHBondContact CA-O 3.48Å; G41-N180 PolarHBondContact N-O 3.33Å; G41-E181 CarbonylContact O-C 3.45Å; G41-E181 VanDerWaalsContact O-CA 3.27Å; G41-E181 WeakPolarHBondContact O-CA 3.46Å; G41-I182 PolarHBondContact O-N 3.01Å; G41-S687 WeakPolarHBondContact CA-O 3.34Å
42	I	75.3	Confident	76.6	Confident	12 Å²	12	43.1 Å²	43.1	6%	0.062	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	129.7	170.8	-177.1	166.9	0	0	0	108.6	Y30 T33 A46 L47 L160 I182	Y30-I42 HydrophobicContact CD2-CG2 3.81Å; Y30-I42 HydrophobicContact CE2-CG2 4.32Å; T33-I42 HydrophobicContact CG2-CB 4.2Å; T33-I42 HydrophobicContact CG2-CG2 4.31Å; I42-A46 HydrophobicContact CD1-CB 4.24Å; I42-A46 HydrophobicContact CG1-CB 3.84Å; I42-L47 HydrophobicContact CD1-CB 4.32Å; I42-L47 HydrophobicContact CD1-CD1 4.18Å; I42-L47 HydrophobicContact CG1-CB 4.37Å; I42-L47 HydrophobicContact CG2-CB 4.48Å; I42-L47 HydrophobicContact CG2-CD1 4.09Å; I42-L160 HydrophobicContact CD1-CD2 3.83Å; I42-I182 HydrophobicContact CB-CB 4.48Å; I42-I182 HydrophobicContact CG1-CB 4.32Å
43	Q	78.3	Confident	77.1	Confident	48 Å²	48	43.6 Å²	43.6	22%	0.224	21%	0.21	C	C	.	.			trans	-61.5	141.4	176.4	-75.3	-176	-12.9	0	0	110	E45 A46 L47 E181 I182 T183	Q43-E45 PolarHBondContact O-N 2.83Å; Q43-A46 HydrophobicContact CB-CB 4.31Å; Q43-A46 WeakPolarHBondContact O-CA 3.45Å; Q43-A46 WeakPolarHBondContact O-CB 3.43Å; Q43-A46 PolarHBondContact O-N 2.89Å; Q43-L47 PolarHBondContact O-N 2.71Å; Q43-E181 HydrophobicContact CG-CG 3.85Å; Q43-E181 WeakPolarHBondContact CG-OE1 3.49Å; Q43-E181 WeakPolarHBondContact CG-OE2 3.33Å; Q43-E181 PolarHBondContact NE2-OE2 2.95Å; Q43-I182 PolarHBondContact N-O 2.95Å; Q43-T183 VanDerWaalsContact OE1-CB 3.3Å
44	R	81.5	Confident	77.7	Confident	200 Å²	200	43.6 Å²	43.6	76%	0.755	21%	0.21	S	C	*	.	H	α-helix	trans	-55.2	-39.5	178.6	-170.1	166.3	-175.6	162.2	2.6	112.6	A46 L47 D48	R44-A46 VanDerWaalsContact C-N 3.29Å; R44-A46 PolarHBondContact O-N 3.44Å; R44-L47 PolarHBondContact O-N 2.85Å; R44-D48 WeakPolarHBondContact O-CB 3.45Å; R44-D48 PolarHBondContact O-N 2.95Å
45	E	81	Confident	78.3	Confident	128 Å²	128	43 Å²	43	60%	0.598	21%	0.207	S	C	*	.	H	α-helix	trans	-62.1	-34.4	175.5	-61.2	174.4	-180	0	0	113	Q43 H49 L184	Q43-E45 PolarHBondContact O-N 2.83Å; E45-H49 WeakPolarHBondContact O-CB 3.42Å; E45-H49 PolarHBondContact O-N 2.83Å; E45-L184 HydrophobicContact CB-CB 4.43Å; E45-L184 HydrophobicContact CB-CD2 4.37Å
46	A	81.3	Confident	78.9	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-74.5	-42.6	176	0	0	0	0	0	111.2	I42 Q43 R44 H49 V50 L184	I42-A46 HydrophobicContact CD1-CB 4.24Å; I42-A46 HydrophobicContact CG1-CB 3.84Å; Q43-A46 HydrophobicContact CB-CB 4.31Å; Q43-A46 WeakPolarHBondContact O-CA 3.45Å; Q43-A46 WeakPolarHBondContact O-CB 3.43Å; Q43-A46 PolarHBondContact O-N 2.89Å; R44-A46 VanDerWaalsContact C-N 3.29Å; R44-A46 PolarHBondContact O-N 3.44Å; A46-H49 PolarHBondContact O-N 2.91Å; A46-V50 WeakPolarHBondContact O-CG2 3.46Å; A46-V50 PolarHBondContact O-N 3.34Å; A46-L184 HydrophobicContact CB-CB 4.27Å
47	L	84.4	Confident	79.7	Confident	19 Å²	19	39.6 Å²	39.6	10%	0.099	18%	0.184	C	C	.	.	H	α-helix	trans	-61.4	-46	176.3	-170.2	70.7	0	0	0	111.4	A26 L29 I42 Q43 R44 H49 V50 E51	A26-L47 HydrophobicContact CB-CD2 4.19Å; L29-L47 HydrophobicContact CB-CD1 3.5Å; L29-L47 VanDerWaalsContact CB-CD1 3.5Å; L29-L47 HydrophobicContact CD1-CD1 4.47Å; I42-L47 HydrophobicContact CD1-CB 4.32Å; I42-L47 HydrophobicContact CD1-CD1 4.18Å; I42-L47 HydrophobicContact CG1-CB 4.37Å; I42-L47 HydrophobicContact CG2-CB 4.48Å; I42-L47 HydrophobicContact CG2-CD1 4.09Å; Q43-L47 PolarHBondContact O-N 2.71Å; R44-L47 PolarHBondContact O-N 2.85Å; L47-H49 VanDerWaalsContact C-N 3.29Å; L47-H49 PolarHBondContact O-N 3.11Å; L47-V50 PolarHBondContact O-N 3.42Å; L47-E51 PolarHBondContact O-N 3.2Å
48	D	85.2	Confident	80.5	Confident	71 Å²	71	39.1 Å²	39.1	38%	0.38	18%	0.181	S	C	.	.	H	α-helix	trans	-61.1	-38.9	177.2	-69	-15.1	0	0	0	111	R44 E51 E52	R44-D48 WeakPolarHBondContact O-CB 3.45Å; R44-D48 PolarHBondContact O-N 2.95Å; D48-E51 PolarHBondContact O-N 3.18Å; D48-E52 PolarHBondContact O-N 2.8Å
49	H	85.6	Confident	81.3	Confident	29 Å²	29	38.4 Å²	38.4	13%	0.134	17%	0.174	C	C	.	.	H	α-helix	trans	-66.3	-42.3	175.7	-176.8	86.5	0	0	0	112	E45 A46 L47 E52 L53 L184 L187 Y202	E45-H49 WeakPolarHBondContact O-CB 3.42Å; E45-H49 PolarHBondContact O-N 2.83Å; A46-H49 PolarHBondContact O-N 2.91Å; L47-H49 VanDerWaalsContact C-N 3.29Å; L47-H49 PolarHBondContact O-N 3.11Å; H49-E52 PolarHBondContact O-N 3.05Å; H49-L53 WeakPolarHBondContact O-CG 3.28Å; H49-L53 PolarHBondContact O-N 2.82Å; H49-L53 VanDerWaalsContact O-N 3.14Å; H49-L184 HydrophobicContact CB-CD1 3.44Å; H49-L184 VanDerWaalsContact CB-CD1 3.44Å; H49-L187 WeakPolarHBondContact CD2-CD2 3.3Å; H49-Y202 PolarHBondContact CE1-OH 2.87Å; H49-Y202 PolarHBondContact NE2-OH 2.96Å
50	V	86.6	Confident	82.2	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.8	-42.6	174.7	177.8	0	0	0	0	110.8	L29 A46 L47 E52 L53 I54 I159 L160 L187	L29-V50 HydrophobicContact CD1-CB 4.46Å; L29-V50 HydrophobicContact CD1-CG1 4.13Å; L29-V50 HydrophobicContact CD2-CG1 3.83Å; A46-V50 WeakPolarHBondContact O-CG2 3.46Å; A46-V50 PolarHBondContact O-N 3.34Å; L47-V50 PolarHBondContact O-N 3.42Å; V50-E52 VanDerWaalsContact C-N 3.31Å; V50-E52 PolarHBondContact O-N 2.93Å; V50-L53 PolarHBondContact O-N 3.01Å; V50-I54 HydrophobicContact CG1-CG1 4.3Å; V50-I54 WeakPolarHBondContact O-CG1 3.46Å; V50-I54 PolarHBondContact O-N 3.03Å; V50-I159 HydrophobicContact CG2-CG2 4.34Å; V50-L160 HydrophobicContact CG2-CD2 4.43Å; V50-L187 HydrophobicContact CG2-CD1 3.46Å; V50-L187 VanDerWaalsContact CG2-CD1 3.46Å; V50-L187 HydrophobicContact CG2-CD2 4.14Å; V50-L187 HydrophobicContact CG2-CG 4.46Å
51	E	88.5	Confident	83	Confident	9 Å²	9	39.7 Å²	39.7	4%	0.042	18%	0.182	C	C	.	.	H	α-helix	trans	-58	-43.8	175.5	-176.7	170.7	-124.2	0	0	111.3	G23 V24 F25 A26 L29 L47 D48 L53 I54 I55	G23-E51 WeakPolarHBondContact CA-OE1 3.43Å; G23-E51 VanDerWaalsContact N-CD 3.34Å; G23-E51 PolarHBondContact N-OE1 2.92Å; G23-E51 VanDerWaalsContact N-OE1 3.08Å; G23-E51 PolarHBondContact N-OE2 3.1Å; V24-E51 PolarHBondContact N-OE1 3.29Å; F25-E51 WeakPolarHBondContact CA-OE1 3.27Å; F25-E51 HydrophobicContact CB-CG 4.21Å; F25-E51 HydrophobicContact CD2-CG 4.41Å; F25-E51 PolarHBondContact N-OE1 2.98Å; A26-E51 PolarHBondContact N-OE1 3.47Å; A26-E51 VanDerWaalsContact N-OE1 3.13Å; L29-E51 HydrophobicContact CD1-CB 3.72Å; L29-E51 HydrophobicContact CD1-CG 4.41Å; L47-E51 PolarHBondContact O-N 3.2Å; D48-E51 PolarHBondContact O-N 3.18Å; E51-L53 PolarHBondContact O-N 2.86Å; E51-I54 PolarHBondContact O-N 2.85Å; E51-I55 HydrophobicContact CG-CD1 3.7Å; E51-I55 HydrophobicContact CG-CG1 4.34Å; E51-I55 WeakPolarHBondContact O-CB 3.44Å; E51-I55 VanDerWaalsContact O-CG1 3.23Å; E51-I55 WeakPolarHBondContact O-CG1 3.5Å; E51-I55 PolarHBondContact O-N 2.83Å
52	E	87	Confident	83.3	Confident	101 Å²	101	39.9 Å²	39.9	47%	0.472	18%	0.183	S	C	.	.	H	α-helix	trans	-60.2	-43.1	176	-179.1	165.9	-155.3	0	0	112.6	K18 D48 H49 V50 I55 R56	K18-E52 IonicContact NZ-OE1 3.1Å; K18-E52 PolarHBondContact NZ-OE1 2.9Å; D48-E52 PolarHBondContact O-N 2.8Å; H49-E52 PolarHBondContact O-N 3.05Å; V50-E52 VanDerWaalsContact C-N 3.31Å; V50-E52 PolarHBondContact O-N 2.93Å; E52-I55 PolarHBondContact O-N 3.2Å; E52-R56 WeakPolarHBondContact O-CB 2.99Å; E52-R56 PolarHBondContact O-N 3.48Å
53	L	87.8	Confident	83.4	Confident	12 Å²	12	42.7 Å²	42.7	6%	0.063	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-41.8	177.7	-66	175.7	0	0	0	112.2	H49 V50 E51 R56 L57 I159 M191 F201	H49-L53 WeakPolarHBondContact O-CG 3.28Å; H49-L53 PolarHBondContact O-N 2.82Å; H49-L53 VanDerWaalsContact O-N 3.14Å; V50-L53 PolarHBondContact O-N 3.01Å; E51-L53 PolarHBondContact O-N 2.86Å; L53-R56 PolarHBondContact O-N 2.96Å; L53-L57 PolarHBondContact O-N 2.9Å; L53-I159 HydrophobicContact CD1-CD1 4.34Å; L53-M191 HydrophobicContact CD1-CE 3.41Å; L53-M191 VanDerWaalsContact CD1-CE 3.41Å; L53-M191 HydrophobicContact CD1-SD 3.67Å; L53-M191 HydrophobicContact CD2-CE 4.49Å; L53-F201 HydrophobicContact CB-CD1 3.97Å; L53-F201 HydrophobicContact CB-CE1 3.7Å; L53-F201 HydrophobicContact CB-CZ 4.27Å; L53-F201 HydrophobicContact CD1-CD1 4.47Å; L53-F201 HydrophobicContact CD2-CB 4.14Å; L53-F201 HydrophobicContact CD2-CD1 3.59Å; L53-F201 HydrophobicContact CD2-CE1 4.24Å; L53-F201 HydrophobicContact CD2-CG 3.99Å; L53-F201 HydrophobicContact CG-CD1 4.2Å; L53-F201 HydrophobicContact CG-CE1 4.4Å
54	I	88.6	Confident	83.2	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68.1	-41.1	178.3	-66	-57.6	0	0	0	111.3	F25 L29 V50 E51 L57 L58 F110 L152 I155 A156	F25-I54 HydrophobicContact CD2-CG2 4.4Å; F25-I54 HydrophobicContact CE2-CG2 4.46Å; L29-I54 HydrophobicContact CD2-CG1 4.45Å; V50-I54 HydrophobicContact CG1-CG1 4.3Å; V50-I54 WeakPolarHBondContact O-CG1 3.46Å; V50-I54 PolarHBondContact O-N 3.03Å; E51-I54 PolarHBondContact O-N 2.85Å; I54-L57 PolarHBondContact O-N 2.9Å; I54-L58 WeakPolarHBondContact O-CB 3.48Å; I54-L58 PolarHBondContact O-N 2.86Å; I54-F110 HydrophobicContact CG2-CE2 4Å; I54-F110 HydrophobicContact CG2-CZ 4.49Å; I54-L152 HydrophobicContact CG2-CB 4.21Å; I54-L152 HydrophobicContact CG2-CD1 4.38Å; I54-L152 HydrophobicContact CG2-CD2 4.34Å; I54-I155 HydrophobicContact CD1-CB 4.48Å; I54-I155 HydrophobicContact CD1-CG2 4.23Å; I54-A156 HydrophobicContact CD1-CB 3.86Å; I54-A156 HydrophobicContact CG1-CB 4.2Å
55	I	84.6	Confident	82.9	Confident	12 Å²	12	43.2 Å²	43.2	6%	0.062	21%	0.212	C	C	.	.	H	α-helix	trans	-62.7	-43.8	174.8	-68.7	165.9	0	0	0	110.4	W21 F25 E51 E52 L57 L58 L59	W21-I55 HydrophobicContact CB-CD1 3.65Å; W21-I55 HydrophobicContact CB-CG1 3.94Å; W21-I55 HydrophobicContact CB-CG2 4.09Å; W21-I55 HydrophobicContact CG-CG2 4.34Å; F25-I55 HydrophobicContact CD2-CG1 4.1Å; F25-I55 HydrophobicContact CE2-CG1 4.07Å; E51-I55 HydrophobicContact CG-CD1 3.7Å; E51-I55 HydrophobicContact CG-CG1 4.34Å; E51-I55 WeakPolarHBondContact O-CB 3.44Å; E51-I55 VanDerWaalsContact O-CG1 3.23Å; E51-I55 WeakPolarHBondContact O-CG1 3.5Å; E51-I55 PolarHBondContact O-N 2.83Å; E52-I55 PolarHBondContact O-N 3.2Å; I55-L57 VanDerWaalsContact C-N 3.33Å; I55-L57 PolarHBondContact O-N 2.54Å; I55-L58 WeakPolarHBondContact O-CB 3.46Å; I55-L58 PolarHBondContact O-N 3.2Å; I55-L59 HydrophobicContact CG2-CD1 3.96Å; I55-L59 HydrophobicContact CG2-CG 4.34Å; I55-L59 VanDerWaalsContact O-CG 3.3Å; I55-L59 WeakPolarHBondContact O-CG 3.4Å; I55-L59 PolarHBondContact O-N 3.3Å
56	R	84	Confident	82.9	Confident	62 Å²	62	37.4 Å²	37.4	23%	0.234	19%	0.185	C	C	.	.	H	α-helix	trans	-58.1	-46.8	176.7	-167.2	-175.2	71.4	104.6	21.6	111	E52 L53 L58 L59 D60 L200 F201	E52-R56 WeakPolarHBondContact O-CB 2.99Å; E52-R56 PolarHBondContact O-N 3.48Å; L53-R56 PolarHBondContact O-N 2.96Å; R56-L58 PolarHBondContact O-N 2.87Å; R56-L59 PolarHBondContact O-N 2.87Å; R56-D60 VanDerWaalsContact O-CG 3.32Å; R56-D60 PolarHBondContact O-N 2.77Å; R56-L200 PolarHBondContact NH2-O 3.21Å; R56-F201 PolarHBondContact NH1-O 2.76Å; R56-F201 VanDerWaalsContact NH2-CD1 3.31Å
57	L	85.9	Confident	82.8	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-63.8	-41	178.3	-167.4	61.3	0	0	0	112.8	L53 I54 I55 D60 V61 F80 L152 I155 L200	L53-L57 PolarHBondContact O-N 2.9Å; I54-L57 PolarHBondContact O-N 2.9Å; I55-L57 VanDerWaalsContact C-N 3.33Å; I55-L57 PolarHBondContact O-N 2.54Å; L57-D60 PolarHBondContact O-N 2.71Å; L57-V61 WeakPolarHBondContact O-CG2 3.15Å; L57-V61 PolarHBondContact O-N 3.33Å; L57-F80 HydrophobicContact CD1-CE1 3.52Å; L57-F80 HydrophobicContact CD1-CZ 3.51Å; L57-F80 HydrophobicContact CD2-CE2 4.32Å; L57-F80 HydrophobicContact CD2-CZ 3.83Å; L57-F80 HydrophobicContact CG-CE1 4.42Å; L57-F80 HydrophobicContact CG-CZ 3.94Å; L57-L152 HydrophobicContact CB-CD2 3.99Å; L57-L152 HydrophobicContact CD2-CD2 3.8Å; L57-L152 HydrophobicContact CG-CD2 3.89Å; L57-I155 HydrophobicContact CD2-CB 4.2Å; L57-I155 HydrophobicContact CD2-CG1 4.04Å; L57-I155 HydrophobicContact CD2-CG2 3.89Å; L57-L200 HydrophobicContact CD1-CD1 4.36Å
58	L	84.8	Confident	82.9	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-60.1	-46.2	175.2	174.2	65	0	0	0	111.3	W21 F25 I54 I55 R56 V61 A62 I148 L152	W21-L58 HydrophobicContact CD2-CD2 4.28Å; W21-L58 HydrophobicContact CE3-CD2 3.88Å; W21-L58 HydrophobicContact CH2-CD2 3.56Å; W21-L58 HydrophobicContact CZ2-CD2 3.97Å; W21-L58 HydrophobicContact CZ3-CD2 3.5Å; F25-L58 HydrophobicContact CE2-CD2 4.34Å; F25-L58 HydrophobicContact CZ-CD2 4.13Å; I54-L58 WeakPolarHBondContact O-CB 3.48Å; I54-L58 PolarHBondContact O-N 2.86Å; I55-L58 WeakPolarHBondContact O-CB 3.46Å; I55-L58 PolarHBondContact O-N 3.2Å; R56-L58 PolarHBondContact O-N 2.87Å; L58-V61 PolarHBondContact O-N 3.47Å; L58-A62 VanDerWaalsContact O-CB 3.23Å; L58-A62 WeakPolarHBondContact O-CB 3.27Å; L58-A62 PolarHBondContact O-N 3.09Å; L58-I148 HydrophobicContact CD1-CG2 3.72Å; L58-L152 HydrophobicContact CB-CD1 3.81Å; L58-L152 HydrophobicContact CB-CD2 4.46Å; L58-L152 HydrophobicContact CD1-CD1 3.72Å; L58-L152 HydrophobicContact CG-CD1 4.22Å
59	L	80.6	Confident	82.9	Confident	44 Å²	44	43.1 Å²	43.1	23%	0.23	22%	0.216	C	C	.	.	H	α-helix	trans	-65.6	-38.6	179.1	-68.2	174	0	0	0	111.7	V17 I55 R56 A62 A63	V17-L59 HydrophobicContact CG1-CD1 4.45Å; V17-L59 HydrophobicContact CG1-CD2 4.07Å; I55-L59 HydrophobicContact CG2-CD1 3.96Å; I55-L59 HydrophobicContact CG2-CG 4.34Å; I55-L59 VanDerWaalsContact O-CG 3.3Å; I55-L59 WeakPolarHBondContact O-CG 3.4Å; I55-L59 PolarHBondContact O-N 3.3Å; R56-L59 PolarHBondContact O-N 2.87Å; L59-A62 PolarHBondContact O-N 2.74Å; L59-A63 VanDerWaalsContact O-CB 3.3Å; L59-A63 WeakPolarHBondContact O-CB 3.27Å; L59-A63 PolarHBondContact O-N 3.39Å
60	D	81	Confident	82.9	Confident	77 Å²	77	44.5 Å²	44.5	41%	0.412	23%	0.232	S	C	.	.	H	α-helix	trans	-63	-43.9	176	-72.3	-18.8	0	0	0	111.9	R56 L57	R56-D60 VanDerWaalsContact O-CG 3.32Å; R56-D60 PolarHBondContact O-N 2.77Å; L57-D60 PolarHBondContact O-N 2.71Å
61	V	82.2	Confident	82.9	Confident	6 Å²	6	47.3 Å²	47.3	4%	0.036	25%	0.248	C	C	.	.	H	α-helix	trans	-66.9	-41.3	176.2	174.3	0	0	0	0	111	L57 L58 K64 V72 I148	L57-V61 WeakPolarHBondContact O-CG2 3.15Å; L57-V61 PolarHBondContact O-N 3.33Å; L58-V61 PolarHBondContact O-N 3.47Å; V61-K64 PolarHBondContact O-N 3.38Å; V61-V72 HydrophobicContact CG1-CG1 4.14Å; V61-I148 HydrophobicContact CG1-CD1 4.37Å; V61-I148 HydrophobicContact CG1-CG1 4.25Å
62	A	76	Confident	82.8	Confident	3 Å²	3	47 Å²	47	3%	0.025	25%	0.246	C	C	.	.	H	α-helix	trans	-67.8	-38.2	-179.9	0	0	0	0	0	112.4	L58 L59 K64 R65 C135 L136	L58-A62 VanDerWaalsContact O-CB 3.23Å; L58-A62 WeakPolarHBondContact O-CB 3.27Å; L58-A62 PolarHBondContact O-N 3.09Å; L59-A62 PolarHBondContact O-N 2.74Å; A62-K64 PolarHBondContact O-N 3.33Å; A62-R65 PolarHBondContact O-N 3.43Å; A62-C135 CarbonylContact C-O 3.56Å; A62-C135 WeakPolarHBondContact CB-O 3.34Å; A62-C135 VanDerWaalsContact O-O 3.13Å; A62-L136 HydrophobicContact CB-CD2 4.29Å; A62-L136 HydrophobicContact CB-CG 4.37Å; A62-L136 VanDerWaalsContact O-CD2 3.24Å; A62-L136 WeakPolarHBondContact O-CD2 3.46Å
63	A	75.6	Confident	82.8	Confident	72 Å²	72	44.7 Å²	44.7	60%	0.595	24%	0.235	S	C	*	.	H	α-helix	trans	-56.8	-25.4	179.2	0	0	0	0	0	113.5	L59 R65	L59-A63 VanDerWaalsContact O-CB 3.3Å; L59-A63 WeakPolarHBondContact O-CB 3.27Å; L59-A63 PolarHBondContact O-N 3.39Å; A63-R65 VanDerWaalsContact C-N 3.31Å; A63-R65 PolarHBondContact O-N 3.09Å
64	K	75.6	Confident	82.7	Confident	118 Å²	118	49.3 Å²	49.3	51%	0.513	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-2.5	176.9	-63.7	-150	-171.8	170.8	0	115.2	V61 A62 H75	V61-K64 PolarHBondContact O-N 3.38Å; A62-K64 PolarHBondContact O-N 3.33Å; K64-H75 WeakPolarHBondContact CD-NE2 3.27Å; K64-H75 WeakPolarHBondContact CE-CE1 3.28Å; K64-H75 WeakPolarHBondContact CE-NE2 3.46Å; K64-H75 PolarHBondContact NZ-CE1 2.79Å; K64-H75 PolarHBondContact NZ-ND1 3.46Å
65	R	75.1	Confident	82.5	Confident	140 Å²	140	50.2 Å²	50.2	53%	0.528	26%	0.261	S	S	.	.			trans	52	60.4	177.6	-60.5	-175.3	-179.1	-169.4	-0.7	113.7	A62 A63 H67 Y138	A62-R65 PolarHBondContact O-N 3.43Å; A63-R65 VanDerWaalsContact C-N 3.31Å; A63-R65 PolarHBondContact O-N 3.09Å; R65-H67 PolarHBondContact O-CD2 2.94Å; R65-H67 PolarHBondContact O-N 2.86Å; R65-Y138 WeakPolarHBondContact CA-OH 3.15Å; R65-Y138 HydrophobicContact CB-CE1 3.95Å; R65-Y138 HydrophobicContact CG-CE1 4.31Å; R65-Y138 PolarHBondContact O-OH 3.41Å
66	P	80.4	Confident	82.6	Confident	6 Å²	6	49.6 Å²	49.6	4%	0.039	26%	0.258	C	S	.	.			trans	-68.5	125.9	176.1	28.2	-35.1	0	0	0	112.5	D71 V72 L136 Y138 I148	P66-D71 HydrophobicContact CB-CB 3.87Å; P66-V72 HydrophobicContact CB-CG2 3.48Å; P66-V72 VanDerWaalsContact CB-CG2 3.48Å; P66-V72 HydrophobicContact CG-CG2 3.83Å; P66-L136 HydrophobicContact CG-CD2 4.43Å; P66-Y138 PolarHBondContact O-OH 3.1Å; P66-I148 HydrophobicContact CG-CD1 4.43Å
67	H	79.3	Confident	82.5	Confident	128 Å²	128	49.4 Å²	49.4	59%	0.593	27%	0.266	S	S	*	.			trans	-94.3	-21.2	178.7	-70.1	-72.1	0	0	0	112.8	R65 D71 Y138	R65-H67 PolarHBondContact O-CD2 2.94Å; R65-H67 PolarHBondContact O-N 2.86Å; H67-D71 WeakPolarHBondContact CA-OD2 3.36Å; H67-D71 PolarHBondContact N-OD2 3.41Å; H67-Y138 AromaticContact CE1-CD1 3.82Å; H67-Y138 AromaticContact CE1-CD2 3.89Å; H67-Y138 AromaticContact CE1-CE1 3.62Å; H67-Y138 AromaticContact CE1-CE2 3.67Å; H67-Y138 AromaticContact CE1-CG 3.98Å; H67-Y138 AromaticContact CE1-CZ 3.54Å; H67-Y138 AromaticContact ND1-CD2 3.71Å; H67-Y138 AromaticContact ND1-CE2 3.31Å; H67-Y138 VanDerWaalsContact ND1-CE2 3.31Å; H67-Y138 WeakPolarHBondContact ND1-CE2 3.43Å; H67-Y138 AromaticContact ND1-CZ 3.56Å
68	S	85.8	Confident	82.3	Confident	43 Å²	43	56.5 Å²	56.5	30%	0.301	30%	0.296	S	S	.	.	S	Bend	trans	-136.1	166	-178.6	69.8	0	0	0	0	112	A70 D71 V72	S68-A70 PolarHBondContact O-N 3.45Å; S68-D71 PolarHBondContact N-OD2 2.96Å; S68-D71 PolarHBondContact O-N 3.29Å; S68-D71 PolarHBondContact OG-N 3.33Å; S68-D71 PolarHBondContact OG-OD1 2.83Å; S68-D71 PolarHBondContact OG-OD2 3.1Å; S68-V72 PolarHBondContact O-N 3.21Å
69	T	85.5	Confident	82.2	Confident	40 Å²	40	59.3 Å²	59.3	25%	0.245	31%	0.314	C	S	.	.	H	α-helix	trans	-62.5	-33.3	173.6	50.1	0	0	0	0	111.8	D71 V72 E73 L96 V144 F147	T69-D71 VanDerWaalsContact C-N 3.33Å; T69-D71 PolarHBondContact O-N 2.9Å; T69-V72 PolarHBondContact O-N 3.11Å; T69-E73 PolarHBondContact O-N 3.13Å; T69-L96 HydrophobicContact CG2-CD2 4.37Å; T69-V144 HydrophobicContact CG2-CG2 4.22Å; T69-F147 HydrophobicContact CG2-CB 4Å; T69-F147 HydrophobicContact CG2-CD2 4.35Å; T69-F147 HydrophobicContact CG2-CG 4.21Å
70	A	86	Confident	82.3	Confident	57 Å²	57	57.6 Å²	57.6	47%	0.471	31%	0.305	S	S	.	.	H	α-helix	trans	-64.5	-35	176	0	0	0	0	0	112.6	S68 V72 E73 Q74	S68-A70 PolarHBondContact O-N 3.45Å; A70-V72 VanDerWaalsContact C-N 3.34Å; A70-E73 PolarHBondContact O-N 3.12Å; A70-Q74 WeakPolarHBondContact O-CB 3.31Å; A70-Q74 PolarHBondContact O-N 3.19Å
71	D	86.6	Confident	82.2	Confident	60 Å²	60	55.3 Å²	55.3	32%	0.321	29%	0.294	S	S	.	.	H	α-helix	trans	-65.6	-40.6	176.3	-57.8	-36.6	0	0	0	111	P66 H67 S68 T69 H75	P66-D71 HydrophobicContact CB-CB 3.87Å; H67-D71 WeakPolarHBondContact CA-OD2 3.36Å; H67-D71 PolarHBondContact N-OD2 3.41Å; S68-D71 PolarHBondContact N-OD2 2.96Å; S68-D71 PolarHBondContact O-N 3.29Å; S68-D71 PolarHBondContact OG-N 3.33Å; S68-D71 PolarHBondContact OG-OD1 2.83Å; S68-D71 PolarHBondContact OG-OD2 3.1Å; T69-D71 VanDerWaalsContact C-N 3.33Å; T69-D71 PolarHBondContact O-N 2.9Å; D71-H75 WeakPolarHBondContact O-CB 3.47Å; D71-H75 PolarHBondContact O-N 2.87Å
72	V	85.7	Confident	81.5	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.006	32%	0.316	C	S	.	.	H	α-helix	trans	-65.7	-45.8	176.1	-174.5	0	0	0	0	110.4	V61 P66 S68 T69 A70 Q74 H75 I76 V144 F147 I148	V61-V72 HydrophobicContact CG1-CG1 4.14Å; P66-V72 HydrophobicContact CB-CG2 3.48Å; P66-V72 VanDerWaalsContact CB-CG2 3.48Å; P66-V72 HydrophobicContact CG-CG2 3.83Å; S68-V72 PolarHBondContact O-N 3.21Å; T69-V72 PolarHBondContact O-N 3.11Å; A70-V72 VanDerWaalsContact C-N 3.34Å; V72-Q74 PolarHBondContact O-N 3.16Å; V72-H75 WeakPolarHBondContact O-CB 3.39Å; V72-H75 PolarHBondContact O-N 3.23Å; V72-I76 HydrophobicContact CG1-CD1 3.71Å; V72-I76 HydrophobicContact CG1-CG1 4.37Å; V72-I76 VanDerWaalsContact O-CG1 3.32Å; V72-I76 WeakPolarHBondContact O-CG1 3.24Å; V72-I76 PolarHBondContact O-N 2.95Å; V72-V144 HydrophobicContact CG2-CG1 4.12Å; V72-F147 HydrophobicContact CB-CD1 3.92Å; V72-F147 HydrophobicContact CB-CE1 4.06Å; V72-F147 HydrophobicContact CG1-CD1 3.72Å; V72-F147 HydrophobicContact CG1-CE1 3.88Å; V72-I148 HydrophobicContact CG1-CG1 4.06Å; V72-I148 HydrophobicContact CG2-CD1 4.27Å; V72-I148 HydrophobicContact CG2-CG1 4Å
73	E	87.6	Confident	81.2	Confident	53 Å²	53	58.2 Å²	58.2	25%	0.248	32%	0.317	C	S	.	.	H	α-helix	trans	-60.2	-46.2	177.5	178.8	173.4	163.7	0	0	112.2	T69 A70 H75 I76 S77 V89 Q93 F147	T69-E73 PolarHBondContact O-N 3.13Å; A70-E73 PolarHBondContact O-N 3.12Å; E73-H75 VanDerWaalsContact C-N 3.28Å; E73-H75 PolarHBondContact O-N 2.8Å; E73-I76 PolarHBondContact O-N 3.18Å; E73-S77 VanDerWaalsContact O-CB 3.3Å; E73-S77 WeakPolarHBondContact O-CB 3.39Å; E73-S77 PolarHBondContact O-N 3.37Å; E73-S77 PolarHBondContact O-OG 2.82Å; E73-V89 HydrophobicContact CG-CG1 3.7Å; E73-V89 HydrophobicContact CG-CG2 4.04Å; E73-Q93 VanDerWaalsContact CD-NE2 3.34Å; E73-Q93 PolarHBondContact OE1-NE2 3.28Å; E73-Q93 PolarHBondContact OE2-NE2 3.44Å; E73-F147 HydrophobicContact CB-CE1 4.47Å; E73-F147 HydrophobicContact CB-CZ 4.28Å
74	Q	85.7	Confident	81.3	Confident	109 Å²	109	54.8 Å²	54.8	51%	0.509	29%	0.289	S	S	.	.	H	α-helix	trans	-63.6	-37.8	177.4	-167.7	-171.3	29.9	0	0	111.3	A70 V72 K78	A70-Q74 WeakPolarHBondContact O-CB 3.31Å; A70-Q74 PolarHBondContact O-N 3.19Å; V72-Q74 PolarHBondContact O-N 3.16Å; Q74-K78 HydrophobicContact CG-CD 4.42Å; Q74-K78 VanDerWaalsContact NE2-NZ 3.18Å; Q74-K78 WeakPolarHBondContact O-CG 3.15Å; Q74-K78 PolarHBondContact O-N 2.9Å
75	H	85	Confident	81.6	Confident	19 Å²	19	50.2 Å²	50.2	9%	0.088	27%	0.27	C	S	.	.	H	α-helix	trans	-63.9	-53.4	175.5	177.8	4.9	0	0	0	111.1	K64 D71 V72 E73 S77 K78 T79	K64-H75 WeakPolarHBondContact CD-NE2 3.27Å; K64-H75 WeakPolarHBondContact CE-CE1 3.28Å; K64-H75 WeakPolarHBondContact CE-NE2 3.46Å; K64-H75 PolarHBondContact NZ-CE1 2.79Å; K64-H75 PolarHBondContact NZ-ND1 3.46Å; D71-H75 WeakPolarHBondContact O-CB 3.47Å; D71-H75 PolarHBondContact O-N 2.87Å; V72-H75 WeakPolarHBondContact O-CB 3.39Å; V72-H75 PolarHBondContact O-N 3.23Å; E73-H75 VanDerWaalsContact C-N 3.28Å; E73-H75 PolarHBondContact O-N 2.8Å; H75-S77 VanDerWaalsContact C-N 3.3Å; H75-S77 PolarHBondContact O-N 2.86Å; H75-K78 PolarHBondContact O-N 2.93Å; H75-K78 VanDerWaalsContact O-N 3.11Å; H75-T79 WeakPolarHBondContact CE1-CG2 3.47Å; H75-T79 PolarHBondContact CE1-OG1 3.37Å; H75-T79 VanDerWaalsContact ND1-CG2 3.34Å; H75-T79 WeakPolarHBondContact ND1-CG2 3.44Å; H75-T79 PolarHBondContact ND1-OG1 2.82Å; H75-T79 PolarHBondContact O-N 3.14Å; H75-T79 PolarHBondContact O-OG1 2.93Å
76	I	85.6	Confident	81.6	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-57.5	-46.4	-179.1	-70.2	165	0	0	0	110.4	V72 E73 K78 T79 F80 N85 V89 F147 V151	V72-I76 HydrophobicContact CG1-CD1 3.71Å; V72-I76 HydrophobicContact CG1-CG1 4.37Å; V72-I76 VanDerWaalsContact O-CG1 3.32Å; V72-I76 WeakPolarHBondContact O-CG1 3.24Å; V72-I76 PolarHBondContact O-N 2.95Å; E73-I76 PolarHBondContact O-N 3.18Å; I76-K78 PolarHBondContact O-N 2.72Å; I76-T79 PolarHBondContact O-N 2.9Å; I76-F80 HydrophobicContact CG1-CE2 4.34Å; I76-F80 HydrophobicContact CG1-CZ 4.26Å; I76-F80 HydrophobicContact CG2-CB 4.25Å; I76-F80 HydrophobicContact CG2-CD2 3.67Å; I76-F80 HydrophobicContact CG2-CE2 4.05Å; I76-F80 HydrophobicContact CG2-CG 3.96Å; I76-F80 WeakPolarHBondContact O-CB 3.49Å; I76-F80 PolarHBondContact O-N 3.01Å; I76-N85 HydrophobicContact CG2-CB 4.27Å; I76-V89 HydrophobicContact CB-CG2 4.27Å; I76-V89 HydrophobicContact CG2-CG2 3.86Å; I76-F147 HydrophobicContact CD1-CE1 4.32Å; I76-V151 HydrophobicContact CD1-CB 4.16Å; I76-V151 HydrophobicContact CD1-CG1 3.7Å; I76-V151 HydrophobicContact CD1-CG2 3.51Å; I76-V151 HydrophobicContact CG1-CG1 4.47Å
77	S	82	Confident	81.4	Confident	57 Å²	57	44.6 Å²	44.6	40%	0.399	25%	0.251	S	S	.	.	H	α-helix	trans	-58.5	-31.7	179.8	-60.6	0	0	0	0	113.1	E73 H75 N85	E73-S77 VanDerWaalsContact O-CB 3.3Å; E73-S77 WeakPolarHBondContact O-CB 3.39Å; E73-S77 PolarHBondContact O-N 3.37Å; E73-S77 PolarHBondContact O-OG 2.82Å; H75-S77 VanDerWaalsContact C-N 3.3Å; H75-S77 PolarHBondContact O-N 2.86Å; S77-N85 PolarHBondContact O-ND2 2.8Å
78	K	81.9	Confident	81.7	Confident	152 Å²	152	38.5 Å²	38.5	66%	0.661	22%	0.222	S	C	*	.	H	α-helix	trans	-87.9	-31.4	179.3	-73.2	176.7	-179.4	174	0	114.1	Q74 H75 I76	Q74-K78 HydrophobicContact CG-CD 4.42Å; Q74-K78 VanDerWaalsContact NE2-NZ 3.18Å; Q74-K78 WeakPolarHBondContact O-CG 3.15Å; Q74-K78 PolarHBondContact O-N 2.9Å; H75-K78 PolarHBondContact O-N 2.93Å; H75-K78 VanDerWaalsContact O-N 3.11Å; I76-K78 PolarHBondContact O-N 2.72Å
79	T	82.3	Confident	81.6	Confident	60 Å²	60	36.6 Å²	36.6	37%	0.368	21%	0.209	S	C	.	.	H	α-helix	trans	-103.6	-31.3	-171.9	51	0	0	0	0	114.4	H75 I76	H75-T79 WeakPolarHBondContact CE1-CG2 3.47Å; H75-T79 PolarHBondContact CE1-OG1 3.37Å; H75-T79 VanDerWaalsContact ND1-CG2 3.34Å; H75-T79 WeakPolarHBondContact ND1-CG2 3.44Å; H75-T79 PolarHBondContact ND1-OG1 2.82Å; H75-T79 PolarHBondContact O-N 3.14Å; H75-T79 PolarHBondContact O-OG1 2.93Å; I76-T79 PolarHBondContact O-N 2.9Å
80	F	83.8	Confident	81.3	Confident	9 Å²	9	35.6 Å²	35.6	4%	0.039	20%	0.201	C	C	.	.	S	Bend	trans	-83.6	137.4	179.8	-71.3	17.2	0	0	0	109.2	L57 I76 N85 V151 I155 L200	L57-F80 HydrophobicContact CD1-CE1 3.52Å; L57-F80 HydrophobicContact CD1-CZ 3.51Å; L57-F80 HydrophobicContact CD2-CE2 4.32Å; L57-F80 HydrophobicContact CD2-CZ 3.83Å; L57-F80 HydrophobicContact CG-CE1 4.42Å; L57-F80 HydrophobicContact CG-CZ 3.94Å; I76-F80 HydrophobicContact CG1-CE2 4.34Å; I76-F80 HydrophobicContact CG1-CZ 4.26Å; I76-F80 HydrophobicContact CG2-CB 4.25Å; I76-F80 HydrophobicContact CG2-CD2 3.67Å; I76-F80 HydrophobicContact CG2-CE2 4.05Å; I76-F80 HydrophobicContact CG2-CG 3.96Å; I76-F80 WeakPolarHBondContact O-CB 3.49Å; I76-F80 PolarHBondContact O-N 3.01Å; F80-N85 HydrophobicContact CB-CB 3.78Å; F80-V151 HydrophobicContact CE2-CG1 3.95Å; F80-V151 HydrophobicContact CZ-CG1 4.36Å; F80-I155 HydrophobicContact CD2-CD1 4.15Å; F80-I155 HydrophobicContact CE2-CD1 3.9Å; F80-I155 HydrophobicContact CE2-CG1 4.13Å; F80-L200 HydrophobicContact CD1-CD1 3.65Å; F80-L200 HydrophobicContact CE1-CD1 4.03Å; F80-L200 HydrophobicContact CG-CD1 4.09Å
81	P	78.1	Confident	81	Confident	28 Å²	28	35.2 Å²	35.2	18%	0.182	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-64.2	141.8	178.1	17.5	-23.1	0	0	0	111.5	L84 N85 V196 D199 L200	P81-L84 WeakPolarHBondContact O-CB 3.38Å; P81-L84 PolarHBondContact O-N 3.14Å; P81-N85 PolarHBondContact O-N 3.16Å; P81-V196 HydrophobicContact CB-CG1 4.11Å; P81-V196 HydrophobicContact CG-CG1 3.75Å; P81-V196 VanDerWaalsContact CG-O 3.28Å; P81-V196 WeakPolarHBondContact CG-O 3.4Å; P81-D199 HydrophobicContact CG-CB 4.27Å; P81-L200 HydrophobicContact CG-CB 4.34Å
82	A	67.8	Low	80.9	Confident	60 Å²	60	32.3 Å²	32.3	50%	0.496	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	143.5	173.7	0	0	0	0	0	110.6	N85 F364	A82-N85 WeakPolarHBondContact CA-OD1 3.4Å; A82-F364 HydrophobicContact CB-CZ 4.29Å
83	P	70.1	Confident	80.8	Confident	10 Å²	10	34.3 Å²	34.3	7%	0.065	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	cis	-89	3.6	2.3	36.6	-40.7	0	0	0	115.8	N85 A86 W87 M643	P83-N85 VanDerWaalsContact C-N 3.27Å; P83-N85 PolarHBondContact O-N 2.66Å; P83-A86 PolarHBondContact O-N 2.75Å; P83-A86 VanDerWaalsContact O-N 3.15Å; P83-W87 HydrophobicContact CB-CE3 4.18Å; P83-W87 HydrophobicContact CB-CH2 4.18Å; P83-W87 HydrophobicContact CB-CZ3 3.78Å; P83-W87 HydrophobicContact CG-CE3 4.06Å; P83-W87 HydrophobicContact CG-CH2 3.83Å; P83-W87 HydrophobicContact CG-CZ3 3.31Å; P83-W87 PolarHBondContact O-N 2.95Å; P83-M643 HydrophobicContact CG-CB 4.26Å; P83-M643 HydrophobicContact CG-CG 4.15Å
84	L	77.9	Confident	80.3	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-59.4	-37.3	-174.5	176.5	70.5	0	0	0	112.7	P81 A86 W87 A88 Y154 I155 V196 L197 L200	P81-L84 WeakPolarHBondContact O-CB 3.38Å; P81-L84 PolarHBondContact O-N 3.14Å; L84-A86 VanDerWaalsContact C-N 3.34Å; L84-A86 PolarHBondContact O-N 2.67Å; L84-W87 PolarHBondContact O-N 2.93Å; L84-A88 VanDerWaalsContact O-CB 3.3Å; L84-A88 WeakPolarHBondContact O-CB 3.08Å; L84-A88 PolarHBondContact O-N 3Å; L84-Y154 HydrophobicContact CD1-CE1 3.79Å; L84-I155 HydrophobicContact CD1-CD1 3.74Å; L84-I155 HydrophobicContact CD2-CD1 3.7Å; L84-I155 HydrophobicContact CG-CD1 3.81Å; L84-V196 HydrophobicContact CB-CG1 3.6Å; L84-V196 HydrophobicContact CD2-CG1 4.01Å; L84-V196 HydrophobicContact CG-CG1 4.43Å; L84-L197 HydrophobicContact CD2-CD2 4.35Å; L84-L200 HydrophobicContact CD2-CD2 3.78Å
85	N	81.1	Confident	79.8	Confident	22 Å²	22	29.2 Å²	29.2	12%	0.118	16%	0.162	C	C	.	.	H	α-helix	trans	-52.9	-48	174.6	61.2	-12.8	0	0	0	112.9	I76 S77 F80 P81 A82 P83 A88 V89	I76-N85 HydrophobicContact CG2-CB 4.27Å; S77-N85 PolarHBondContact O-ND2 2.8Å; F80-N85 HydrophobicContact CB-CB 3.78Å; P81-N85 PolarHBondContact O-N 3.16Å; A82-N85 WeakPolarHBondContact CA-OD1 3.4Å; P83-N85 VanDerWaalsContact C-N 3.27Å; P83-N85 PolarHBondContact O-N 2.66Å; N85-A88 PolarHBondContact O-N 3.25Å; N85-V89 VanDerWaalsContact O-CG2 3.31Å; N85-V89 WeakPolarHBondContact O-CG2 3.33Å; N85-V89 PolarHBondContact O-N 3.01Å
86	A	75.5	Confident	79.5	Confident	10 Å²	10	29.7 Å²	29.7	8%	0.083	17%	0.165	C	C	.	.	H	α-helix	trans	-69.1	-42.2	-174.6	0	0	0	0	0	112.1	P83 L84 K90 L355 F364	P83-A86 PolarHBondContact O-N 2.75Å; P83-A86 VanDerWaalsContact O-N 3.15Å; L84-A86 VanDerWaalsContact C-N 3.34Å; L84-A86 PolarHBondContact O-N 2.67Å; A86-K90 WeakPolarHBondContact O-CB 3.31Å; A86-K90 PolarHBondContact O-N 3.22Å; A86-L355 HydrophobicContact CB-CD1 4.12Å; A86-F364 HydrophobicContact CB-CE2 4.04Å
87	W	76.9	Confident	79	Confident	19 Å²	19	32.4 Å²	32.4	7%	0.072	18%	0.181	C	C	.	.	H	α-helix	trans	-69.8	-38.3	176.6	-72.4	-46.1	0	0	0	112.9	P83 L84 V89 K90 E91 Y154 R646 M647	P83-W87 HydrophobicContact CB-CE3 4.18Å; P83-W87 HydrophobicContact CB-CH2 4.18Å; P83-W87 HydrophobicContact CB-CZ3 3.78Å; P83-W87 HydrophobicContact CG-CE3 4.06Å; P83-W87 HydrophobicContact CG-CH2 3.83Å; P83-W87 HydrophobicContact CG-CZ3 3.31Å; P83-W87 PolarHBondContact O-N 2.95Å; L84-W87 PolarHBondContact O-N 2.93Å; W87-V89 VanDerWaalsContact C-N 3.32Å; W87-V89 PolarHBondContact O-N 3.43Å; W87-K90 PolarHBondContact O-N 3.33Å; W87-E91 PolarHBondContact O-N 3.21Å; W87-Y154 HydrophobicContact CB-CE1 4.03Å; W87-Y154 HydrophobicContact CB-CE2 4.42Å; W87-Y154 WeakPolarHBondContact CB-OH 3.42Å; W87-R646 HydrophobicContact CE3-CB 3.81Å; W87-R646 HydrophobicContact CE3-CG 4.36Å; W87-R646 HydrophobicContact CH2-CB 3.14Å; W87-R646 HydrophobicContact CH2-CG 4.31Å; W87-R646 HydrophobicContact CZ2-CB 4.08Å; W87-R646 HydrophobicContact CZ3-CB 2.99Å; W87-R646 HydrophobicContact CZ3-CG 3.73Å; W87-M647 HydrophobicContact CH2-CG 4.12Å; W87-M647 HydrophobicContact CZ2-CG 4.06Å
88	A	84	Confident	78.3	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.6	-42	176	0	0	0	0	0	111.8	L84 N85 A92 V151 Y154	L84-A88 VanDerWaalsContact O-CB 3.3Å; L84-A88 WeakPolarHBondContact O-CB 3.08Å; L84-A88 PolarHBondContact O-N 3Å; N85-A88 PolarHBondContact O-N 3.25Å; A88-A92 WeakPolarHBondContact O-CB 3.32Å; A88-A92 PolarHBondContact O-N 3.47Å; A88-V151 HydrophobicContact CB-CG1 4.38Å; A88-Y154 HydrophobicContact CB-CD1 3.76Å; A88-Y154 HydrophobicContact CB-CE1 4.15Å
89	V	85.4	Confident	77.4	Confident	3 Å²	3	30.2 Å²	30.2	2%	0.018	17%	0.172	C	C	.	.	H	α-helix	trans	-66.2	-45.8	174.7	170	0	0	0	0	111.2	E73 I76 N85 W87 E91 A92 Q93 I362	E73-V89 HydrophobicContact CG-CG1 3.7Å; E73-V89 HydrophobicContact CG-CG2 4.04Å; I76-V89 HydrophobicContact CB-CG2 4.27Å; I76-V89 HydrophobicContact CG2-CG2 3.86Å; N85-V89 VanDerWaalsContact O-CG2 3.31Å; N85-V89 WeakPolarHBondContact O-CG2 3.33Å; N85-V89 PolarHBondContact O-N 3.01Å; W87-V89 VanDerWaalsContact C-N 3.32Å; W87-V89 PolarHBondContact O-N 3.43Å; V89-E91 PolarHBondContact O-N 3.27Å; V89-A92 PolarHBondContact O-N 3.4Å; V89-Q93 HydrophobicContact CG1-CG 4.28Å; V89-Q93 WeakPolarHBondContact O-CB 3.17Å; V89-Q93 WeakPolarHBondContact O-CG 3.34Å; V89-Q93 PolarHBondContact O-N 2.81Å; V89-I362 HydrophobicContact CG1-CD1 4.29Å
90	K	79.2	Confident	76.1	Confident	19 Å²	19	33.4 Å²	33.4	8%	0.083	18%	0.183	C	C	.	.	H	α-helix	trans	-56.7	-50.8	179.1	-179.4	-175.7	175.8	-176.9	0	111.7	A86 W87 A92 Q93 E94 L355	A86-K90 WeakPolarHBondContact O-CB 3.31Å; A86-K90 PolarHBondContact O-N 3.22Å; W87-K90 PolarHBondContact O-N 3.33Å; K90-A92 PolarHBondContact O-N 2.91Å; K90-Q93 PolarHBondContact O-N 3.49Å; K90-E94 WeakPolarHBondContact CE-OE1 3.44Å; K90-E94 WeakPolarHBondContact O-CG 3.43Å; K90-E94 PolarHBondContact O-N 2.78Å; K90-L355 HydrophobicContact CD-CD2 4.07Å
91	E	79.2	Confident	74.4	Confident	48 Å²	48	39.4 Å²	39.4	22%	0.224	21%	0.205	C	C	.	.	H	α-helix	trans	-64.1	-40.4	-179.8	-76.8	-73.4	156.1	0	0	111.7	W87 V89 Q93 E94 V95 R106 Y154 R657	W87-E91 PolarHBondContact O-N 3.21Å; V89-E91 PolarHBondContact O-N 3.27Å; E91-Q93 VanDerWaalsContact C-N 3.34Å; E91-Q93 PolarHBondContact O-N 3.36Å; E91-E94 PolarHBondContact O-N 2.77Å; E91-V95 WeakPolarHBondContact O-CG2 3.42Å; E91-V95 PolarHBondContact O-N 2.92Å; E91-R106 IonicContact OE2-NH1 2.7Å; E91-R106 PolarHBondContact OE2-NH1 2.96Å; E91-Y154 HydrophobicContact CB-CD2 4.02Å; E91-Y154 HydrophobicContact CB-CG 4.44Å; E91-Y154 HydrophobicContact CG-CD2 3.64Å; E91-Y154 HydrophobicContact CG-CE2 3.86Å; E91-Y154 HydrophobicContact CG-CG 4.5Å; E91-R657 IonicContact OE1-NH2 3.31Å
92	A	84	Confident	72.4	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.4	-38	176.3	0	0	0	0	0	112.7	A88 V89 K90 L96 F147 V151	A88-A92 WeakPolarHBondContact O-CB 3.32Å; A88-A92 PolarHBondContact O-N 3.47Å; V89-A92 PolarHBondContact O-N 3.4Å; K90-A92 PolarHBondContact O-N 2.91Å; A92-L96 WeakPolarHBondContact O-CB 3.31Å; A92-L96 PolarHBondContact O-N 3.05Å; A92-L96 VanDerWaalsContact O-N 3.11Å; A92-F147 HydrophobicContact CB-CD1 4.36Å; A92-F147 HydrophobicContact CB-CD2 3.74Å; A92-F147 HydrophobicContact CB-CE1 4.19Å; A92-F147 HydrophobicContact CB-CE2 3.54Å; A92-F147 HydrophobicContact CB-CG 4.16Å; A92-F147 HydrophobicContact CB-CZ 3.78Å; A92-V151 HydrophobicContact CB-CG2 3.68Å
93	Q	84.1	Confident	70.9	Confident	43 Å²	43	54 Å²	54	20%	0.201	25%	0.25	C	C	.	.	H	α-helix	trans	-67.2	-42.8	173.5	-72.4	175.9	-9.9	0	0	111.8	E73 V89 K90 E91 V95 L96 V97 F147	E73-Q93 VanDerWaalsContact CD-NE2 3.34Å; E73-Q93 PolarHBondContact OE1-NE2 3.28Å; E73-Q93 PolarHBondContact OE2-NE2 3.44Å; V89-Q93 HydrophobicContact CG1-CG 4.28Å; V89-Q93 WeakPolarHBondContact O-CB 3.17Å; V89-Q93 WeakPolarHBondContact O-CG 3.34Å; V89-Q93 PolarHBondContact O-N 2.81Å; K90-Q93 PolarHBondContact O-N 3.49Å; E91-Q93 VanDerWaalsContact C-N 3.34Å; E91-Q93 PolarHBondContact O-N 3.36Å; Q93-V95 VanDerWaalsContact C-N 3.32Å; Q93-V95 PolarHBondContact O-N 3.32Å; Q93-L96 PolarHBondContact O-N 2.78Å; Q93-V97 WeakPolarHBondContact O-CG2 3.47Å; Q93-V97 PolarHBondContact O-N 3.25Å; Q93-F147 HydrophobicContact CG-CE2 3.99Å
94	E	76.9	Confident	69.5	Low	25 Å²	25	64.8 Å²	64.8	12%	0.117	29%	0.289	C	S	.	.	H	α-helix	trans	-59.1	-41.8	176.5	-76.4	-169.2	-165.7	0	0	111.9	K90 E91 V97 K98 R657	K90-E94 WeakPolarHBondContact CE-OE1 3.44Å; K90-E94 WeakPolarHBondContact O-CG 3.43Å; K90-E94 PolarHBondContact O-N 2.78Å; E91-E94 PolarHBondContact O-N 2.77Å; E94-V97 PolarHBondContact O-N 2.77Å; E94-K98 WeakPolarHBondContact O-CB 3.44Å; E94-K98 VanDerWaalsContact O-CG 3.32Å; E94-K98 WeakPolarHBondContact O-CG 3.23Å; E94-K98 PolarHBondContact O-N 3.28Å; E94-K98 IonicContact OE2-NZ 2.72Å; E94-R657 IonicContact OE1-NH1 3.75Å; E94-R657 IonicContact OE1-NH2 2.82Å; E94-R657 PolarHBondContact OE1-NH2 3.11Å; E94-R657 IonicContact OE2-CZ 2.72Å; E94-R657 IonicContact OE2-NH2 2.8Å; E94-R657 PolarHBondContact OE2-NH2 3.45Å; E94-R657 VanDerWaalsContact OE2-NH2 3.09Å
95	V	76	Confident	67.8	Low	30 Å²	30	71 Å²	71	18%	0.182	32%	0.322	C	S	.	.	H	α-helix	trans	-64.8	-42.2	176.1	174.3	0	0	0	0	111.1	E91 Q93 V97 K98 S99 L146 S150	E91-V95 WeakPolarHBondContact O-CG2 3.42Å; E91-V95 PolarHBondContact O-N 2.92Å; Q93-V95 VanDerWaalsContact C-N 3.32Å; Q93-V95 PolarHBondContact O-N 3.32Å; V95-V97 VanDerWaalsContact C-N 3.35Å; V95-V97 PolarHBondContact O-N 2.9Å; V95-K98 PolarHBondContact O-N 3.4Å; V95-S99 PolarHBondContact O-N 3.37Å; V95-L146 HydrophobicContact CG1-CD1 4.14Å; V95-L146 HydrophobicContact CG1-CD2 4.42Å; V95-L146 HydrophobicContact CG1-CG 4.33Å; V95-S150 WeakPolarHBondContact CG1-OG 3.39Å
96	L	78	Confident	66.3	Low	29 Å²	29	77.1 Å²	77.1	15%	0.152	34%	0.344	C	S	.	.	H	α-helix	trans	-64.1	-37.9	177.9	-169.2	69.7	0	0	0	112.1	T69 A92 Q93 S99 H100 Q143 L146	T69-L96 HydrophobicContact CG2-CD2 4.37Å; A92-L96 WeakPolarHBondContact O-CB 3.31Å; A92-L96 PolarHBondContact O-N 3.05Å; A92-L96 VanDerWaalsContact O-N 3.11Å; Q93-L96 PolarHBondContact O-N 2.78Å; L96-S99 PolarHBondContact O-OG 2.81Å; L96-H100 PolarHBondContact O-CE1 2.99Å; L96-H100 PolarHBondContact O-ND1 2.74Å; L96-Q143 HydrophobicContact CD1-CB 4.08Å; L96-Q143 HydrophobicContact CD1-CG 4.33Å; L96-L146 HydrophobicContact CD1-CD2 4.36Å
97	V	74.3	Confident	65.2	Low	57 Å²	57	81.2 Å²	81.2	35%	0.345	37%	0.372	S	S	.	.	H	α-helix	trans	-68.6	-44.8	175.9	173.6	0	0	0	0	110.7	Q93 E94 V95 S99 H100 Y360	Q93-V97 WeakPolarHBondContact O-CG2 3.47Å; Q93-V97 PolarHBondContact O-N 3.25Å; E94-V97 PolarHBondContact O-N 2.77Å; V95-V97 VanDerWaalsContact C-N 3.35Å; V95-V97 PolarHBondContact O-N 2.9Å; V97-S99 VanDerWaalsContact C-N 3.3Å; V97-S99 PolarHBondContact O-N 3.35Å; V97-H100 PolarHBondContact O-N 2.82Å; V97-Y360 HydrophobicContact CG2-CE2 4.42Å
98	K	68.4	Low	64.4	Low	97 Å²	97	81.9 Å²	81.9	42%	0.422	38%	0.381	S	S	.	.	H	α-helix	trans	-64.7	-33.5	179.6	-72.9	172.6	-176.4	169.4	0	112.2	E94 V95 H100 R101	E94-K98 WeakPolarHBondContact O-CB 3.44Å; E94-K98 VanDerWaalsContact O-CG 3.32Å; E94-K98 WeakPolarHBondContact O-CG 3.23Å; E94-K98 PolarHBondContact O-N 3.28Å; E94-K98 IonicContact OE2-NZ 2.72Å; V95-K98 PolarHBondContact O-N 3.4Å; K98-H100 PolarHBondContact O-N 2.97Å; K98-H100 VanDerWaalsContact O-N 3.12Å; K98-R101 PolarHBondContact O-N 3.49Å; K98-R101 VanDerWaalsContact O-O 3.12Å
99	S	62.8	Low	63.8	Low	65 Å²	65	83 Å²	83	46%	0.455	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-19.2	178.8	73.9	0	0	0	0	114.2	V95 L96 V97 R101	V95-S99 PolarHBondContact O-N 3.37Å; L96-S99 PolarHBondContact O-OG 2.81Å; V97-S99 VanDerWaalsContact C-N 3.3Å; V97-S99 PolarHBondContact O-N 3.35Å; S99-R101 VanDerWaalsContact C-N 3.34Å
100	H	54.8	Low	63.5	Low	127 Å²	127	83 Å²	83	59%	0.588	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-17	175.6	-69.8	79.4	0	0	0	112.9	L96 V97 K98 Q143	L96-H100 PolarHBondContact O-CE1 2.99Å; L96-H100 PolarHBondContact O-ND1 2.74Å; V97-H100 PolarHBondContact O-N 2.82Å; K98-H100 PolarHBondContact O-N 2.97Å; K98-H100 VanDerWaalsContact O-N 3.12Å; H100-Q143 PolarHBondContact NE2-NE2 3.33Å
101	R	48.7	Very low	63.3	Low	136 Å²	136	83.4 Å²	83.4	51%	0.513	39%	0.392	S	S	.	.	S	Bend	trans	-96.6	130.7	176.2	-63.8	-177.5	176.9	179.6	-2.8	108	K98 S99 H103 D776	K98-R101 PolarHBondContact O-N 3.49Å; K98-R101 VanDerWaalsContact O-O 3.12Å; S99-R101 VanDerWaalsContact C-N 3.34Å; R101-H103 PolarHBondContact O-N 2.84Å; R101-D776 IonicContact CZ-OD1 3.05Å; R101-D776 IonicContact CZ-OD2 3.94Å; R101-D776 IonicContact NH1-OD1 2.79Å; R101-D776 PolarHBondContact NH1-OD1 3.3Å; R101-D776 IonicContact NH1-OD2 3.91Å; R101-D776 PolarHBondContact NH1-OD2 3.31Å; R101-D776 IonicContact NH2-OD1 3.33Å; R101-D776 PolarHBondContact NH2-OD1 2.87Å; R101-D776 IonicContact NH2-OD2 3.69Å
102	R	36.1	Very low	63.1	Low	255 Å²	255	84 Å²	84	96%	0.962	40%	0.396	S	S	*	.			trans	-66.8	19.4	-176.9	-59.5	-175.6	-166.5	173.5	4.4	114.6
103	H	36.1	Very low	62.5	Low	140 Å²	140	91.7 Å²	91.7	65%	0.648	43%	0.432	S	S	*	.			trans	-88.2	121.6	178.1	-101.1	-89.1	0	0	0	110.2	R101 D105	R101-H103 PolarHBondContact O-N 2.84Å; H103-D105 IonicContact CG-OD2 3.76Å; H103-D105 IonicContact ND1-OD2 3.73Å; H103-D105 PolarHBondContact ND1-OD2 3.41Å; H103-D105 PolarHBondContact O-N 2.93Å; H103-D105 VanDerWaalsContact O-N 3.1Å
104	R	40.7	Very low	62.1	Low	235 Å²	235	96.8 Å²	96.8	89%	0.887	45%	0.449	S	S	*	.			trans	-69.7	4.4	-176.5	-85.6	178.6	168.8	-179.5	-3.8	114.5	R106	R104-R106 VanDerWaalsContact C-N 3.3Å; R104-R106 PolarHBondContact O-N 3.21Å; R104-R106 VanDerWaalsContact O-N 3.13Å
105	D	42.8	Very low	62	Low	131 Å²	131	95.6 Å²	95.6	70%	0.701	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	8.8	-158.9	-63.4	-42.7	0	0	0	116.3	H103	H103-D105 IonicContact CG-OD2 3.76Å; H103-D105 IonicContact ND1-OD2 3.73Å; H103-D105 PolarHBondContact ND1-OD2 3.41Å; H103-D105 PolarHBondContact O-N 2.93Å; H103-D105 VanDerWaalsContact O-N 3.1Å
106	R	48.8	Very low	61.9	Low	151 Å²	151	95.7 Å²	95.7	57%	0.57	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-158.8	79.4	162.6	-112.7	-173	-176.6	-168.2	2.2	109.8	E91 R104	E91-R106 IonicContact OE2-NH1 2.7Å; E91-R106 PolarHBondContact OE2-NH1 2.96Å; R104-R106 VanDerWaalsContact C-N 3.3Å; R104-R106 PolarHBondContact O-N 3.21Å; R104-R106 VanDerWaalsContact O-N 3.13Å
107	S	53	Low	61.5	Low	96 Å²	96	99.4 Å²	99.4	67%	0.671	46%	0.462	S	S	*	.			trans	-70.8	134.5	165.1	49.9	0	0	0	0	109.1	I109	S107-I109 PolarHBondContact O-N 2.95Å
108	A	60.3	Low	61.4	Low	33 Å²	33	98.8 Å²	98.8	27%	0.273	46%	0.456	S	S	.	.			trans	-53.7	134.7	176.8	0	0	0	0	0	110.4	F110 L146	A108-F110 VanDerWaalsContact C-N 3.3Å; A108-L146 HydrophobicContact CB-CD1 4.38Å
109	I	69.9	Low	61.4	Low	22 Å²	22	94.7 Å²	94.7	11%	0.113	44%	0.439	C	S	.	.	S	Bend	trans	-73.3	-32.1	-178.3	-60.1	166.1	0	0	0	109.8	S28 R31 V32 D35 S107 E153	S28-I109 WeakPolarHBondContact CB-O 3.12Å; S28-I109 WeakPolarHBondContact O-CG2 3.38Å; S28-I109 PolarHBondContact OG-O 3.12Å; R31-I109 HydrophobicContact CB-CG2 3.71Å; V32-I109 HydrophobicContact CG2-CB 4.33Å; V32-I109 HydrophobicContact CG2-CD1 3.92Å; V32-I109 HydrophobicContact CG2-CG2 4Å; D35-I109 WeakPolarHBondContact OD2-CD1 3.48Å; S107-I109 PolarHBondContact O-N 2.95Å; I109-E153 WeakPolarHBondContact CD1-OE1 3.42Å; I109-E153 PolarHBondContact N-OE2 2.9Å
110	F	79.1	Confident	61.2	Low	3 Å²	3	97.2 Å²	97.2	1%	0.013	44%	0.438	C	S	.	.	S	Bend	trans	-71.4	146.9	178.4	-83.2	32.3	0	0	0	111.5	F25 L29 V32 I54 A108 L112 L152 E153 A156	F25-F110 AromaticContact CD1-CD2 3.55Å; F25-F110 HydrophobicContact CD1-CD2 3.55Å; F25-F110 AromaticContact CD1-CE2 3.62Å; F25-F110 HydrophobicContact CD1-CE2 3.62Å; F25-F110 HydrophobicContact CD1-CG 4.17Å; F25-F110 HydrophobicContact CD1-CZ 4.3Å; F25-F110 AromaticContact CE1-CD2 3.54Å; F25-F110 HydrophobicContact CE1-CD2 3.54Å; F25-F110 AromaticContact CE1-CE2 3.86Å; F25-F110 HydrophobicContact CE1-CE2 3.86Å; F25-F110 HydrophobicContact CE1-CG 4.38Å; F25-F110 HydrophobicContact CG-CE2 4.45Å; L29-F110 HydrophobicContact CD2-CE1 4.2Å; L29-F110 HydrophobicContact CD2-CZ 3.89Å; V32-F110 HydrophobicContact CG2-CE1 4.01Å; I54-F110 HydrophobicContact CG2-CE2 4Å; I54-F110 HydrophobicContact CG2-CZ 4.49Å; A108-F110 VanDerWaalsContact C-N 3.3Å; F110-L112 VanDerWaalsContact C-N 3.3Å; F110-L112 PolarHBondContact O-N 3.49Å; F110-L152 HydrophobicContact CD2-CB 4.32Å; F110-L152 HydrophobicContact CE2-CB 3.87Å; F110-E153 HydrophobicContact CD1-CB 4.12Å; F110-E153 HydrophobicContact CD1-CG 4.08Å; F110-E153 HydrophobicContact CE1-CB 4.24Å; F110-E153 HydrophobicContact CE1-CG 4.23Å; F110-E153 HydrophobicContact CG-CB 4.33Å; F110-A156 HydrophobicContact CE1-CB 4.47Å; F110-A156 HydrophobicContact CZ-CB 3.94Å
111	P	75	Confident	61	Low	29 Å²	29	94.5 Å²	94.5	19%	0.188	43%	0.43	C	S	.	.			trans	-79	78.1	-170.2	33.3	-33.9	0	0	0	111	V24 S28 Q113 R114 V115	V24-P111 HydrophobicContact CG1-CG 4.07Å; S28-P111 WeakPolarHBondContact OG-CD 3.45Å; P111-Q113 VanDerWaalsContact C-N 3.26Å; P111-Q113 PolarHBondContact O-N 3.45Å; P111-Q113 VanDerWaalsContact O-N 3.11Å; P111-R114 HydrophobicContact CB-CB 4.15Å; P111-R114 HydrophobicContact CB-CG 4.4Å; P111-R114 HydrophobicContact CG-CB 4.38Å; P111-R114 PolarHBondContact O-N 3.46Å; P111-V115 HydrophobicContact CG-CG2 4.35Å; P111-V115 PolarHBondContact O-N 3.37Å
112	L	76	Confident	60.6	Low	59 Å²	59	92.3 Å²	92.3	31%	0.309	44%	0.436	S	S	.	.	H	α-helix	trans	-50.1	-43.1	-171.3	-176.1	69.3	0	0	0	113.2	F110 H116 T145 L146	F110-L112 VanDerWaalsContact C-N 3.3Å; F110-L112 PolarHBondContact O-N 3.49Å; L112-H116 WeakPolarHBondContact O-CB 3.42Å; L112-H116 PolarHBondContact O-N 3.39Å; L112-T145 HydrophobicContact CD1-CG2 3.96Å; L112-L146 HydrophobicContact CD1-CB 4.2Å; L112-L146 HydrophobicContact CD1-CD1 4.24Å; L112-L146 HydrophobicContact CD2-CD1 4.27Å
113	Q	71.8	Confident	60.6	Low	162 Å²	162	82.9 Å²	82.9	76%	0.757	41%	0.412	S	S	*	.	H	α-helix	trans	-65.9	-41.7	179.6	-69.7	-179.2	-7.4	0	0	112.3	P111 L117	P111-Q113 VanDerWaalsContact C-N 3.26Å; P111-Q113 PolarHBondContact O-N 3.45Å; P111-Q113 VanDerWaalsContact O-N 3.11Å; Q113-L117 WeakPolarHBondContact O-CB 3.33Å; Q113-L117 WeakPolarHBondContact O-CG 3.44Å; Q113-L117 PolarHBondContact O-N 3.26Å
114	R	73.8	Confident	60.5	Low	150 Å²	150	82 Å²	82	57%	0.566	42%	0.419	S	S	*	.	H	α-helix	trans	-67.6	-44.7	177.6	-70	-173.8	178.9	166.7	1.8	110.8	P111 L117 L118	P111-R114 HydrophobicContact CB-CB 4.15Å; P111-R114 HydrophobicContact CB-CG 4.4Å; P111-R114 HydrophobicContact CG-CB 4.38Å; P111-R114 PolarHBondContact O-N 3.46Å; R114-L117 PolarHBondContact O-N 3.32Å; R114-L118 WeakPolarHBondContact O-CB 3.49Å; R114-L118 VanDerWaalsContact O-CG 3.3Å; R114-L118 WeakPolarHBondContact O-CG 3.32Å; R114-L118 PolarHBondContact O-N 3.06Å
115	V	75.1	Confident	60.2	Low	1 Å²	1	77.4 Å²	77.4	1%	0.006	42%	0.417	C	S	.	.	H	α-helix	trans	-60.3	-47.8	175.7	178.4	0	0	0	0	110.4	F25 P111 L117 L118 L119 T145	F25-V115 HydrophobicContact CE1-CG2 3.73Å; F25-V115 HydrophobicContact CZ-CG2 3.96Å; P111-V115 HydrophobicContact CG-CG2 4.35Å; P111-V115 PolarHBondContact O-N 3.37Å; V115-L117 VanDerWaalsContact C-N 3.35Å; V115-L117 PolarHBondContact O-N 3.28Å; V115-L118 PolarHBondContact O-N 3.35Å; V115-L119 HydrophobicContact CG1-CD1 3.93Å; V115-L119 HydrophobicContact CG1-CG 4.38Å; V115-L119 WeakPolarHBondContact O-CB 3.16Å; V115-L119 VanDerWaalsContact O-CG 3.28Å; V115-L119 WeakPolarHBondContact O-CG 3.48Å; V115-L119 PolarHBondContact O-N 3.29Å; V115-T145 HydrophobicContact CG1-CG2 4.12Å
116	H	74.7	Confident	60.1	Low	32 Å²	32	73.7 Å²	73.7	15%	0.148	41%	0.41	C	S	.	.	H	α-helix	trans	-59.9	-42.9	177.4	-173.1	70.5	0	0	0	112.1	L112 L119 R120 V140 T145	L112-H116 WeakPolarHBondContact O-CB 3.42Å; L112-H116 PolarHBondContact O-N 3.39Å; H116-L119 PolarHBondContact O-N 3.37Å; H116-R120 WeakPolarHBondContact O-CB 3.4Å; H116-R120 PolarHBondContact O-N 2.78Å; H116-V140 PolarHBondContact CE1-O 2.97Å; H116-T145 HydrophobicContact CB-CG2 3.88Å; H116-T145 PolarHBondContact ND1-OG1 3.37Å
117	L	70.2	Confident	59.6	Low	107 Å²	107	76.7 Å²	76.7	56%	0.56	43%	0.427	S	S	*	.	H	α-helix	trans	-64.2	-44.9	177.4	-75.2	169.6	0	0	0	112.1	Q113 R114 V115 L119 R120 V121	Q113-L117 WeakPolarHBondContact O-CB 3.33Å; Q113-L117 WeakPolarHBondContact O-CG 3.44Å; Q113-L117 PolarHBondContact O-N 3.26Å; R114-L117 PolarHBondContact O-N 3.32Å; V115-L117 VanDerWaalsContact C-N 3.35Å; V115-L117 PolarHBondContact O-N 3.28Å; L117-L119 VanDerWaalsContact C-N 3.31Å; L117-L119 PolarHBondContact O-N 3.48Å; L117-R120 PolarHBondContact O-N 2.95Å; L117-R120 VanDerWaalsContact O-N 3.07Å; L117-V121 WeakPolarHBondContact O-CG2 3.42Å; L117-V121 PolarHBondContact O-N 3.26Å
118	L	70.5	Confident	59.2	Low	44 Å²	44	77.5 Å²	77.5	23%	0.23	42%	0.423	C	S	.	.	H	α-helix	trans	-65.6	-34.6	178.5	-70.9	171.5	0	0	0	112.2	W21 V24 R114 V115	W21-L118 HydrophobicContact CD2-CD1 4.23Å; W21-L118 HydrophobicContact CE3-CD1 3.68Å; W21-L118 HydrophobicContact CH2-CB 3.42Å; W21-L118 VanDerWaalsContact CH2-CB 3.42Å; W21-L118 HydrophobicContact CH2-CD1 3.95Å; W21-L118 HydrophobicContact CH2-CG 4.33Å; W21-L118 HydrophobicContact CZ2-CB 3.76Å; W21-L118 HydrophobicContact CZ2-CD1 4.47Å; W21-L118 HydrophobicContact CZ3-CB 3.92Å; W21-L118 HydrophobicContact CZ3-CD1 3.53Å; W21-L118 HydrophobicContact CZ3-CG 4.38Å; V24-L118 HydrophobicContact CG1-CD1 4.32Å; V24-L118 HydrophobicContact CG2-CD1 3.96Å; R114-L118 WeakPolarHBondContact O-CB 3.49Å; R114-L118 VanDerWaalsContact O-CG 3.3Å; R114-L118 WeakPolarHBondContact O-CG 3.32Å; R114-L118 PolarHBondContact O-N 3.06Å; V115-L118 PolarHBondContact O-N 3.35Å
119	L	68.4	Low	58.2	Low	10 Å²	10	79.8 Å²	79.8	5%	0.052	43%	0.427	C	S	.	.	H	α-helix	trans	-72.9	-27.2	171.2	-68.5	175.9	0	0	0	112.9	W21 V115 H116 L117 L136 T145	W21-L119 HydrophobicContact CH2-CD2 4.39Å; W21-L119 HydrophobicContact CH2-CG 4.43Å; W21-L119 HydrophobicContact CZ2-CD2 4.5Å; V115-L119 HydrophobicContact CG1-CD1 3.93Å; V115-L119 HydrophobicContact CG1-CG 4.38Å; V115-L119 WeakPolarHBondContact O-CB 3.16Å; V115-L119 VanDerWaalsContact O-CG 3.28Å; V115-L119 WeakPolarHBondContact O-CG 3.48Å; V115-L119 PolarHBondContact O-N 3.29Å; H116-L119 PolarHBondContact O-N 3.37Å; L117-L119 VanDerWaalsContact C-N 3.31Å; L117-L119 PolarHBondContact O-N 3.48Å; L119-L136 HydrophobicContact CB-CD1 4.34Å; L119-L136 HydrophobicContact CD1-CD1 4.5Å; L119-L136 HydrophobicContact CD2-CD1 3.91Å; L119-L136 HydrophobicContact CG-CD1 4.47Å; L119-T145 HydrophobicContact CD1-CG2 3.99Å
120	R	59.9	Low	56.8	Low	118 Å²	118	84 Å²	84	45%	0.445	46%	0.457	S	S	.	.	H	α-helix	trans	-90	-21.4	-172.2	-177.6	172.2	175.3	-179.4	-4.6	114.6	H116 L117 S122	H116-R120 WeakPolarHBondContact O-CB 3.4Å; H116-R120 PolarHBondContact O-N 2.78Å; L117-R120 PolarHBondContact O-N 2.95Å; L117-R120 VanDerWaalsContact O-N 3.07Å; R120-S122 WeakPolarHBondContact O-CB 3.44Å; R120-S122 PolarHBondContact O-N 2.94Å; R120-S122 PolarHBondContact O-OG 3.26Å
121	V	50.9	Low	55	Low	70 Å²	70	86.5 Å²	86.5	42%	0.424	47%	0.471	S	S	.	.			trans	-41.5	95.2	-166	-171.8	0	0	0	0	112.4	L117	L117-V121 WeakPolarHBondContact O-CG2 3.42Å; L117-V121 PolarHBondContact O-N 3.26Å
122	S	39	Very low	53.5	Low	91 Å²	91	87.4 Å²	87.4	64%	0.636	47%	0.473	S	S	*	.			trans	-127.2	66	175.7	-54.6	0	0	0	0	105.2	R120	R120-S122 WeakPolarHBondContact O-CB 3.44Å; R120-S122 PolarHBondContact O-N 2.94Å; R120-S122 PolarHBondContact O-OG 3.26Å
123	A	36.4	Very low	51.9	Low	56 Å²	56	89.9 Å²	89.9	46%	0.463	48%	0.483	S	S	.	.			trans	-142.2	129.1	178.9	0	0	0	0	0	110.2	V125 F129	A123-V125 PolarHBondContact O-N 2.96Å; A123-F129 WeakPolarHBondContact O-CE2 3.36Å
124	P	34.4	Very low	50.7	Low	121 Å²	121	88.6 Å²	88.6	79%	0.786	48%	0.477	S	S	*	.			trans	-88.4	91.6	-168	33.9	-31.8	0	0	0	111.2
125	V	34	Very low	49.6	Very low	139 Å²	139	82 Å²	82	84%	0.842	45%	0.454	S	S	*	.			trans	-151.4	104.6	163.4	-143	0	0	0	0	111.4	A123	A123-V125 PolarHBondContact O-N 2.96Å
126	G	41	Very low	48.7	Very low	54 Å²	54	82 Å²	82	56%	0.557	45%	0.454	S	S	*	.	S	Bend	trans	104.6	156.5	159.1	0	0	0	0	0	118.4	I128 F129	G126-I128 PolarHBondContact O-N 3.14Å; G126-F129 VanDerWaalsContact O-CB 3.22Å; G126-F129 WeakPolarHBondContact O-CB 3.2Å; G126-F129 PolarHBondContact O-N 3.36Å
127	F	39.1	Very low	47.8	Very low	213 Å²	213	82.8 Å²	82.8	93%	0.934	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-10.8	-174.2	-138.3	-99.7	0	0	0	115.1	F129	F127-F129 VanDerWaalsContact C-N 3.32Å
128	I	44	Very low	47.6	Very low	114 Å²	114	80 Å²	80	59%	0.585	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-17.6	175.5	-64.3	168.9	0	0	0	111.6	G126 C130 L131 L132	G126-I128 PolarHBondContact O-N 3.14Å; I128-C130 VanDerWaalsContact C-N 3.35Å; I128-C130 PolarHBondContact O-N 2.88Å; I128-L131 PolarHBondContact O-N 3.37Å; I128-L132 HydrophobicContact CG2-CD1 4.04Å
129	F	39.1	Very low	47.4	Very low	80 Å²	80	85.9 Å²	85.9	35%	0.351	48%	0.477	S	S	.	.	H	α-helix	trans	-66	-26.8	-174.6	-169.1	-99.8	0	0	0	114.7	A123 G126 F127 L131	A123-F129 WeakPolarHBondContact O-CE2 3.36Å; G126-F129 VanDerWaalsContact O-CB 3.22Å; G126-F129 WeakPolarHBondContact O-CB 3.2Å; G126-F129 PolarHBondContact O-N 3.36Å; F127-F129 VanDerWaalsContact C-N 3.32Å; F129-L131 PolarHBondContact O-N 2.65Å
130	C	40.7	Very low	47.5	Very low	111 Å²	111	85.9 Å²	85.9	75%	0.75	48%	0.477	S	S	*	.	H	α-helix	trans	-72.8	-14.5	179.7	-70.7	0	0	0	0	114	I128	I128-C130 VanDerWaalsContact C-N 3.35Å; I128-C130 PolarHBondContact O-N 2.88Å
131	L	40.7	Very low	48.4	Very low	56 Å²	56	84.3 Å²	84.3	29%	0.293	48%	0.477	S	S	.	.	H	α-helix	trans	-103.6	-23.6	-177.2	-75.2	160.1	0	0	0	113.4	C16 I128 F129	C16-L131 HydrophobicContact CB-CD1 4.42Å; I128-L131 PolarHBondContact O-N 3.37Å; F129-L131 PolarHBondContact O-N 2.65Å
132	L	43.2	Very low	49.6	Very low	47 Å²	47	84.6 Å²	84.6	25%	0.246	48%	0.482	C	S	.	.	H	α-helix	trans	-86.4	-15.8	175.7	-86.5	158.4	0	0	0	113.7	I128 E134 C135	I128-L132 HydrophobicContact CG2-CD1 4.04Å; L132-E134 PolarHBondContact O-N 3.24Å; L132-C135 PolarHBondContact O-N 3.35Å
133	H	42	Very low	51.7	Low	112 Å²	112	84.1 Å²	84.1	52%	0.519	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-5.4	177.7	-164.8	-86.2	0	0	0	113.6
134	E	47.5	Very low	54	Low	135 Å²	135	81.7 Å²	81.7	63%	0.631	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-15.5	-179.4	-73.2	-169.8	150.8	0	0	115.5	L132	L132-E134 PolarHBondContact O-N 3.24Å
135	C	51.1	Low	56.3	Low	11 Å²	11	76 Å²	76	7%	0.074	41%	0.412	C	S	.	.	S	Bend	trans	-74.9	-46.4	-171.7	-72.4	0	0	0	0	113.8	A62 L132	A62-C135 CarbonylContact C-O 3.56Å; A62-C135 WeakPolarHBondContact CB-O 3.34Å; A62-C135 VanDerWaalsContact O-O 3.13Å; L132-C135 PolarHBondContact O-N 3.35Å
136	L	55.1	Low	58.7	Low	2 Å²	2	70.3 Å²	70.3	1%	0.01	38%	0.377	C	S	.	.			trans	-143.5	-41.1	170.7	-71	170.6	0	0	0	111.7	A62 P66 L119 Y138 V140	A62-L136 HydrophobicContact CB-CD2 4.29Å; A62-L136 HydrophobicContact CB-CG 4.37Å; A62-L136 VanDerWaalsContact O-CD2 3.24Å; A62-L136 WeakPolarHBondContact O-CD2 3.46Å; P66-L136 HydrophobicContact CG-CD2 4.43Å; L119-L136 HydrophobicContact CB-CD1 4.34Å; L119-L136 HydrophobicContact CD1-CD1 4.5Å; L119-L136 HydrophobicContact CD2-CD1 3.91Å; L119-L136 HydrophobicContact CG-CD1 4.47Å; L136-Y138 VanDerWaalsContact C-N 3.28Å; L136-Y138 HydrophobicContact CB-CD1 4.44Å; L136-Y138 HydrophobicContact CB-CE1 3.99Å; L136-Y138 HydrophobicContact CD2-CE1 4.27Å; L136-Y138 WeakPolarHBondContact CD2-OH 3.25Å; L136-Y138 WeakPolarHBondContact O-CD1 3.34Å; L136-Y138 WeakPolarHBondContact O-CE1 3.48Å; L136-Y138 PolarHBondContact O-N 3.14Å; L136-V140 HydrophobicContact CB-CG2 4.1Å; L136-V140 HydrophobicContact CD1-CB 4.49Å; L136-V140 HydrophobicContact CD1-CG1 4.48Å; L136-V140 HydrophobicContact CD1-CG2 3.39Å; L136-V140 HydrophobicContact CG-CG2 4.26Å
137	G	57.1	Low	60.8	Low	47 Å²	47	67.9 Å²	67.9	49%	0.485	35%	0.351	S	S	.	.			trans	73.9	11.3	173.3	0	0	0	0	0	115.3
138	Y	66.3	Low	63.1	Low	48 Å²	48	58 Å²	58	19%	0.188	31%	0.308	C	S	.	.	S	Bend	trans	-145.8	168.6	174.7	57.2	-88.1	0	0	0	111.2	R65 P66 H67 L136 V140	R65-Y138 WeakPolarHBondContact CA-OH 3.15Å; R65-Y138 HydrophobicContact CB-CE1 3.95Å; R65-Y138 HydrophobicContact CG-CE1 4.31Å; R65-Y138 PolarHBondContact O-OH 3.41Å; P66-Y138 PolarHBondContact O-OH 3.1Å; H67-Y138 AromaticContact CE1-CD1 3.82Å; H67-Y138 AromaticContact CE1-CD2 3.89Å; H67-Y138 AromaticContact CE1-CE1 3.62Å; H67-Y138 AromaticContact CE1-CE2 3.67Å; H67-Y138 AromaticContact CE1-CG 3.98Å; H67-Y138 AromaticContact CE1-CZ 3.54Å; H67-Y138 AromaticContact ND1-CD2 3.71Å; H67-Y138 AromaticContact ND1-CE2 3.31Å; H67-Y138 VanDerWaalsContact ND1-CE2 3.31Å; H67-Y138 WeakPolarHBondContact ND1-CE2 3.43Å; H67-Y138 AromaticContact ND1-CZ 3.56Å; L136-Y138 VanDerWaalsContact C-N 3.28Å; L136-Y138 HydrophobicContact CB-CD1 4.44Å; L136-Y138 HydrophobicContact CB-CE1 3.99Å; L136-Y138 HydrophobicContact CD2-CE1 4.27Å; L136-Y138 WeakPolarHBondContact CD2-OH 3.25Å; L136-Y138 WeakPolarHBondContact O-CD1 3.34Å; L136-Y138 WeakPolarHBondContact O-CE1 3.48Å; L136-Y138 PolarHBondContact O-N 3.14Å; Y138-V140 HydrophobicContact CD2-CG2 4.06Å; Y138-V140 HydrophobicContact CE2-CG2 3.73Å; Y138-V140 PolarHBondContact O-N 3.46Å
139	K	65.3	Low	65.1	Low	169 Å²	169	52.6 Å²	52.6	74%	0.735	28%	0.28	S	S	*	.			trans	-72.2	115	175.9	-173.7	-177.5	176.9	-172.1	0	110
140	V	69.7	Low	67.3	Low	9 Å²	9	49.1 Å²	49.1	6%	0.055	27%	0.266	C	S	.	.			trans	-95.6	139.9	-179.9	-178.3	0	0	0	0	109.6	H116 L136 Y138 V144	H116-V140 PolarHBondContact CE1-O 2.97Å; L136-V140 HydrophobicContact CB-CG2 4.1Å; L136-V140 HydrophobicContact CD1-CB 4.49Å; L136-V140 HydrophobicContact CD1-CG1 4.48Å; L136-V140 HydrophobicContact CD1-CG2 3.39Å; L136-V140 HydrophobicContact CG-CG2 4.26Å; Y138-V140 HydrophobicContact CD2-CG2 4.06Å; Y138-V140 HydrophobicContact CE2-CG2 3.73Å; Y138-V140 PolarHBondContact O-N 3.46Å; V140-V144 HydrophobicContact CG1-CB 3.85Å; V140-V144 HydrophobicContact CG1-CG1 3.85Å
141	D	79	Confident	69.5	Low	86 Å²	86	44 Å²	44	46%	0.46	23%	0.232	S	C	.	.			trans	-67.6	146.9	176.6	-165	-79	0	0	0	111.5	Q143 V144 T145	D141-Q143 PolarHBondContact O-N 3.13Å; D141-Q143 VanDerWaalsContact OD1-CB 3.28Å; D141-Q143 WeakPolarHBondContact OD1-CB 3.12Å; D141-Q143 WeakPolarHBondContact OD1-CG 3.36Å; D141-Q143 PolarHBondContact OD1-N 3.08Å; D141-V144 HydrophobicContact CB-CG2 4.1Å; D141-V144 PolarHBondContact O-N 3.15Å; D141-T145 PolarHBondContact O-N 3.22Å; D141-T145 VanDerWaalsContact O-N 3.14Å; D141-T145 PolarHBondContact O-OG1 2.89Å
142	S	77.3	Confident	71.8	Confident	75 Å²	75	41.5 Å²	41.5	52%	0.524	22%	0.218	S	C	.	.	H	α-helix	trans	-63.5	-31.1	178.2	53.6	0	0	0	0	112.1	T145 L146	S142-T145 PolarHBondContact O-N 3.11Å; S142-L146 WeakPolarHBondContact O-CB 3.31Å; S142-L146 PolarHBondContact O-N 3.37Å
143	Q	82.5	Confident	73.8	Confident	82 Å²	82	41.2 Å²	41.2	38%	0.383	22%	0.216	S	C	.	.	H	α-helix	trans	-66.6	-39.1	175.3	-64.7	-170.5	-23	0	0	112.1	L96 H100 D141 T145 L146 F147	L96-Q143 HydrophobicContact CD1-CB 4.08Å; L96-Q143 HydrophobicContact CD1-CG 4.33Å; H100-Q143 PolarHBondContact NE2-NE2 3.33Å; D141-Q143 PolarHBondContact O-N 3.13Å; D141-Q143 VanDerWaalsContact OD1-CB 3.28Å; D141-Q143 WeakPolarHBondContact OD1-CB 3.12Å; D141-Q143 WeakPolarHBondContact OD1-CG 3.36Å; D141-Q143 PolarHBondContact OD1-N 3.08Å; Q143-T145 VanDerWaalsContact C-N 3.33Å; Q143-L146 PolarHBondContact O-N 2.85Å; Q143-F147 WeakPolarHBondContact O-CB 3.42Å; Q143-F147 PolarHBondContact O-N 3.33Å
144	V	84.4	Confident	75.9	Confident	4 Å²	4	38 Å²	38	2%	0.024	20%	0.199	C	C	.	.	H	α-helix	trans	-65	-41.2	174.8	178.4	0	0	0	0	110.3	T69 V72 V140 D141 F147 I148	T69-V144 HydrophobicContact CG2-CG2 4.22Å; V72-V144 HydrophobicContact CG2-CG1 4.12Å; V140-V144 HydrophobicContact CG1-CB 3.85Å; V140-V144 HydrophobicContact CG1-CG1 3.85Å; D141-V144 HydrophobicContact CB-CG2 4.1Å; D141-V144 PolarHBondContact O-N 3.15Å; V144-F147 PolarHBondContact O-N 3.42Å; V144-I148 HydrophobicContact CG1-CD1 4.04Å; V144-I148 WeakPolarHBondContact O-CG1 3.42Å; V144-I148 PolarHBondContact O-N 3.11Å
145	T	82.9	Confident	77.9	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.006	17%	0.169	C	C	.	.	H	α-helix	trans	-64.6	-41.6	177	-50.8	0	0	0	0	112	L112 V115 H116 L119 D141 S142 Q143 S149	L112-T145 HydrophobicContact CD1-CG2 3.96Å; V115-T145 HydrophobicContact CG1-CG2 4.12Å; H116-T145 HydrophobicContact CB-CG2 3.88Å; H116-T145 PolarHBondContact ND1-OG1 3.37Å; L119-T145 HydrophobicContact CD1-CG2 3.99Å; D141-T145 PolarHBondContact O-N 3.22Å; D141-T145 VanDerWaalsContact O-N 3.14Å; D141-T145 PolarHBondContact O-OG1 2.89Å; S142-T145 PolarHBondContact O-N 3.11Å; Q143-T145 VanDerWaalsContact C-N 3.33Å; T145-S149 WeakPolarHBondContact O-CB 3.39Å; T145-S149 PolarHBondContact O-N 3.48Å; T145-S149 PolarHBondContact O-OG 3.38Å
146	L	84.2	Confident	79.6	Confident	21 Å²	21	31 Å²	31	11%	0.11	17%	0.166	C	C	.	.	H	α-helix	trans	-60.5	-48	175.2	179.2	62.6	0	0	0	110.4	V95 L96 A108 L112 S142 Q143 I148 S149 S150	V95-L146 HydrophobicContact CG1-CD1 4.14Å; V95-L146 HydrophobicContact CG1-CD2 4.42Å; V95-L146 HydrophobicContact CG1-CG 4.33Å; L96-L146 HydrophobicContact CD1-CD2 4.36Å; A108-L146 HydrophobicContact CB-CD1 4.38Å; L112-L146 HydrophobicContact CD1-CB 4.2Å; L112-L146 HydrophobicContact CD1-CD1 4.24Å; L112-L146 HydrophobicContact CD2-CD1 4.27Å; S142-L146 WeakPolarHBondContact O-CB 3.31Å; S142-L146 PolarHBondContact O-N 3.37Å; Q143-L146 PolarHBondContact O-N 2.85Å; L146-I148 PolarHBondContact O-N 2.96Å; L146-S149 PolarHBondContact O-N 3.29Å; L146-S149 VanDerWaalsContact O-N 3.16Å; L146-S150 PolarHBondContact O-N 2.67Å; L146-S150 PolarHBondContact O-OG 2.94Å
147	F	86.7	Confident	80.9	Confident	2 Å²	2	31.7 Å²	31.7	1%	0.009	17%	0.171	C	C	.	.	H	α-helix	trans	-59.2	-47.6	179.3	-166	-89.8	0	0	0	112.2	T69 V72 E73 I76 A92 Q93 Q143 V144 S149 S150 V151	T69-F147 HydrophobicContact CG2-CB 4Å; T69-F147 HydrophobicContact CG2-CD2 4.35Å; T69-F147 HydrophobicContact CG2-CG 4.21Å; V72-F147 HydrophobicContact CB-CD1 3.92Å; V72-F147 HydrophobicContact CB-CE1 4.06Å; V72-F147 HydrophobicContact CG1-CD1 3.72Å; V72-F147 HydrophobicContact CG1-CE1 3.88Å; E73-F147 HydrophobicContact CB-CE1 4.47Å; E73-F147 HydrophobicContact CB-CZ 4.28Å; I76-F147 HydrophobicContact CD1-CE1 4.32Å; A92-F147 HydrophobicContact CB-CD1 4.36Å; A92-F147 HydrophobicContact CB-CD2 3.74Å; A92-F147 HydrophobicContact CB-CE1 4.19Å; A92-F147 HydrophobicContact CB-CE2 3.54Å; A92-F147 HydrophobicContact CB-CG 4.16Å; A92-F147 HydrophobicContact CB-CZ 3.78Å; Q93-F147 HydrophobicContact CG-CE2 3.99Å; Q143-F147 WeakPolarHBondContact O-CB 3.42Å; Q143-F147 PolarHBondContact O-N 3.33Å; V144-F147 PolarHBondContact O-N 3.42Å; F147-S149 VanDerWaalsContact C-N 3.34Å; F147-S149 PolarHBondContact O-N 3.43Å; F147-S150 PolarHBondContact O-N 2.89Å; F147-V151 HydrophobicContact CD1-CG2 4.3Å; F147-V151 HydrophobicContact CE1-CG2 4.16Å; F147-V151 WeakPolarHBondContact O-CG2 3.27Å; F147-V151 PolarHBondContact O-N 3Å
148	I	86.2	Confident	82	Confident	5 Å²	5	30 Å²	30	3%	0.026	15%	0.152	C	C	.	.	H	α-helix	trans	-59.1	-46.7	174.9	-66.7	168.5	0	0	0	110.5	L58 V61 P66 V72 V144 L146 S150 V151 L152	L58-I148 HydrophobicContact CD1-CG2 3.72Å; V61-I148 HydrophobicContact CG1-CD1 4.37Å; V61-I148 HydrophobicContact CG1-CG1 4.25Å; P66-I148 HydrophobicContact CG-CD1 4.43Å; V72-I148 HydrophobicContact CG1-CG1 4.06Å; V72-I148 HydrophobicContact CG2-CD1 4.27Å; V72-I148 HydrophobicContact CG2-CG1 4Å; V144-I148 HydrophobicContact CG1-CD1 4.04Å; V144-I148 WeakPolarHBondContact O-CG1 3.42Å; V144-I148 PolarHBondContact O-N 3.11Å; L146-I148 PolarHBondContact O-N 2.96Å; I148-S150 VanDerWaalsContact C-N 3.34Å; I148-S150 PolarHBondContact O-N 2.84Å; I148-V151 PolarHBondContact O-N 3.32Å; I148-L152 HydrophobicContact CG2-CD1 4.07Å; I148-L152 HydrophobicContact CG2-CG 4.45Å; I148-L152 WeakPolarHBondContact O-CG 3.32Å; I148-L152 PolarHBondContact O-N 3.47Å
149	S	85.5	Confident	82.8	Confident	1 Å²	1	27.9 Å²	27.9	1%	0.007	14%	0.143	C	C	.	.	H	α-helix	trans	-63	-40.1	-179.2	-56	0	0	0	0	112	T145 L146 F147 L152 E153	T145-S149 WeakPolarHBondContact O-CB 3.39Å; T145-S149 PolarHBondContact O-N 3.48Å; T145-S149 PolarHBondContact O-OG 3.38Å; L146-S149 PolarHBondContact O-N 3.29Å; L146-S149 VanDerWaalsContact O-N 3.16Å; F147-S149 VanDerWaalsContact C-N 3.34Å; F147-S149 PolarHBondContact O-N 3.43Å; S149-L152 PolarHBondContact O-N 3.27Å; S149-E153 WeakPolarHBondContact O-CB 3.5Å; S149-E153 PolarHBondContact O-N 3.48Å
150	S	85.3	Confident	83.4	Confident	8 Å²	8	19.9 Å²	19.9	6%	0.056	11%	0.108	C	C	.	.	H	α-helix	trans	-65.1	-38.3	176.7	-60.3	0	0	0	0	112.7	V95 L146 F147 I148 Y154	V95-S150 WeakPolarHBondContact CG1-OG 3.39Å; L146-S150 PolarHBondContact O-N 2.67Å; L146-S150 PolarHBondContact O-OG 2.94Å; F147-S150 PolarHBondContact O-N 2.89Å; I148-S150 VanDerWaalsContact C-N 3.34Å; I148-S150 PolarHBondContact O-N 2.84Å; S150-Y154 WeakPolarHBondContact O-CB 3.46Å; S150-Y154 PolarHBondContact O-N 3.35Å
151	V	87.6	Confident	83.6	Confident	4 Å²	4	22.7 Å²	22.7	2%	0.024	12%	0.12	C	C	.	.	H	α-helix	trans	-63.3	-46.4	173.5	171.2	0	0	0	0	110.5	I76 F80 A88 A92 F147 I148 Y154 I155	I76-V151 HydrophobicContact CD1-CB 4.16Å; I76-V151 HydrophobicContact CD1-CG1 3.7Å; I76-V151 HydrophobicContact CD1-CG2 3.51Å; I76-V151 HydrophobicContact CG1-CG1 4.47Å; F80-V151 HydrophobicContact CE2-CG1 3.95Å; F80-V151 HydrophobicContact CZ-CG1 4.36Å; A88-V151 HydrophobicContact CB-CG1 4.38Å; A92-V151 HydrophobicContact CB-CG2 3.68Å; F147-V151 HydrophobicContact CD1-CG2 4.3Å; F147-V151 HydrophobicContact CE1-CG2 4.16Å; F147-V151 WeakPolarHBondContact O-CG2 3.27Å; F147-V151 PolarHBondContact O-N 3Å; I148-V151 PolarHBondContact O-N 3.32Å; V151-Y154 PolarHBondContact O-N 3.38Å; V151-I155 HydrophobicContact CG1-CG1 4.47Å; V151-I155 VanDerWaalsContact O-CG1 3.23Å; V151-I155 WeakPolarHBondContact O-CG1 3.24Å; V151-I155 PolarHBondContact O-N 2.76Å
152	L	88.8	Confident	82.7	Confident	2 Å²	2	18.8 Å²	18.8	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-64.8	-40	179.2	-64.9	175.8	0	0	0	112.2	I54 L57 L58 F110 I148 S149 I155 A156	I54-L152 HydrophobicContact CG2-CB 4.21Å; I54-L152 HydrophobicContact CG2-CD1 4.38Å; I54-L152 HydrophobicContact CG2-CD2 4.34Å; L57-L152 HydrophobicContact CB-CD2 3.99Å; L57-L152 HydrophobicContact CD2-CD2 3.8Å; L57-L152 HydrophobicContact CG-CD2 3.89Å; L58-L152 HydrophobicContact CB-CD1 3.81Å; L58-L152 HydrophobicContact CB-CD2 4.46Å; L58-L152 HydrophobicContact CD1-CD1 3.72Å; L58-L152 HydrophobicContact CG-CD1 4.22Å; F110-L152 HydrophobicContact CD2-CB 4.32Å; F110-L152 HydrophobicContact CE2-CB 3.87Å; I148-L152 HydrophobicContact CG2-CD1 4.07Å; I148-L152 HydrophobicContact CG2-CG 4.45Å; I148-L152 WeakPolarHBondContact O-CG 3.32Å; I148-L152 PolarHBondContact O-N 3.47Å; S149-L152 PolarHBondContact O-N 3.27Å; L152-I155 PolarHBondContact O-N 2.67Å; L152-A156 WeakPolarHBondContact O-CB 3.2Å; L152-A156 PolarHBondContact O-N 2.87Å
153	E	86.4	Confident	81.7	Confident	42 Å²	42	15.5 Å²	15.5	20%	0.196	8%	0.077	C	C	.	.	H	α-helix	trans	-61.8	-43.9	175.5	-172.5	178.1	137.3	0	0	111.1	V32 I109 F110 S149 A156 A157	V32-E153 HydrophobicContact CG2-CG 4.26Å; I109-E153 WeakPolarHBondContact CD1-OE1 3.42Å; I109-E153 PolarHBondContact N-OE2 2.9Å; F110-E153 HydrophobicContact CD1-CB 4.12Å; F110-E153 HydrophobicContact CD1-CG 4.08Å; F110-E153 HydrophobicContact CE1-CB 4.24Å; F110-E153 HydrophobicContact CE1-CG 4.23Å; F110-E153 HydrophobicContact CG-CB 4.33Å; S149-E153 WeakPolarHBondContact O-CB 3.5Å; S149-E153 PolarHBondContact O-N 3.48Å; E153-A156 PolarHBondContact O-N 2.89Å; E153-A157 WeakPolarHBondContact O-CB 3.35Å; E153-A157 PolarHBondContact O-N 2.93Å
154	Y	86.2	Confident	80.3	Confident	43 Å²	43	13.4 Å²	13.4	17%	0.169	7%	0.068	C	C	.	.	H	α-helix	trans	-61	-46.7	175.1	178.6	-98.3	0	0	0	112	L84 W87 A88 E91 S150 V151 A156 A157 D158	L84-Y154 HydrophobicContact CD1-CE1 3.79Å; W87-Y154 HydrophobicContact CB-CE1 4.03Å; W87-Y154 HydrophobicContact CB-CE2 4.42Å; W87-Y154 WeakPolarHBondContact CB-OH 3.42Å; A88-Y154 HydrophobicContact CB-CD1 3.76Å; A88-Y154 HydrophobicContact CB-CE1 4.15Å; E91-Y154 HydrophobicContact CB-CD2 4.02Å; E91-Y154 HydrophobicContact CB-CG 4.44Å; E91-Y154 HydrophobicContact CG-CD2 3.64Å; E91-Y154 HydrophobicContact CG-CE2 3.86Å; E91-Y154 HydrophobicContact CG-CG 4.5Å; S150-Y154 WeakPolarHBondContact O-CB 3.46Å; S150-Y154 PolarHBondContact O-N 3.35Å; V151-Y154 PolarHBondContact O-N 3.38Å; Y154-A156 PolarHBondContact O-N 2.87Å; Y154-A157 PolarHBondContact O-N 3.45Å; Y154-D158 VanDerWaalsContact O-CB 3.29Å; Y154-D158 WeakPolarHBondContact O-CB 3.3Å; Y154-D158 PolarHBondContact O-N 2.95Å
155	I	87.8	Confident	78.9	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-65.2	-39.9	179.5	-62.6	-74	0	0	0	111	I54 L57 F80 L84 V151 L152 D158 I159 L200 F201	I54-I155 HydrophobicContact CD1-CB 4.48Å; I54-I155 HydrophobicContact CD1-CG2 4.23Å; L57-I155 HydrophobicContact CD2-CB 4.2Å; L57-I155 HydrophobicContact CD2-CG1 4.04Å; L57-I155 HydrophobicContact CD2-CG2 3.89Å; F80-I155 HydrophobicContact CD2-CD1 4.15Å; F80-I155 HydrophobicContact CE2-CD1 3.9Å; F80-I155 HydrophobicContact CE2-CG1 4.13Å; L84-I155 HydrophobicContact CD1-CD1 3.74Å; L84-I155 HydrophobicContact CD2-CD1 3.7Å; L84-I155 HydrophobicContact CG-CD1 3.81Å; V151-I155 HydrophobicContact CG1-CG1 4.47Å; V151-I155 VanDerWaalsContact O-CG1 3.23Å; V151-I155 WeakPolarHBondContact O-CG1 3.24Å; V151-I155 PolarHBondContact O-N 2.76Å; L152-I155 PolarHBondContact O-N 2.67Å; I155-D158 PolarHBondContact O-N 3.44Å; I155-I159 HydrophobicContact CG2-CD1 4.04Å; I155-I159 HydrophobicContact CG2-CG1 4.47Å; I155-I159 VanDerWaalsContact O-CG1 3.3Å; I155-I159 WeakPolarHBondContact O-CG1 3.42Å; I155-I159 PolarHBondContact O-N 3.35Å; I155-L200 HydrophobicContact CD1-CD2 4.39Å; I155-F201 HydrophobicContact CG2-CE2 4.25Å; I155-F201 HydrophobicContact CG2-CZ 3.85Å
156	A	86.6	Confident	77.5	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-61.4	-48.2	174.5	0	0	0	0	0	111.5	L29 I54 F110 L152 E153 Y154 D158 I159 L160	L29-A156 HydrophobicContact CD2-CB 3.56Å; I54-A156 HydrophobicContact CD1-CB 3.86Å; I54-A156 HydrophobicContact CG1-CB 4.2Å; F110-A156 HydrophobicContact CE1-CB 4.47Å; F110-A156 HydrophobicContact CZ-CB 3.94Å; L152-A156 WeakPolarHBondContact O-CB 3.2Å; L152-A156 PolarHBondContact O-N 2.87Å; E153-A156 PolarHBondContact O-N 2.89Å; Y154-A156 PolarHBondContact O-N 2.87Å; A156-D158 PolarHBondContact O-N 3.04Å; A156-I159 PolarHBondContact O-N 2.95Å; A156-L160 WeakPolarHBondContact O-CB 3.44Å; A156-L160 VanDerWaalsContact O-CG 3.3Å; A156-L160 WeakPolarHBondContact O-CG 3.36Å; A156-L160 PolarHBondContact O-N 3.15Å
157	A	82.5	Confident	75.6	Confident	16 Å²	16	14.8 Å²	14.8	13%	0.132	8%	0.076	C	C	.	.	H	α-helix	trans	-60.1	-37.4	175.8	0	0	0	0	0	111.4	V32 V36 E153 Y154 L160 K161	V32-A157 HydrophobicContact CG1-CB 3.74Å; V36-A157 HydrophobicContact CG2-CB 4.02Å; E153-A157 WeakPolarHBondContact O-CB 3.35Å; E153-A157 PolarHBondContact O-N 2.93Å; Y154-A157 PolarHBondContact O-N 3.45Å; A157-L160 PolarHBondContact O-N 2.89Å; A157-K161 VanDerWaalsContact O-CB 3.25Å; A157-K161 WeakPolarHBondContact O-CB 3.47Å; A157-K161 WeakPolarHBondContact O-CG 3.37Å; A157-K161 PolarHBondContact O-N 3.12Å
158	D	82.1	Confident	73.6	Confident	13 Å²	13	16.8 Å²	16.8	7%	0.07	9%	0.085	C	C	.	.	H	α-helix	trans	-70.7	-41.8	179.8	-171.6	67.2	0	0	0	113.4	Y154 I155 A156 L160 K161 S162 R646	Y154-D158 VanDerWaalsContact O-CB 3.29Å; Y154-D158 WeakPolarHBondContact O-CB 3.3Å; Y154-D158 PolarHBondContact O-N 2.95Å; I155-D158 PolarHBondContact O-N 3.44Å; A156-D158 PolarHBondContact O-N 3.04Å; D158-L160 VanDerWaalsContact C-N 3.31Å; D158-L160 PolarHBondContact O-N 2.95Å; D158-K161 PolarHBondContact O-N 3.37Å; D158-S162 WeakPolarHBondContact O-CB 3.28Å; D158-S162 PolarHBondContact O-N 3.18Å; D158-R646 IonicContact OD1-CZ 2.82Å; D158-R646 IonicContact OD1-NH1 3.79Å; D158-R646 PolarHBondContact OD1-NH1 2.96Å; D158-R646 IonicContact OD1-NH2 3.26Å; D158-R646 IonicContact OD2-CZ 3.25Å; D158-R646 IonicContact OD2-NH1 2.67Å; D158-R646 PolarHBondContact OD2-NH1 2.73Å; D158-R646 IonicContact OD2-NH2 3.79Å; D158-R646 PolarHBondContact OD2-NH2 3.02Å
159	I	82.5	Confident	71.5	Confident	2 Å²	2	17.1 Å²	17.1	1%	0.01	9%	0.087	C	C	.	.	H	α-helix	trans	-59	-46.4	171.8	-66.4	163.8	0	0	0	109.8	V50 L53 I155 A156 S162 S163 L187 L197 F201	V50-I159 HydrophobicContact CG2-CG2 4.34Å; L53-I159 HydrophobicContact CD1-CD1 4.34Å; I155-I159 HydrophobicContact CG2-CD1 4.04Å; I155-I159 HydrophobicContact CG2-CG1 4.47Å; I155-I159 VanDerWaalsContact O-CG1 3.3Å; I155-I159 WeakPolarHBondContact O-CG1 3.42Å; I155-I159 PolarHBondContact O-N 3.35Å; A156-I159 PolarHBondContact O-N 2.95Å; I159-S162 PolarHBondContact O-N 3.48Å; I159-S163 PolarHBondContact O-N 3.03Å; I159-L187 HydrophobicContact CG2-CD1 4.02Å; I159-L187 HydrophobicContact CG2-CG 4.37Å; I159-L197 HydrophobicContact CG1-CD1 4.35Å; I159-L197 HydrophobicContact CG1-CD2 4.2Å; I159-F201 HydrophobicContact CD1-CE2 3.65Å; I159-F201 HydrophobicContact CD1-CZ 3.74Å; I159-F201 HydrophobicContact CG1-CE2 4.12Å
160	L	77.8	Confident	69.3	Low	1 Å²	1	18 Å²	18	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-68.9	-38.3	-180	-66.8	167.8	0	0	0	111.6	V32 T33 V36 H37 I42 V50 A156 A157 D158 S163 L187	V32-L160 HydrophobicContact CB-CD1 4.31Å; V32-L160 HydrophobicContact CG1-CD1 3.82Å; T33-L160 WeakPolarHBondContact OG1-CD1 3.35Å; V36-L160 HydrophobicContact CG1-CB 4.49Å; H37-L160 PolarHBondContact NE2-O 3.48Å; I42-L160 HydrophobicContact CD1-CD2 3.83Å; V50-L160 HydrophobicContact CG2-CD2 4.43Å; A156-L160 WeakPolarHBondContact O-CB 3.44Å; A156-L160 VanDerWaalsContact O-CG 3.3Å; A156-L160 WeakPolarHBondContact O-CG 3.36Å; A156-L160 PolarHBondContact O-N 3.15Å; A157-L160 PolarHBondContact O-N 2.89Å; D158-L160 VanDerWaalsContact C-N 3.31Å; D158-L160 PolarHBondContact O-N 2.95Å; L160-S163 WeakPolarHBondContact O-CB 3.32Å; L160-S163 PolarHBondContact O-N 3.06Å; L160-S163 PolarHBondContact O-OG 3.15Å; L160-L187 HydrophobicContact CD2-CD1 4.4Å
161	K	73.2	Confident	66.9	Low	69 Å²	69	18 Å²	18	30%	0.3	9%	0.094	S	C	.	.	H	α-helix	trans	-63.4	-45.7	172.6	-80.4	176.6	-174.6	-169.6	0	111.7	V36 A157 D158 S163 N164 N165	V36-K161 HydrophobicContact CB-CG 4.4Å; V36-K161 HydrophobicContact CG1-CB 4.21Å; V36-K161 HydrophobicContact CG1-CD 4.5Å; V36-K161 HydrophobicContact CG1-CG 3.34Å; V36-K161 HydrophobicContact CG2-CG 4.12Å; A157-K161 VanDerWaalsContact O-CB 3.25Å; A157-K161 WeakPolarHBondContact O-CB 3.47Å; A157-K161 WeakPolarHBondContact O-CG 3.37Å; A157-K161 PolarHBondContact O-N 3.12Å; D158-K161 PolarHBondContact O-N 3.37Å; K161-S163 PolarHBondContact O-N 3.02Å; K161-N164 PolarHBondContact O-N 2.7Å; K161-N164 VanDerWaalsContact O-N 3.1Å; K161-N165 PolarHBondContact O-N 3.18Å
162	S	61.3	Low	64.4	Low	4 Å²	4	20.1 Å²	20.1	3%	0.028	11%	0.105	C	C	.	.	H	α-helix	trans	-57.3	-39	177	-172.1	0	0	0	0	110.7	D158 I159 N164 N165 Y166	D158-S162 WeakPolarHBondContact O-CB 3.28Å; D158-S162 PolarHBondContact O-N 3.18Å; I159-S162 PolarHBondContact O-N 3.48Å; S162-N164 VanDerWaalsContact C-N 3.33Å; S162-N164 PolarHBondContact O-N 2.9Å; S162-N165 PolarHBondContact O-N 3.35Å; S162-Y166 VanDerWaalsContact O-CD2 3.31Å; S162-Y166 WeakPolarHBondContact O-CD2 3.32Å; S162-Y166 PolarHBondContact O-N 2.76Å; S162-Y166 VanDerWaalsContact OG-CD2 3.31Å; S162-Y166 WeakPolarHBondContact OG-CD2 3.19Å; S162-Y166 WeakPolarHBondContact OG-CE2 3.15Å
163	S	56	Low	62.3	Low	6 Å²	6	21.3 Å²	21.3	4%	0.042	11%	0.109	C	C	.	.	H	α-helix	trans	-55.7	-41.7	174.9	84	0	0	0	0	113.7	I159 L160 K161 A167	I159-S163 PolarHBondContact O-N 3.03Å; L160-S163 WeakPolarHBondContact O-CB 3.32Å; L160-S163 PolarHBondContact O-N 3.06Å; L160-S163 PolarHBondContact O-OG 3.15Å; K161-S163 PolarHBondContact O-N 3.02Å; S163-A167 WeakPolarHBondContact O-CA 3.49Å; S163-A167 WeakPolarHBondContact O-CB 3.33Å; S163-A167 PolarHBondContact O-N 3.36Å
164	N	53.8	Low	60	Low	37 Å²	37	21 Å²	21	20%	0.198	11%	0.111	C	C	.	.	H	α-helix	trans	-79.2	-38.7	178.1	-172.8	11.3	0	0	0	112.5	H37 K161 S162 Y166 A167 Q168	H37-N164 WeakPolarHBondContact CE1-CB 3.47Å; H37-N164 VanDerWaalsContact CE1-CG 3.48Å; H37-N164 PolarHBondContact CE1-ND2 2.87Å; H37-N164 PolarHBondContact ND1-ND2 2.84Å; H37-N164 WeakPolarHBondContact NE2-CB 3.3Å; K161-N164 PolarHBondContact O-N 2.7Å; K161-N164 VanDerWaalsContact O-N 3.1Å; S162-N164 VanDerWaalsContact C-N 3.33Å; S162-N164 PolarHBondContact O-N 2.9Å; N164-Y166 VanDerWaalsContact C-N 3.33Å; N164-Y166 PolarHBondContact O-N 3.1Å; N164-A167 PolarHBondContact O-N 2.88Å; N164-Q168 PolarHBondContact ND2-NE2 3.31Å; N164-Q168 VanDerWaalsContact O-CB 3.31Å; N164-Q168 WeakPolarHBondContact O-CB 3.49Å; N164-Q168 WeakPolarHBondContact O-CG 3.13Å; N164-Q168 PolarHBondContact O-N 3.22Å; N164-Q168 WeakPolarHBondContact OD1-CG 3.24Å; N164-Q168 PolarHBondContact OD1-NE2 3.07Å
165	N	54	Low	57.6	Low	34 Å²	34	23.1 Å²	23.1	18%	0.182	12%	0.121	C	C	.	.	H	α-helix	trans	-59.3	-46.4	175.1	-67.8	-25.7	0	0	0	110.6	K161 S162 L169 R243	K161-N165 PolarHBondContact O-N 3.18Å; S162-N165 PolarHBondContact O-N 3.35Å; N165-L169 WeakPolarHBondContact O-CB 3.19Å; N165-L169 WeakPolarHBondContact O-CD1 3.39Å; N165-L169 WeakPolarHBondContact O-CG 3.31Å; N165-L169 PolarHBondContact O-N 3.03Å; N165-R243 PolarHBondContact ND2-NH2 3.28Å; N165-R243 VanDerWaalsContact OD1-CZ 3.25Å; N165-R243 PolarHBondContact OD1-NH1 3.04Å; N165-R243 PolarHBondContact OD1-NH2 2.98Å
166	Y	52.6	Low	55.2	Low	13 Å²	13	24.7 Å²	24.7	5%	0.051	13%	0.129	C	C	.	.	H	α-helix	trans	-75.9	-29.3	175.8	-74.7	-74.8	0	0	0	113.3	S162 N164 L169 T170 A190 A193 D194	S162-Y166 VanDerWaalsContact O-CD2 3.31Å; S162-Y166 WeakPolarHBondContact O-CD2 3.32Å; S162-Y166 PolarHBondContact O-N 2.76Å; S162-Y166 VanDerWaalsContact OG-CD2 3.31Å; S162-Y166 WeakPolarHBondContact OG-CD2 3.19Å; S162-Y166 WeakPolarHBondContact OG-CE2 3.15Å; N164-Y166 VanDerWaalsContact C-N 3.33Å; N164-Y166 PolarHBondContact O-N 3.1Å; Y166-L169 HydrophobicContact CD1-CD1 4.48Å; Y166-L169 PolarHBondContact O-N 2.92Å; Y166-T170 WeakPolarHBondContact O-CB 3.45Å; Y166-T170 PolarHBondContact O-N 3.06Å; Y166-T170 PolarHBondContact O-OG1 3.44Å; Y166-A190 HydrophobicContact CD2-CB 4.25Å; Y166-A190 HydrophobicContact CG-CB 4.35Å; Y166-A193 HydrophobicContact CD1-CB 3.31Å; Y166-A193 HydrophobicContact CD2-CB 4.44Å; Y166-A193 HydrophobicContact CE1-CB 3.23Å; Y166-A193 HydrophobicContact CE2-CB 4.39Å; Y166-A193 HydrophobicContact CG-CB 3.96Å; Y166-A193 PolarHBondContact OH-O 2.87Å; Y166-A193 VanDerWaalsContact OH-O 3.08Å; Y166-D194 HydrophobicContact CE2-CB 3.78Å
167	A	46	Very low	53	Low	9 Å²	9	26.8 Å²	26.8	7%	0.074	14%	0.14	C	C	.	.	H	α-helix	trans	-65.6	-40	173	0	0	0	0	0	112.1	S163 N164 Y173 V174 I177	S163-A167 WeakPolarHBondContact O-CA 3.49Å; S163-A167 WeakPolarHBondContact O-CB 3.33Å; S163-A167 PolarHBondContact O-N 3.36Å; N164-A167 PolarHBondContact O-N 2.88Å; A167-Y173 HydrophobicContact CB-CG 4.49Å; A167-V174 WeakPolarHBondContact O-CG2 3.21Å; A167-I177 HydrophobicContact CB-CD1 4.16Å
168	Q	44.1	Very low	51.1	Low	43 Å²	43	31.3 Å²	31.3	20%	0.201	15%	0.154	C	C	.	.	H	α-helix	trans	-62	-50.9	168.1	-70.1	172.1	14.4	0	0	109.6	N164 T170 H236	N164-Q168 PolarHBondContact ND2-NE2 3.31Å; N164-Q168 VanDerWaalsContact O-CB 3.31Å; N164-Q168 WeakPolarHBondContact O-CB 3.49Å; N164-Q168 WeakPolarHBondContact O-CG 3.13Å; N164-Q168 PolarHBondContact O-N 3.22Å; N164-Q168 WeakPolarHBondContact OD1-CG 3.24Å; N164-Q168 PolarHBondContact OD1-NE2 3.07Å; Q168-T170 PolarHBondContact O-N 2.85Å; Q168-H236 PolarHBondContact O-CE1 2.97Å; Q168-H236 PolarHBondContact O-NE2 2.92Å; Q168-H236 VanDerWaalsContact O-NE2 3.12Å
169	L	40.7	Very low	49.6	Very low	12 Å²	12	38 Å²	38	6%	0.063	18%	0.178	C	C	.	.	H	α-helix	trans	-70.1	-24.2	-172.7	-71.1	154.4	0	0	0	115.6	N165 Y166 R641	N165-L169 WeakPolarHBondContact O-CB 3.19Å; N165-L169 WeakPolarHBondContact O-CD1 3.39Å; N165-L169 WeakPolarHBondContact O-CG 3.31Å; N165-L169 PolarHBondContact O-N 3.03Å; Y166-L169 HydrophobicContact CD1-CD1 4.48Å; Y166-L169 PolarHBondContact O-N 2.92Å; L169-R641 VanDerWaalsContact CD2-NH2 3.33Å; L169-R641 VanDerWaalsContact CG-NH2 3.34Å
170	T	40.5	Very low	48.5	Very low	19 Å²	19	41.4 Å²	41.4	12%	0.117	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102	2.4	-175.1	54.4	0	0	0	0	114.4	Y166 Q168 N172 Y173 N453	Y166-T170 WeakPolarHBondContact O-CB 3.45Å; Y166-T170 PolarHBondContact O-N 3.06Å; Y166-T170 PolarHBondContact O-OG1 3.44Å; Q168-T170 PolarHBondContact O-N 2.85Å; T170-N172 PolarHBondContact O-N 3.35Å; T170-Y173 WeakPolarHBondContact OG1-CD2 3.48Å; T170-Y173 WeakPolarHBondContact OG1-CE2 3.37Å; T170-N453 PolarHBondContact O-ND2 2.92Å
171	G	35.6	Very low	48	Very low	10 Å²	10	43.3 Å²	43.3	10%	0.103	21%	0.205	C	C	.	.	S	Bend	trans	62.1	-24.7	167.6	0	0	0	0	0	117.7	P449	G171-P449 WeakPolarHBondContact CA-O 3.38Å
172	N	34.8	Very low	47.9	Very low	48 Å²	48	40.6 Å²	40.6	26%	0.257	19%	0.194	S	C	.	.	S	Bend	trans	-87.9	-28.6	178.2	-87	-22.3	0	0	0	112.2	T170 V174 K175 N453	T170-N172 PolarHBondContact O-N 3.35Å; N172-V174 VanDerWaalsContact C-N 3.28Å; N172-K175 WeakPolarHBondContact O-CB 3.22Å; N172-K175 PolarHBondContact O-N 3.31Å; N172-N453 PolarHBondContact ND2-ND2 3.3Å
173	Y	43.7	Very low	48.6	Very low	26 Å²	26	41 Å²	41	10%	0.102	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-19.1	172.3	-57.9	-55.4	0	0	0	112.2	A167 T170 K175 N176 I177 D186 V189	A167-Y173 HydrophobicContact CB-CG 4.49Å; T170-Y173 WeakPolarHBondContact OG1-CD2 3.48Å; T170-Y173 WeakPolarHBondContact OG1-CE2 3.37Å; Y173-K175 PolarHBondContact O-N 3.45Å; Y173-N176 CarbonylContact O-C 3.58Å; Y173-N176 VanDerWaalsContact O-CA 3.27Å; Y173-N176 WeakPolarHBondContact O-CA 3.39Å; Y173-N176 WeakPolarHBondContact O-CB 3.49Å; Y173-N176 PolarHBondContact O-N 3.01Å; Y173-I177 WeakPolarHBondContact O-CG1 3.32Å; Y173-I177 PolarHBondContact O-N 2.85Å; Y173-D186 HydrophobicContact CD1-CB 3.93Å; Y173-D186 WeakPolarHBondContact CD1-OD1 3.36Å; Y173-D186 HydrophobicContact CE1-CB 4.34Å; Y173-D186 WeakPolarHBondContact CE1-OD1 3.38Å; Y173-D186 HydrophobicContact CG-CB 4.27Å; Y173-V189 HydrophobicContact CE2-CB 3.85Å; Y173-V189 HydrophobicContact CE2-CG1 3.55Å; Y173-V189 VanDerWaalsContact OH-CB 3.23Å; Y173-V189 WeakPolarHBondContact OH-CB 3.38Å; Y173-V189 VanDerWaalsContact OH-CG1 3.3Å; Y173-V189 WeakPolarHBondContact OH-CG1 3.35Å; Y173-V189 WeakPolarHBondContact OH-CG2 3.36Å
174	V	38.5	Very low	49.7	Very low	37 Å²	37	42.3 Å²	42.3	22%	0.224	20%	0.202	C	C	.	.	H	α-helix	trans	-59.9	-25.6	165.7	-170.5	0	0	0	0	112.3	A167 N172 N176 I177 R178	A167-V174 WeakPolarHBondContact O-CG2 3.21Å; N172-V174 VanDerWaalsContact C-N 3.28Å; V174-N176 VanDerWaalsContact C-N 3.33Å; V174-I177 HydrophobicContact CB-CD1 4.34Å; V174-I177 HydrophobicContact CG1-CD1 4.45Å; V174-I177 HydrophobicContact CG2-CD1 4.14Å; V174-I177 WeakPolarHBondContact O-CB 3.34Å; V174-I177 PolarHBondContact O-N 3.03Å; V174-R178 PolarHBondContact O-N 3Å
175	K	36.6	Very low	50.6	Low	86 Å²	86	45.3 Å²	45.3	37%	0.374	22%	0.215	S	C	.	.	H	α-helix	trans	-74.5	-22.9	170.1	-68.9	172	-178.6	154.4	0	112.8	N172 Y173	N172-K175 WeakPolarHBondContact O-CB 3.22Å; N172-K175 PolarHBondContact O-N 3.31Å; Y173-K175 PolarHBondContact O-N 3.45Å
176	N	35.6	Very low	51.3	Low	34 Å²	34	44.1 Å²	44.1	18%	0.182	21%	0.209	C	C	.	.	H	α-helix	trans	-86	-23.2	166.8	-77.5	-13.1	0	0	0	112.5	Y173 V174 R178 R179 D186	Y173-N176 CarbonylContact O-C 3.58Å; Y173-N176 VanDerWaalsContact O-CA 3.27Å; Y173-N176 WeakPolarHBondContact O-CA 3.39Å; Y173-N176 WeakPolarHBondContact O-CB 3.49Å; Y173-N176 PolarHBondContact O-N 3.01Å; V174-N176 VanDerWaalsContact C-N 3.33Å; N176-R178 PolarHBondContact O-N 3.11Å; N176-R179 WeakPolarHBondContact O-CA 3.4Å; N176-R179 VanDerWaalsContact O-CB 3.25Å; N176-R179 WeakPolarHBondContact O-CB 3.47Å; N176-R179 PolarHBondContact O-N 2.85Å; N176-D186 PolarHBondContact ND2-OD1 2.88Å; N176-D186 PolarHBondContact ND2-OD2 3.01Å
177	I	41.4	Very low	52.4	Low	44 Å²	44	43.6 Å²	43.6	23%	0.226	21%	0.207	C	C	.	.	H	α-helix	trans	-59.5	-29.5	168.1	-67	179.3	0	0	0	110	F40 A167 Y173 V174 R179 N180	F40-I177 HydrophobicContact CE1-CB 4.19Å; F40-I177 HydrophobicContact CE1-CG1 4.36Å; F40-I177 HydrophobicContact CE1-CG2 3.6Å; F40-I177 HydrophobicContact CZ-CG2 3.65Å; A167-I177 HydrophobicContact CB-CD1 4.16Å; Y173-I177 WeakPolarHBondContact O-CG1 3.32Å; Y173-I177 PolarHBondContact O-N 2.85Å; V174-I177 HydrophobicContact CB-CD1 4.34Å; V174-I177 HydrophobicContact CG1-CD1 4.45Å; V174-I177 HydrophobicContact CG2-CD1 4.14Å; V174-I177 WeakPolarHBondContact O-CB 3.34Å; V174-I177 PolarHBondContact O-N 3.03Å; I177-R179 PolarHBondContact O-N 3.38Å; I177-N180 PolarHBondContact O-N 3.47Å
178	R	43.1	Very low	53.8	Low	111 Å²	111	45.4 Å²	45.4	42%	0.419	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-17.8	168.1	-65.2	-162.9	-165.3	-174.4	13.1	114.6	V174 N176 N180 E228 Q229 K232	V174-R178 PolarHBondContact O-N 3Å; N176-R178 PolarHBondContact O-N 3.11Å; R178-N180 VanDerWaalsContact C-N 3.26Å; R178-E228 IonicContact CZ-OE1 3.2Å; R178-E228 IonicContact NH1-OE1 2.68Å; R178-E228 PolarHBondContact NH1-OE1 3.26Å; R178-E228 IonicContact NH2-OE1 3.12Å; R178-Q229 VanDerWaalsContact NH2-OE1 3.16Å; R178-K232 VanDerWaalsContact CZ-NZ 3.32Å
179	R	50.7	Low	55	Low	153 Å²	153	43.5 Å²	43.5	58%	0.577	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84	1.5	173.9	-69.2	-176.8	167.2	160.3	-4.4	112.9	N176 I177 E181	N176-R179 WeakPolarHBondContact O-CA 3.4Å; N176-R179 VanDerWaalsContact O-CB 3.25Å; N176-R179 WeakPolarHBondContact O-CB 3.47Å; N176-R179 PolarHBondContact O-N 2.85Å; I177-R179 PolarHBondContact O-N 3.38Å; R179-E181 HydrophobicContact CB-CB 4.4Å; R179-E181 WeakPolarHBondContact O-CB 3.13Å; R179-E181 PolarHBondContact O-N 2.63Å
180	N	59.3	Low	56.3	Low	74 Å²	74	43.1 Å²	43.1	40%	0.396	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.8	33.9	-172.3	-68.1	1.5	0	0	0	111.4	G41 I177 R178	G41-N180 WeakPolarHBondContact CA-O 3.48Å; G41-N180 PolarHBondContact N-O 3.33Å; I177-N180 PolarHBondContact O-N 3.47Å; R178-N180 VanDerWaalsContact C-N 3.26Å
181	E	66.9	Low	58	Low	40 Å²	40	42.3 Å²	42.3	19%	0.187	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	132.6	-172.3	-163.4	-174.4	-152.1	0	0	111.6	G41 Q43 R179	G41-E181 CarbonylContact O-C 3.45Å; G41-E181 VanDerWaalsContact O-CA 3.27Å; G41-E181 WeakPolarHBondContact O-CA 3.46Å; Q43-E181 HydrophobicContact CG-CG 3.85Å; Q43-E181 WeakPolarHBondContact CG-OE1 3.49Å; Q43-E181 WeakPolarHBondContact CG-OE2 3.33Å; Q43-E181 PolarHBondContact NE2-OE2 2.95Å; R179-E181 HydrophobicContact CB-CB 4.4Å; R179-E181 WeakPolarHBondContact O-CB 3.13Å; R179-E181 PolarHBondContact O-N 2.63Å
182	I	71.4	Confident	59.6	Low	13 Å²	13	43.9 Å²	43.9	7%	0.067	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	122	174.9	-59.3	171.1	0	0	0	109.5	T33 G41 I42 Q43	T33-I182 HydrophobicContact CG2-CD1 4.01Å; G41-I182 PolarHBondContact O-N 3.01Å; I42-I182 HydrophobicContact CB-CB 4.48Å; I42-I182 HydrophobicContact CG1-CB 4.32Å; Q43-I182 PolarHBondContact N-O 2.95Å
183	T	74.6	Confident	61.1	Low	11 Å²	11	42.9 Å²	42.9	7%	0.067	20%	0.199	C	C	.	.			trans	-95.9	161.2	177.8	78.5	0	0	0	0	112.7	Q43 Q185 D186 L187	Q43-T183 VanDerWaalsContact OE1-CB 3.3Å; T183-Q185 PolarHBondContact O-N 3.45Å; T183-D186 WeakPolarHBondContact CB-OD2 3.37Å; T183-D186 WeakPolarHBondContact CG2-OD2 3.25Å; T183-D186 PolarHBondContact N-OD2 2.97Å; T183-D186 PolarHBondContact O-N 3.43Å; T183-D186 PolarHBondContact OG1-N 2.94Å; T183-D186 PolarHBondContact OG1-OD1 3.25Å; T183-D186 PolarHBondContact OG1-OD2 3.18Å; T183-L187 PolarHBondContact O-N 3.11Å; T183-L187 VanDerWaalsContact O-N 3.15Å
184	L	79.2	Confident	62.4	Low	35 Å²	35	41.8 Å²	41.8	18%	0.183	20%	0.195	C	C	.	.	H	α-helix	trans	-61.1	-33.3	177.3	177.5	61.6	0	0	0	112.2	E45 A46 H49 K188	E45-L184 HydrophobicContact CB-CB 4.43Å; E45-L184 HydrophobicContact CB-CD2 4.37Å; A46-L184 HydrophobicContact CB-CB 4.27Å; H49-L184 HydrophobicContact CB-CD1 3.44Å; H49-L184 VanDerWaalsContact CB-CD1 3.44Å; L184-K188 HydrophobicContact CD1-CD 4.4Å; L184-K188 HydrophobicContact CD1-CG 4.37Å; L184-K188 HydrophobicContact CG-CD 4.3Å; L184-K188 WeakPolarHBondContact O-CG 3.47Å; L184-K188 PolarHBondContact O-N 3.29Å
185	Q	72.6	Confident	64	Low	99 Å²	99	41.4 Å²	41.4	46%	0.463	19%	0.192	S	C	.	.	H	α-helix	trans	-68.7	-41.3	178.7	-175	170.6	-3.8	0	0	111.3	T183 L187 K188 V189	T183-Q185 PolarHBondContact O-N 3.45Å; Q185-L187 VanDerWaalsContact C-N 3.32Å; Q185-L187 PolarHBondContact O-N 3.39Å; Q185-K188 PolarHBondContact O-N 3.18Å; Q185-V189 WeakPolarHBondContact O-CG2 3.28Å; Q185-V189 PolarHBondContact O-N 3.11Å
186	D	69.4	Low	65.9	Low	10 Å²	10	38 Å²	38	5%	0.053	18%	0.178	C	C	.	.	H	α-helix	trans	-61	-46	177.8	-48.8	-25.6	0	0	0	109.8	Y173 N176 T183 V189 A190	Y173-D186 HydrophobicContact CD1-CB 3.93Å; Y173-D186 WeakPolarHBondContact CD1-OD1 3.36Å; Y173-D186 HydrophobicContact CE1-CB 4.34Å; Y173-D186 WeakPolarHBondContact CE1-OD1 3.38Å; Y173-D186 HydrophobicContact CG-CB 4.27Å; N176-D186 PolarHBondContact ND2-OD1 2.88Å; N176-D186 PolarHBondContact ND2-OD2 3.01Å; T183-D186 WeakPolarHBondContact CB-OD2 3.37Å; T183-D186 WeakPolarHBondContact CG2-OD2 3.25Å; T183-D186 PolarHBondContact N-OD2 2.97Å; T183-D186 PolarHBondContact O-N 3.43Å; T183-D186 PolarHBondContact OG1-N 2.94Å; T183-D186 PolarHBondContact OG1-OD1 3.25Å; T183-D186 PolarHBondContact OG1-OD2 3.18Å; D186-V189 PolarHBondContact O-N 3.01Å; D186-A190 WeakPolarHBondContact O-CB 3.49Å; D186-A190 PolarHBondContact O-N 3.08Å
187	L	75.1	Confident	68	Low	1 Å²	1	36.4 Å²	36.4	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-61.9	-46.5	177.7	-169.9	125.2	0	0	0	112.1	H49 V50 I159 L160 T183 Q185 V189 A190 M191	H49-L187 WeakPolarHBondContact CD2-CD2 3.3Å; V50-L187 HydrophobicContact CG2-CD1 3.46Å; V50-L187 VanDerWaalsContact CG2-CD1 3.46Å; V50-L187 HydrophobicContact CG2-CD2 4.14Å; V50-L187 HydrophobicContact CG2-CG 4.46Å; I159-L187 HydrophobicContact CG2-CD1 4.02Å; I159-L187 HydrophobicContact CG2-CG 4.37Å; L160-L187 HydrophobicContact CD2-CD1 4.4Å; T183-L187 PolarHBondContact O-N 3.11Å; T183-L187 VanDerWaalsContact O-N 3.15Å; Q185-L187 VanDerWaalsContact C-N 3.32Å; Q185-L187 PolarHBondContact O-N 3.39Å; L187-V189 VanDerWaalsContact C-N 3.31Å; L187-V189 PolarHBondContact O-N 2.86Å; L187-A190 PolarHBondContact O-N 3.01Å; L187-M191 HydrophobicContact CD2-CG 4.47Å; L187-M191 HydrophobicContact CD2-SD 3.82Å; L187-M191 WeakPolarHBondContact O-CG 3.1Å; L187-M191 PolarHBondContact O-N 3.49Å
188	K	75.8	Confident	69.7	Low	47 Å²	47	34.5 Å²	34.5	20%	0.204	16%	0.159	C	C	.	.	H	α-helix	trans	-62.5	-35.9	178.6	-77.4	179.9	177.7	174.6	0	112.9	L184 Q185 R192 I210	L184-K188 HydrophobicContact CD1-CD 4.4Å; L184-K188 HydrophobicContact CD1-CG 4.37Å; L184-K188 HydrophobicContact CG-CD 4.3Å; L184-K188 WeakPolarHBondContact O-CG 3.47Å; L184-K188 PolarHBondContact O-N 3.29Å; Q185-K188 PolarHBondContact O-N 3.18Å; K188-R192 WeakPolarHBondContact O-CG 3.34Å; K188-R192 PolarHBondContact O-N 3.38Å; K188-R192 VanDerWaalsContact O-N 3.08Å; K188-I210 HydrophobicContact CB-CD1 4.11Å; K188-I210 HydrophobicContact CD-CD1 4.27Å
189	V	68.5	Low	71.4	Confident	4 Å²	4	31.8 Å²	31.8	2%	0.024	15%	0.153	C	C	.	.	H	α-helix	trans	-76	-37.9	178.7	174.2	0	0	0	0	111.6	Y173 Q185 D186 L187 R192 A193 F212	Y173-V189 HydrophobicContact CE2-CB 3.85Å; Y173-V189 HydrophobicContact CE2-CG1 3.55Å; Y173-V189 VanDerWaalsContact OH-CB 3.23Å; Y173-V189 WeakPolarHBondContact OH-CB 3.38Å; Y173-V189 VanDerWaalsContact OH-CG1 3.3Å; Y173-V189 WeakPolarHBondContact OH-CG1 3.35Å; Y173-V189 WeakPolarHBondContact OH-CG2 3.36Å; Q185-V189 WeakPolarHBondContact O-CG2 3.28Å; Q185-V189 PolarHBondContact O-N 3.11Å; D186-V189 PolarHBondContact O-N 3.01Å; L187-V189 VanDerWaalsContact C-N 3.31Å; L187-V189 PolarHBondContact O-N 2.86Å; V189-R192 PolarHBondContact O-N 3.35Å; V189-A193 PolarHBondContact O-N 2.89Å; V189-A193 VanDerWaalsContact O-N 3.1Å; V189-F212 HydrophobicContact CG2-CZ 4.08Å
190	A	69.7	Low	72.9	Confident	3 Å²	3	25.2 Å²	25.2	3%	0.025	13%	0.13	C	C	.	.	H	α-helix	trans	-60.5	-45.2	171.3	0	0	0	0	0	112.2	Y166 D186 L187 R192 A193 D194	Y166-A190 HydrophobicContact CD2-CB 4.25Å; Y166-A190 HydrophobicContact CG-CB 4.35Å; D186-A190 WeakPolarHBondContact O-CB 3.49Å; D186-A190 PolarHBondContact O-N 3.08Å; L187-A190 PolarHBondContact O-N 3.01Å; A190-R192 VanDerWaalsContact C-N 3.34Å; A190-R192 PolarHBondContact O-N 3.36Å; A190-A193 PolarHBondContact O-N 3.28Å; A190-D194 PolarHBondContact O-N 3.03Å
191	M	74.9	Confident	73.9	Confident	2 Å²	2	21.9 Å²	21.9	1%	0.01	11%	0.111	C	C	.	.	H	α-helix	trans	-59	-44.4	175.1	-71.8	-174.3	81.8	0	0	111.5	L53 L187 A193 D194 M198 F201 Y202	L53-M191 HydrophobicContact CD1-CE 3.41Å; L53-M191 VanDerWaalsContact CD1-CE 3.41Å; L53-M191 HydrophobicContact CD1-SD 3.67Å; L53-M191 HydrophobicContact CD2-CE 4.49Å; L187-M191 HydrophobicContact CD2-CG 4.47Å; L187-M191 HydrophobicContact CD2-SD 3.82Å; L187-M191 WeakPolarHBondContact O-CG 3.1Å; L187-M191 PolarHBondContact O-N 3.49Å; M191-A193 VanDerWaalsContact C-N 3.31Å; M191-A193 PolarHBondContact O-N 3.37Å; M191-D194 PolarHBondContact O-N 3.49Å; M191-M198 WeakPolarHBondContact O-CG 3.4Å; M191-F201 HydrophobicContact CE-CB 3.84Å; M191-F201 HydrophobicContact CE-CD2 3.54Å; M191-F201 HydrophobicContact CE-CE2 4.33Å; M191-F201 HydrophobicContact CE-CG 3.84Å; M191-Y202 HydrophobicContact CB-CE2 4.28Å; M191-Y202 HydrophobicContact CE-CD2 4.43Å; M191-Y202 HydrophobicContact CE-CE2 3.55Å; M191-Y202 HydrophobicContact SD-CE2 4.06Å
192	R	69	Low	74.3	Confident	43 Å²	43	21.3 Å²	21.3	16%	0.162	11%	0.108	C	C	.	.	H	α-helix	trans	-60.9	-35.2	178	-79.3	-178.9	-174.5	-166.2	0.2	115	K188 V189 A190 M198 P208 C477	K188-R192 WeakPolarHBondContact O-CG 3.34Å; K188-R192 PolarHBondContact O-N 3.38Å; K188-R192 VanDerWaalsContact O-N 3.08Å; V189-R192 PolarHBondContact O-N 3.35Å; A190-R192 VanDerWaalsContact C-N 3.34Å; A190-R192 PolarHBondContact O-N 3.36Å; R192-M198 WeakPolarHBondContact CA-SD 3.38Å; R192-M198 HydrophobicContact CB-SD 4.33Å; R192-M198 HydrophobicContact CG-CE 4.06Å; R192-M198 HydrophobicContact CG-SD 3.93Å; R192-P208 PolarHBondContact NH2-O 2.96Å; R192-C477 PolarHBondContact NH1-O 3.28Å
193	A	66.9	Low	74.1	Confident	27 Å²	27	26.1 Å²	26.1	22%	0.223	13%	0.13	C	C	.	.	H	α-helix	trans	-79.1	-22.1	-179.1	0	0	0	0	0	112.2	Y166 V189 A190 M191 N195	Y166-A193 HydrophobicContact CD1-CB 3.31Å; Y166-A193 HydrophobicContact CD2-CB 4.44Å; Y166-A193 HydrophobicContact CE1-CB 3.23Å; Y166-A193 HydrophobicContact CE2-CB 4.39Å; Y166-A193 HydrophobicContact CG-CB 3.96Å; Y166-A193 PolarHBondContact OH-O 2.87Å; Y166-A193 VanDerWaalsContact OH-O 3.08Å; V189-A193 PolarHBondContact O-N 2.89Å; V189-A193 VanDerWaalsContact O-N 3.1Å; A190-A193 PolarHBondContact O-N 3.28Å; M191-A193 VanDerWaalsContact C-N 3.31Å; M191-A193 PolarHBondContact O-N 3.37Å; A193-N195 PolarHBondContact O-N 3.03Å
194	D	71.3	Confident	73.2	Confident	4 Å²	4	30 Å²	30	2%	0.021	15%	0.15	C	C	.	.			trans	-89	101	173.6	-164.7	-19.2	0	0	0	111.5	Y166 A190 M191 V196 L197 M198 S642 R646	Y166-D194 HydrophobicContact CE2-CB 3.78Å; A190-D194 PolarHBondContact O-N 3.03Å; M191-D194 PolarHBondContact O-N 3.49Å; D194-V196 PolarHBondContact O-N 3.06Å; D194-V196 VanDerWaalsContact O-N 3.11Å; D194-V196 WeakPolarHBondContact OD1-CB 3.34Å; D194-V196 PolarHBondContact OD1-N 3.3Å; D194-L197 HydrophobicContact CB-CB 4.08Å; D194-L197 HydrophobicContact CB-CD1 4.08Å; D194-L197 HydrophobicContact CB-CG 4.14Å; D194-L197 PolarHBondContact O-N 3.01Å; D194-L197 VanDerWaalsContact O-N 3.17Å; D194-M198 PolarHBondContact O-N 3.35Å; D194-S642 WeakPolarHBondContact OD1-CB 3.48Å; D194-S642 PolarHBondContact OD1-OG 3.14Å; D194-S642 PolarHBondContact OD2-OG 3.32Å; D194-R646 IonicContact OD2-CZ 2.72Å; D194-R646 IonicContact OD2-NH2 3.57Å; D194-R646 PolarHBondContact OD2-NH2 2.96Å
195	N	72.8	Confident	71.8	Confident	29 Å²	29	36 Å²	36	16%	0.155	18%	0.183	C	C	.	.	H	α-helix	trans	-52.3	-35	176.9	-64.4	-29.2	0	0	0	112.7	A193 D199 R570 L638	A193-N195 PolarHBondContact O-N 3.03Å; N195-D199 WeakPolarHBondContact O-CB 3.18Å; N195-D199 PolarHBondContact O-N 3.47Å; N195-R570 HydrophobicContact CB-CB 4Å; N195-R570 WeakPolarHBondContact OD1-CB 3.26Å; N195-L638 PolarHBondContact ND2-O 3.24Å
196	V	76.1	Confident	70.8	Confident	14 Å²	14	37.5 Å²	37.5	9%	0.085	19%	0.189	C	C	.	.	H	α-helix	trans	-71.8	-43.1	-177.2	-177.5	0	0	0	0	111	P81 L84 D194 L200 S642	P81-V196 HydrophobicContact CB-CG1 4.11Å; P81-V196 HydrophobicContact CG-CG1 3.75Å; P81-V196 VanDerWaalsContact CG-O 3.28Å; P81-V196 WeakPolarHBondContact CG-O 3.4Å; L84-V196 HydrophobicContact CB-CG1 3.6Å; L84-V196 HydrophobicContact CD2-CG1 4.01Å; L84-V196 HydrophobicContact CG-CG1 4.43Å; D194-V196 PolarHBondContact O-N 3.06Å; D194-V196 VanDerWaalsContact O-N 3.11Å; D194-V196 WeakPolarHBondContact OD1-CB 3.34Å; D194-V196 PolarHBondContact OD1-N 3.3Å; V196-L200 PolarHBondContact O-N 3.46Å; V196-S642 WeakPolarHBondContact CG2-OG 3.45Å
197	L	79.3	Confident	70	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-73.8	-34.8	176.9	-64.5	176.6	0	0	0	111.9	L84 I159 D194 L200 F201	L84-L197 HydrophobicContact CD2-CD2 4.35Å; I159-L197 HydrophobicContact CG1-CD1 4.35Å; I159-L197 HydrophobicContact CG1-CD2 4.2Å; D194-L197 HydrophobicContact CB-CB 4.08Å; D194-L197 HydrophobicContact CB-CD1 4.08Å; D194-L197 HydrophobicContact CB-CG 4.14Å; D194-L197 PolarHBondContact O-N 3.01Å; D194-L197 VanDerWaalsContact O-N 3.17Å; L197-L200 PolarHBondContact O-N 2.97Å; L197-F201 HydrophobicContact CD2-CE2 4.15Å; L197-F201 WeakPolarHBondContact O-CD2 3.46Å; L197-F201 PolarHBondContact O-N 2.97Å
198	M	77.7	Confident	68.5	Low	4 Å²	4	42.1 Å²	42.1	2%	0.02	22%	0.217	C	C	.	.	H	α-helix	trans	-60.7	-46.8	172.6	-78.5	-52.8	-78.2	0	0	111.9	M191 R192 D194 L200 F201 Y202 L207	M191-M198 WeakPolarHBondContact O-CG 3.4Å; R192-M198 WeakPolarHBondContact CA-SD 3.38Å; R192-M198 HydrophobicContact CB-SD 4.33Å; R192-M198 HydrophobicContact CG-CE 4.06Å; R192-M198 HydrophobicContact CG-SD 3.93Å; D194-M198 PolarHBondContact O-N 3.35Å; M198-L200 VanDerWaalsContact C-N 3.25Å; M198-L200 PolarHBondContact O-N 2.99Å; M198-F201 PolarHBondContact O-N 3.15Å; M198-Y202 HydrophobicContact CE-CD2 3.84Å; M198-Y202 HydrophobicContact CE-CG 4.05Å; M198-Y202 PolarHBondContact O-N 3.21Å; M198-Y202 HydrophobicContact SD-CD2 3.38Å; M198-Y202 WeakPolarHBondContact SD-CD2 3.31Å; M198-Y202 HydrophobicContact SD-CE2 3.92Å; M198-Y202 HydrophobicContact SD-CG 4.19Å; M198-L207 HydrophobicContact CE-CD2 3.87Å
199	D	77.5	Confident	67	Low	55 Å²	55	46.4 Å²	46.4	29%	0.294	24%	0.241	S	C	.	.	H	α-helix	trans	-64.9	-30.9	179.7	-71.9	-5.8	0	0	0	111.5	P81 N195 R612	P81-D199 HydrophobicContact CG-CB 4.27Å; N195-D199 WeakPolarHBondContact O-CB 3.18Å; N195-D199 PolarHBondContact O-N 3.47Å; D199-R612 IonicContact OD2-NH1 3.14Å; D199-R612 PolarHBondContact OD2-NH1 3.47Å
200	L	82.4	Confident	66	Low	15 Å²	15	47.7 Å²	47.7	8%	0.079	25%	0.247	C	C	.	.	H	α-helix	trans	-76.7	-41.4	177.4	-176.3	63.4	0	0	0	113.5	R56 L57 F80 P81 L84 I155 V196 L197 M198	R56-L200 PolarHBondContact NH2-O 3.21Å; L57-L200 HydrophobicContact CD1-CD1 4.36Å; F80-L200 HydrophobicContact CD1-CD1 3.65Å; F80-L200 HydrophobicContact CE1-CD1 4.03Å; F80-L200 HydrophobicContact CG-CD1 4.09Å; P81-L200 HydrophobicContact CG-CB 4.34Å; L84-L200 HydrophobicContact CD2-CD2 3.78Å; I155-L200 HydrophobicContact CD1-CD2 4.39Å; V196-L200 PolarHBondContact O-N 3.46Å; L197-L200 PolarHBondContact O-N 2.97Å; M198-L200 VanDerWaalsContact C-N 3.25Å; M198-L200 PolarHBondContact O-N 2.99Å
201	F	81.8	Confident	64.6	Low	3 Å²	3	51.2 Å²	51.2	1%	0.013	27%	0.272	C	S	.	.	H	α-helix	trans	-102.8	-30	-168.6	-71	-68.7	0	0	0	116	L53 R56 I155 I159 M191 L197 M198	L53-F201 HydrophobicContact CB-CD1 3.97Å; L53-F201 HydrophobicContact CB-CE1 3.7Å; L53-F201 HydrophobicContact CB-CZ 4.27Å; L53-F201 HydrophobicContact CD1-CD1 4.47Å; L53-F201 HydrophobicContact CD2-CB 4.14Å; L53-F201 HydrophobicContact CD2-CD1 3.59Å; L53-F201 HydrophobicContact CD2-CE1 4.24Å; L53-F201 HydrophobicContact CD2-CG 3.99Å; L53-F201 HydrophobicContact CG-CD1 4.2Å; L53-F201 HydrophobicContact CG-CE1 4.4Å; R56-F201 PolarHBondContact NH1-O 2.76Å; R56-F201 VanDerWaalsContact NH2-CD1 3.31Å; I155-F201 HydrophobicContact CG2-CE2 4.25Å; I155-F201 HydrophobicContact CG2-CZ 3.85Å; I159-F201 HydrophobicContact CD1-CE2 3.65Å; I159-F201 HydrophobicContact CD1-CZ 3.74Å; I159-F201 HydrophobicContact CG1-CE2 4.12Å; M191-F201 HydrophobicContact CE-CB 3.84Å; M191-F201 HydrophobicContact CE-CD2 3.54Å; M191-F201 HydrophobicContact CE-CE2 4.33Å; M191-F201 HydrophobicContact CE-CG 3.84Å; L197-F201 HydrophobicContact CD2-CE2 4.15Å; L197-F201 WeakPolarHBondContact O-CD2 3.46Å; L197-F201 PolarHBondContact O-N 2.97Å; M198-F201 PolarHBondContact O-N 3.15Å
202	Y	73.8	Confident	62.9	Low	29 Å²	29	54.9 Å²	54.9	11%	0.114	29%	0.288	C	S	.	.			trans	-121.1	109	-170.2	-64.1	-76.5	0	0	0	111.1	H49 M191 M198	H49-Y202 PolarHBondContact CE1-OH 2.87Å; H49-Y202 PolarHBondContact NE2-OH 2.96Å; M191-Y202 HydrophobicContact CB-CE2 4.28Å; M191-Y202 HydrophobicContact CE-CD2 4.43Å; M191-Y202 HydrophobicContact CE-CE2 3.55Å; M191-Y202 HydrophobicContact SD-CE2 4.06Å; M198-Y202 HydrophobicContact CE-CD2 3.84Å; M198-Y202 HydrophobicContact CE-CG 4.05Å; M198-Y202 PolarHBondContact O-N 3.21Å; M198-Y202 HydrophobicContact SD-CD2 3.38Å; M198-Y202 WeakPolarHBondContact SD-CD2 3.31Å; M198-Y202 HydrophobicContact SD-CE2 3.92Å; M198-Y202 HydrophobicContact SD-CG 4.19Å
203	H	67.3	Low	61.5	Low	114 Å²	114	56.3 Å²	56.3	53%	0.528	30%	0.299	S	S	.	.			trans	-84.4	157.3	168.9	-55.1	-54.3	0	0	0	110.3	D205 E206	H203-D205 PolarHBondContact O-N 2.89Å; H203-E206 PolarHBondContact O-N 3.07Å; H203-E206 VanDerWaalsContact O-N 3.14Å
204	D	55.2	Low	60	Low	92 Å²	92	57 Å²	57	49%	0.492	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-22	-165	-77	-39.2	0	0	0	115.5	R570 K571	D204-R570 IonicContact OD1-NH2 3.54Å; D204-K571 WeakPolarHBondContact OD1-CE 3.44Å; D204-K571 IonicContact OD1-NZ 3.65Å; D204-K571 PolarHBondContact OD1-NZ 2.86Å; D204-K571 IonicContact OD2-NZ 3.16Å; D204-K571 PolarHBondContact OD2-NZ 3.4Å
205	D	50.8	Low	58.3	Low	162 Å²	162	64.7 Å²	64.7	87%	0.866	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-9.2	-174.8	-62.7	-39.6	0	0	0	114.9	H203	H203-D205 PolarHBondContact O-N 2.89Å
206	E	51.9	Low	56.7	Low	129 Å²	129	67.3 Å²	67.3	60%	0.603	35%	0.354	S	S	*	.			trans	-115.2	22.3	-169.6	-66.4	-167.3	160.1	0	0	115.3	H203 P208	H203-E206 PolarHBondContact O-N 3.07Å; H203-E206 VanDerWaalsContact O-N 3.14Å; E206-P208 WeakPolarHBondContact O-CD 3.4Å
207	L	51.9	Low	54.9	Low	56 Å²	56	70.4 Å²	70.4	29%	0.293	37%	0.37	S	S	.	.			trans	-69.7	113.1	179.5	-74.4	167.6	0	0	0	111.6	M198 I209	M198-L207 HydrophobicContact CE-CD2 3.87Å; L207-I209 PolarHBondContact O-N 2.6Å
208	P	44.6	Very low	52.8	Low	53 Å²	53	73.6 Å²	73.6	34%	0.344	39%	0.389	S	S	.	.			trans	-67.7	128.5	175.3	-14.1	29.7	0	0	0	108.9	R192 E206 I210	R192-P208 PolarHBondContact NH2-O 2.96Å; E206-P208 WeakPolarHBondContact O-CD 3.4Å; P208-I210 PolarHBondContact O-N 2.93Å
209	I	44.3	Very low	50.9	Low	137 Å²	137	77.4 Å²	77.4	70%	0.703	42%	0.421	S	S	*	.			trans	-69.9	95.4	175.8	-57.5	171.3	0	0	0	108.1	L207 S211	L207-I209 PolarHBondContact O-N 2.6Å; I209-S211 PolarHBondContact O-N 2.98Å
210	I	46.5	Very low	49.1	Very low	30 Å²	30	78.5 Å²	78.5	15%	0.154	43%	0.433	C	S	.	.			trans	-83.9	94.5	163.7	-57.2	176.6	0	0	0	105.1	K188 P208 F212	K188-I210 HydrophobicContact CB-CD1 4.11Å; K188-I210 HydrophobicContact CD-CD1 4.27Å; P208-I210 PolarHBondContact O-N 2.93Å; I210-F212 HydrophobicContact CG2-CD2 4.26Å; I210-F212 HydrophobicContact CG2-CE2 4.03Å; I210-F212 HydrophobicContact CG2-CZ 4.28Å; I210-F212 PolarHBondContact O-N 3.02Å
211	S	40.5	Very low	47.3	Very low	78 Å²	78	85 Å²	85	55%	0.545	46%	0.461	S	S	.	.			trans	-69	99.1	169.1	124.9	0	0	0	0	106.9	I209 N213	I209-S211 PolarHBondContact O-N 2.98Å; S211-N213 VanDerWaalsContact C-N 3.29Å; S211-N213 PolarHBondContact O-N 3.15Å; S211-N213 PolarHBondContact OG-OD1 3.32Å
212	F	40.2	Very low	45.1	Very low	79 Å²	79	92.5 Å²	92.5	35%	0.346	50%	0.499	S	S	.	.			trans	-67.5	98.4	158.7	-73.7	-80.6	0	0	0	106.3	V189 I210 A214 L217	V189-F212 HydrophobicContact CG2-CZ 4.08Å; I210-F212 HydrophobicContact CG2-CD2 4.26Å; I210-F212 HydrophobicContact CG2-CE2 4.03Å; I210-F212 HydrophobicContact CG2-CZ 4.28Å; I210-F212 PolarHBondContact O-N 3.02Å; F212-A214 PolarHBondContact O-N 3.46Å; F212-L217 HydrophobicContact CD1-CD1 4.08Å
213	N	38.5	Very low	43.6	Very low	73 Å²	73	93.3 Å²	93.3	39%	0.39	52%	0.517	S	S	.	.			trans	-63.2	96.4	165.4	-89.4	-11.9	0	0	0	106.5	S211 E215 D216 L217	S211-N213 VanDerWaalsContact C-N 3.29Å; S211-N213 PolarHBondContact O-N 3.15Å; S211-N213 PolarHBondContact OG-OD1 3.32Å; N213-E215 PolarHBondContact O-N 3.49Å; N213-D216 HydrophobicContact CB-CB 3.95Å; N213-D216 VanDerWaalsContact CB-OD2 3.3Å; N213-D216 WeakPolarHBondContact CB-OD2 3.44Å; N213-D216 PolarHBondContact ND2-OD2 3.14Å; N213-D216 PolarHBondContact O-N 3.01Å; N213-L217 PolarHBondContact O-N 3.01Å
214	A	36.3	Very low	43	Very low	42 Å²	42	93.4 Å²	93.4	35%	0.347	53%	0.53	S	S	.	.	H	α-helix	trans	-52.4	-28.9	173.6	0	0	0	0	0	111	F212 V218	F212-A214 PolarHBondContact O-N 3.46Å; A214-V218 WeakPolarHBondContact O-CG2 3.35Å; A214-V218 PolarHBondContact O-N 2.99Å; A214-V218 VanDerWaalsContact O-N 3.14Å
215	E	35.2	Very low	43.6	Very low	164 Å²	164	94.5 Å²	94.5	77%	0.766	54%	0.535	S	S	*	.	H	α-helix	trans	-67	-34.7	175.1	-65.5	-175.4	166.7	0	0	113.7	N213 A219	N213-E215 PolarHBondContact O-N 3.49Å; E215-A219 WeakPolarHBondContact O-CB 3.47Å; E215-A219 PolarHBondContact O-N 3.4Å
216	D	39.1	Very low	44.9	Very low	85 Å²	85	89.2 Å²	89.2	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-75.1	-30.4	179.9	-75.8	-34	0	0	0	112.1	N213 S220	N213-D216 HydrophobicContact CB-CB 3.95Å; N213-D216 VanDerWaalsContact CB-OD2 3.3Å; N213-D216 WeakPolarHBondContact CB-OD2 3.44Å; N213-D216 PolarHBondContact ND2-OD2 3.14Å; N213-D216 PolarHBondContact O-N 3.01Å; D216-S220 PolarHBondContact O-N 2.88Å; D216-S220 PolarHBondContact O-OG 3.14Å
217	L	37.3	Very low	46.4	Very low	78 Å²	78	83.7 Å²	83.7	41%	0.408	48%	0.484	S	S	.	.	H	α-helix	trans	-78.6	-29.8	175.1	-87	139.7	0	0	0	113.1	F212 N213	F212-L217 HydrophobicContact CD1-CD1 4.08Å; N213-L217 PolarHBondContact O-N 3.01Å
218	V	36.3	Very low	47.7	Very low	68 Å²	68	83.1 Å²	83.1	41%	0.412	48%	0.48	S	S	.	.	H	α-helix	trans	-81.8	-30.1	175.9	176.1	0	0	0	0	111.6	A214	A214-V218 WeakPolarHBondContact O-CG2 3.35Å; A214-V218 PolarHBondContact O-N 2.99Å; A214-V218 VanDerWaalsContact O-N 3.14Å
219	A	37.8	Very low	49.2	Very low	84 Å²	84	82.3 Å²	82.3	69%	0.694	47%	0.472	S	S	*	.	H	α-helix	trans	-76.5	-19.3	178	0	0	0	0	0	114	E215	E215-A219 WeakPolarHBondContact O-CB 3.47Å; E215-A219 PolarHBondContact O-N 3.4Å
220	S	39.7	Very low	51	Low	77 Å²	77	76.1 Å²	76.1	54%	0.538	44%	0.44	S	S	.	.	S	Bend	trans	-97.6	97.5	-176.8	53.8	0	0	0	0	112.4	D216	D216-S220 PolarHBondContact O-N 2.88Å; D216-S220 PolarHBondContact O-OG 3.14Å
221	K	44.5	Very low	52.7	Low	153 Å²	153	74.7 Å²	74.7	67%	0.665	43%	0.433	S	S	*	.			trans	89.7	64.6	172.3	-59.3	180	173	-177.7	0	116.9	G223	K221-G223 PolarHBondContact O-N 2.83Å
222	I	35.3	Very low	54.4	Low	159 Å²	159	73.4 Å²	73.4	82%	0.815	42%	0.418	S	S	*	.			trans	-79.5	71.6	139.4	-56.8	171.1	0	0	0	106.9
223	G	43.3	Very low	56	Low	47 Å²	47	72.8 Å²	72.8	49%	0.485	42%	0.418	S	S	.	.	S	Bend	trans	-141.4	133.7	-179.6	0	0	0	0	0	110	K221	K221-G223 PolarHBondContact O-N 2.83Å
224	S	54.4	Low	58.2	Low	116 Å²	116	69.3 Å²	69.3	81%	0.811	40%	0.399	S	S	*	.			trans	-25.9	125	-179.2	55.4	0	0	0	0	115.2	S226	S224-S226 PolarHBondContact O-N 2.86Å
225	I	67.2	Low	60.4	Low	114 Å²	114	68.6 Å²	68.6	59%	0.585	39%	0.39	S	S	*	.			trans	-56.6	119.2	163.9	-60	171.5	0	0	0	106.8	T230 L403	I225-T230 VanDerWaalsContact CG2-OG1 3.24Å; I225-T230 WeakPolarHBondContact CG2-OG1 3.24Å; I225-L403 HydrophobicContact CG2-CD1 3.9Å; I225-L403 WeakPolarHBondContact O-CD2 3.42Å
226	S	77.3	Confident	62.2	Low	52 Å²	52	62 Å²	62	36%	0.364	36%	0.359	S	S	.	.			trans	-91.1	157.2	174.4	64.9	0	0	0	0	110.2	S224 E228 Q229 T230	S224-S226 PolarHBondContact O-N 2.86Å; S226-E228 VanDerWaalsContact C-N 3.3Å; S226-E228 PolarHBondContact O-N 3.29Å; S226-Q229 PolarHBondContact O-N 3.03Å; S226-Q229 WeakPolarHBondContact OG-CB 3.31Å; S226-Q229 PolarHBondContact OG-N 3.23Å; S226-T230 PolarHBondContact O-N 2.85Å; S226-T230 VanDerWaalsContact O-N 3.09Å; S226-T230 PolarHBondContact O-OG1 2.75Å
227	Y	84.6	Confident	64	Low	12 Å²	12	58.9 Å²	58.9	5%	0.047	34%	0.342	C	S	.	.	H	α-helix	trans	-54.6	-49	172.4	-171.1	-81	0	0	0	110.7	Q229 T230 V231 V298 P299 F300 I301 L400 L403 A404 D409 L413	Y227-Q229 VanDerWaalsContact C-N 3.32Å; Y227-Q229 PolarHBondContact O-N 3.08Å; Y227-T230 WeakPolarHBondContact O-CA 3.17Å; Y227-T230 WeakPolarHBondContact O-CB 3.23Å; Y227-T230 PolarHBondContact O-N 3.33Å; Y227-V231 HydrophobicContact CD1-CG2 3.62Å; Y227-V231 HydrophobicContact CE1-CG2 3.36Å; Y227-V231 WeakPolarHBondContact O-CG2 3.4Å; Y227-V231 PolarHBondContact O-N 3.15Å; Y227-V298 HydrophobicContact CD1-CG1 3.58Å; Y227-V298 HydrophobicContact CE1-CG1 4.31Å; Y227-V298 HydrophobicContact CG-CG1 4.27Å; Y227-P299 VanDerWaalsContact CE1-O 3.3Å; Y227-P299 WeakPolarHBondContact CE1-O 2.93Å; Y227-F300 HydrophobicContact CE1-CD1 4.27Å; Y227-I301 HydrophobicContact CE1-CG1 4.41Å; Y227-I301 WeakPolarHBondContact OH-CG1 3.45Å; Y227-I301 PolarHBondContact OH-N 3.19Å; Y227-I301 VanDerWaalsContact OH-N 3.11Å; Y227-L400 HydrophobicContact CD2-CD2 4.27Å; Y227-L400 HydrophobicContact CE2-CB 4.36Å; Y227-L400 HydrophobicContact CE2-CD2 3.96Å; Y227-L403 HydrophobicContact CD2-CB 3.96Å; Y227-L403 HydrophobicContact CG-CB 4.5Å; Y227-A404 HydrophobicContact CD2-CB 4.29Å; Y227-A404 HydrophobicContact CE2-CB 3.95Å; Y227-D409 WeakPolarHBondContact CE2-OD2 3.26Å; Y227-D409 VanDerWaalsContact OH-CG 3.29Å; Y227-D409 PolarHBondContact OH-OD1 3.37Å; Y227-D409 PolarHBondContact OH-OD2 3.23Å; Y227-L413 HydrophobicContact CE2-CD1 4.34Å
228	E	79.4	Confident	66.4	Low	45 Å²	45	55.1 Å²	55.1	21%	0.21	32%	0.323	C	S	.	.	H	α-helix	trans	-55.7	-41	177.6	-171.2	-143.7	135.2	0	0	113.4	R178 S226 K232	R178-E228 IonicContact CZ-OE1 3.2Å; R178-E228 IonicContact NH1-OE1 2.68Å; R178-E228 PolarHBondContact NH1-OE1 3.26Å; R178-E228 IonicContact NH2-OE1 3.12Å; S226-E228 VanDerWaalsContact C-N 3.3Å; S226-E228 PolarHBondContact O-N 3.29Å; E228-K232 HydrophobicContact CG-CD 4.35Å; E228-K232 WeakPolarHBondContact O-CG 3.09Å; E228-K232 PolarHBondContact O-N 3.35Å; E228-K232 VanDerWaalsContact O-N 3.14Å; E228-K232 WeakPolarHBondContact OE1-CE 3.13Å; E228-K232 IonicContact OE1-NZ 2.68Å; E228-K232 PolarHBondContact OE1-NZ 2.88Å
229	Q	75.9	Confident	68.5	Low	36 Å²	36	54.1 Å²	54.1	17%	0.168	32%	0.317	C	S	.	.	H	α-helix	trans	-67.7	-40	176.9	-176.3	60.4	47.6	0	0	111	R178 S226 Y227 K232 D233	R178-Q229 VanDerWaalsContact NH2-OE1 3.16Å; S226-Q229 PolarHBondContact O-N 3.03Å; S226-Q229 WeakPolarHBondContact OG-CB 3.31Å; S226-Q229 PolarHBondContact OG-N 3.23Å; Y227-Q229 VanDerWaalsContact C-N 3.32Å; Y227-Q229 PolarHBondContact O-N 3.08Å; Q229-K232 PolarHBondContact O-N 3.06Å; Q229-D233 PolarHBondContact NE2-OD1 3.1Å; Q229-D233 PolarHBondContact O-N 3.37Å
230	T	81.1	Confident	70.2	Confident	7 Å²	7	50.6 Å²	50.6	4%	0.043	29%	0.286	C	S	.	.	H	α-helix	trans	-64.2	-43.3	178.3	-49.3	0	0	0	0	111.5	I225 S226 Y227 K232 D233 L234 F396 V399 L400 L403	I225-T230 VanDerWaalsContact CG2-OG1 3.24Å; I225-T230 WeakPolarHBondContact CG2-OG1 3.24Å; S226-T230 PolarHBondContact O-N 2.85Å; S226-T230 VanDerWaalsContact O-N 3.09Å; S226-T230 PolarHBondContact O-OG1 2.75Å; Y227-T230 WeakPolarHBondContact O-CA 3.17Å; Y227-T230 WeakPolarHBondContact O-CB 3.23Å; Y227-T230 PolarHBondContact O-N 3.33Å; T230-K232 VanDerWaalsContact C-N 3.32Å; T230-K232 PolarHBondContact O-N 2.87Å; T230-D233 PolarHBondContact O-N 3.31Å; T230-L234 PolarHBondContact O-N 3.23Å; T230-F396 HydrophobicContact CG2-CD1 4Å; T230-F396 HydrophobicContact CG2-CE1 4.22Å; T230-V399 HydrophobicContact CG2-CG1 4.18Å; T230-L400 HydrophobicContact CG2-CD2 3.78Å; T230-L400 HydrophobicContact CG2-CG 4.31Å; T230-L403 WeakPolarHBondContact OG1-CD1 3.38Å
231	V	84.1	Confident	72.5	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-59.2	-44.6	174.6	173.9	0	0	0	0	111	Y227 D233 L234 V235 V290 P299 I301 L400	Y227-V231 HydrophobicContact CD1-CG2 3.62Å; Y227-V231 HydrophobicContact CE1-CG2 3.36Å; Y227-V231 WeakPolarHBondContact O-CG2 3.4Å; Y227-V231 PolarHBondContact O-N 3.15Å; V231-D233 VanDerWaalsContact C-N 3.35Å; V231-D233 PolarHBondContact O-N 3.37Å; V231-L234 WeakPolarHBondContact O-CB 3.5Å; V231-L234 PolarHBondContact O-N 3.42Å; V231-V235 WeakPolarHBondContact O-CG2 3.06Å; V231-V235 PolarHBondContact O-N 2.9Å; V231-V290 HydrophobicContact CG1-CG2 3.79Å; V231-P299 HydrophobicContact CG1-CG 4.28Å; V231-I301 HydrophobicContact CB-CD1 4.48Å; V231-I301 HydrophobicContact CG1-CD1 4.34Å; V231-I301 HydrophobicContact CG1-CG2 3.79Å; V231-I301 HydrophobicContact CG2-CD1 3.83Å; V231-I301 HydrophobicContact CG2-CG1 3.96Å; V231-I301 HydrophobicContact CG2-CG2 4.16Å; V231-L400 HydrophobicContact CG2-CD2 4.43Å
232	K	76	Confident	74.5	Confident	51 Å²	51	40.8 Å²	40.8	22%	0.222	23%	0.234	C	C	.	.	H	α-helix	trans	-68.6	-34.5	179.9	-71.8	174.5	177.8	178.6	0	112.3	R178 E228 Q229 T230 H236	R178-K232 VanDerWaalsContact CZ-NZ 3.32Å; E228-K232 HydrophobicContact CG-CD 4.35Å; E228-K232 WeakPolarHBondContact O-CG 3.09Å; E228-K232 PolarHBondContact O-N 3.35Å; E228-K232 VanDerWaalsContact O-N 3.14Å; E228-K232 WeakPolarHBondContact OE1-CE 3.13Å; E228-K232 IonicContact OE1-NZ 2.68Å; E228-K232 PolarHBondContact OE1-NZ 2.88Å; Q229-K232 PolarHBondContact O-N 3.06Å; T230-K232 VanDerWaalsContact C-N 3.32Å; T230-K232 PolarHBondContact O-N 2.87Å; K232-H236 VanDerWaalsContact O-CB 3.32Å; K232-H236 WeakPolarHBondContact O-CB 3.5Å; K232-H236 PolarHBondContact O-N 3.2Å; K232-H236 VanDerWaalsContact O-N 3.16Å
233	D	73.3	Confident	76.8	Confident	66 Å²	66	34.8 Å²	34.8	35%	0.353	20%	0.201	S	C	.	.	H	α-helix	trans	-67.5	-36.5	173.1	-65.4	-20.1	0	0	0	111.3	Q229 T230 V231 H237	Q229-D233 PolarHBondContact NE2-OD1 3.1Å; Q229-D233 PolarHBondContact O-N 3.37Å; T230-D233 PolarHBondContact O-N 3.31Å; V231-D233 VanDerWaalsContact C-N 3.35Å; V231-D233 PolarHBondContact O-N 3.37Å; D233-H237 WeakPolarHBondContact O-CB 3.46Å; D233-H237 PolarHBondContact O-N 3.28Å
234	L	83.9	Confident	78.7	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-66.2	-51.8	174.9	177.6	65.5	0	0	0	112.4	T230 V231 H236 H237 E238 F282 L286 I301 F305 F396	T230-L234 PolarHBondContact O-N 3.23Å; V231-L234 WeakPolarHBondContact O-CB 3.5Å; V231-L234 PolarHBondContact O-N 3.42Å; L234-H236 PolarHBondContact O-N 3.28Å; L234-H237 PolarHBondContact O-N 3.08Å; L234-H237 VanDerWaalsContact O-N 3.07Å; L234-E238 HydrophobicContact CD1-CG 4.42Å; L234-E238 PolarHBondContact O-N 3.22Å; L234-F282 HydrophobicContact CD2-CZ 4.33Å; L234-L286 HydrophobicContact CD2-CD1 3.99Å; L234-L286 HydrophobicContact CD2-CD2 4.23Å; L234-L286 HydrophobicContact CG-CD1 4.02Å; L234-I301 HydrophobicContact CD2-CD1 3.67Å; L234-F305 HydrophobicContact CD2-CE2 3.61Å; L234-F305 HydrophobicContact CD2-CZ 3.68Å; L234-F396 HydrophobicContact CB-CE1 4.23Å; L234-F396 HydrophobicContact CB-CZ 4.42Å; L234-F396 HydrophobicContact CD1-CD2 3.93Å; L234-F396 HydrophobicContact CD1-CE2 3.95Å; L234-F396 HydrophobicContact CD1-CG 4.24Å; L234-F396 HydrophobicContact CD1-CZ 4.27Å
235	V	82.2	Confident	80.4	Confident	26 Å²	26	27.9 Å²	27.9	16%	0.158	14%	0.144	C	C	.	.	H	α-helix	trans	-53.7	-45.3	176.7	171.4	0	0	0	0	110.2	V231 H237 E238 T239 L283 L286 E287 V290	V231-V235 WeakPolarHBondContact O-CG2 3.06Å; V231-V235 PolarHBondContact O-N 2.9Å; V235-H237 PolarHBondContact O-N 3.41Å; V235-E238 PolarHBondContact O-N 2.89Å; V235-T239 PolarHBondContact O-N 2.68Å; V235-T239 PolarHBondContact O-OG1 3.09Å; V235-L283 HydrophobicContact CG1-CD1 4.07Å; V235-L286 HydrophobicContact CG2-CB 3.94Å; V235-L286 HydrophobicContact CG2-CD1 4.37Å; V235-E287 HydrophobicContact CG1-CG 4.33Å; V235-V290 HydrophobicContact CG2-CG2 4.31Å
236	H	73.1	Confident	81.4	Confident	25 Å²	25	23.2 Å²	23.2	12%	0.116	12%	0.12	C	C	.	.	H	α-helix	trans	-63.1	-42.5	178.6	-180	48.1	0	0	0	113.1	Q168 K232 L234 T239 Q240 P449	Q168-H236 PolarHBondContact O-CE1 2.97Å; Q168-H236 PolarHBondContact O-NE2 2.92Å; Q168-H236 VanDerWaalsContact O-NE2 3.12Å; K232-H236 VanDerWaalsContact O-CB 3.32Å; K232-H236 WeakPolarHBondContact O-CB 3.5Å; K232-H236 PolarHBondContact O-N 3.2Å; K232-H236 VanDerWaalsContact O-N 3.16Å; L234-H236 PolarHBondContact O-N 3.28Å; H236-T239 PolarHBondContact O-N 3.33Å; H236-Q240 WeakPolarHBondContact O-CB 3.39Å; H236-Q240 PolarHBondContact O-N 2.96Å; H236-Q240 VanDerWaalsContact O-N 3.08Å; H236-P449 VanDerWaalsContact NE2-CB 3.3Å; H236-P449 WeakPolarHBondContact NE2-CB 3.39Å; H236-P449 VanDerWaalsContact NE2-CG 3.27Å; H236-P449 WeakPolarHBondContact NE2-CG 3.5Å
237	H	77	Confident	81.8	Confident	20 Å²	20	21.7 Å²	21.7	9%	0.093	11%	0.107	C	C	.	.	H	α-helix	trans	-65.6	-38.5	178.5	-177.8	-122.7	0	0	0	111.8	D233 L234 V235 F241 H389 K392 F396	D233-H237 WeakPolarHBondContact O-CB 3.46Å; D233-H237 PolarHBondContact O-N 3.28Å; L234-H237 PolarHBondContact O-N 3.08Å; L234-H237 VanDerWaalsContact O-N 3.07Å; V235-H237 PolarHBondContact O-N 3.41Å; H237-F241 WeakPolarHBondContact O-CB 3.45Å; H237-F241 PolarHBondContact O-N 3.17Å; H237-H389 AromaticContact CE1-CE1 3.17Å; H237-H389 PolarHBondContact CE1-CE1 3.27Å; H237-H389 AromaticContact CE1-ND1 2.94Å; H237-H389 PolarHBondContact CE1-ND1 3.42Å; H237-H389 AromaticContact ND1-CE1 3.59Å; H237-H389 AromaticContact ND1-ND1 3.82Å; H237-H389 AromaticContact NE2-CE1 3.78Å; H237-H389 AromaticContact NE2-ND1 3.33Å; H237-H389 PolarHBondContact NE2-ND1 3.17Å; H237-K392 PolarHBondContact CD2-NZ 3.44Å; H237-K392 WeakPolarHBondContact CE1-CD 3.25Å; H237-K392 PolarHBondContact NE2-NZ 3.29Å; H237-F396 AromaticContact ND1-CE2 3.97Å
238	E	87.6	Confident	82.1	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-63	-48	172.2	-75.3	-61.4	135.6	0	0	112.9	L234 V235 Q240 F241 L242 T279 F282 L283 L286 H389 Y393	L234-E238 HydrophobicContact CD1-CG 4.42Å; L234-E238 PolarHBondContact O-N 3.22Å; V235-E238 PolarHBondContact O-N 2.89Å; E238-Q240 VanDerWaalsContact C-N 3.29Å; E238-Q240 PolarHBondContact O-N 3.33Å; E238-F241 PolarHBondContact O-N 3.32Å; E238-L242 WeakPolarHBondContact O-CB 3.49Å; E238-L242 PolarHBondContact O-N 3.15Å; E238-T279 WeakPolarHBondContact OE2-CG2 3.38Å; E238-F282 HydrophobicContact CG-CD1 4.03Å; E238-F282 HydrophobicContact CG-CE1 4.15Å; E238-L283 HydrophobicContact CB-CB 4.34Å; E238-L283 HydrophobicContact CB-CD1 3.82Å; E238-L286 HydrophobicContact CG-CD1 4.09Å; E238-H389 IonicContact OE1-CD2 2.76Å; E238-H389 IonicContact OE1-CE1 3.85Å; E238-H389 PolarHBondContact OE1-CE1 3.33Å; E238-H389 VanDerWaalsContact OE1-CE1 3.27Å; E238-H389 IonicContact OE1-NE2 3.29Å; E238-H389 PolarHBondContact OE1-NE2 2.94Å; E238-H389 IonicContact OE2-NE2 3.66Å; E238-Y393 WeakPolarHBondContact OE1-CE1 3.4Å; E238-Y393 PolarHBondContact OE1-OH 2.9Å; E238-Y393 PolarHBondContact OE2-OH 2.88Å
239	T	80	Confident	82.5	Confident	46 Å²	46	20.2 Å²	20.2	28%	0.282	10%	0.102	S	C	.	.	H	α-helix	trans	-58.2	-43.5	177.2	-51.2	0	0	0	0	111.6	V235 H236 L242 R243	V235-T239 PolarHBondContact O-N 2.68Å; V235-T239 PolarHBondContact O-OG1 3.09Å; H236-T239 PolarHBondContact O-N 3.33Å; T239-L242 PolarHBondContact O-N 3.4Å; T239-R243 PolarHBondContact O-N 3.48Å; T239-R243 VanDerWaalsContact O-N 3.15Å
240	Q	75.5	Confident	82.9	Confident	10 Å²	10	19.5 Å²	19.5	5%	0.047	10%	0.099	C	C	.	.	H	α-helix	trans	-67.8	-40.8	179	179.3	56.1	28.1	0	0	111.7	H236 E238 R243 E244	H236-Q240 WeakPolarHBondContact O-CB 3.39Å; H236-Q240 PolarHBondContact O-N 2.96Å; H236-Q240 VanDerWaalsContact O-N 3.08Å; E238-Q240 VanDerWaalsContact C-N 3.29Å; E238-Q240 PolarHBondContact O-N 3.33Å; Q240-R243 WeakPolarHBondContact O-CB 3.15Å; Q240-R243 PolarHBondContact O-N 3.24Å; Q240-E244 PolarHBondContact NE2-OE1 3.43Å; Q240-E244 PolarHBondContact O-N 3.28Å; Q240-E244 VanDerWaalsContact O-N 3.08Å
241	F	86.8	Confident	83	Confident	4 Å²	4	19.1 Å²	19.1	2%	0.018	10%	0.097	C	C	.	.	H	α-helix	trans	-63.8	-42.9	176.1	177.1	-119.1	0	0	0	111.9	H237 E238 R243 E244 V245 I275 T279 Y317 R385 P386 H389	H237-F241 WeakPolarHBondContact O-CB 3.45Å; H237-F241 PolarHBondContact O-N 3.17Å; E238-F241 PolarHBondContact O-N 3.32Å; F241-R243 PolarHBondContact O-N 2.79Å; F241-E244 WeakPolarHBondContact O-CB 3.21Å; F241-E244 PolarHBondContact O-N 3.03Å; F241-V245 HydrophobicContact CD1-CG2 4.31Å; F241-V245 HydrophobicContact CD2-CG2 4.17Å; F241-V245 HydrophobicContact CE1-CG2 3.86Å; F241-V245 HydrophobicContact CE2-CG2 3.7Å; F241-V245 HydrophobicContact CG-CG2 4.46Å; F241-V245 HydrophobicContact CZ-CG2 3.52Å; F241-V245 WeakPolarHBondContact O-CG2 3.38Å; F241-V245 PolarHBondContact O-N 3.43Å; F241-I275 HydrophobicContact CE1-CG2 3.94Å; F241-I275 HydrophobicContact CZ-CG2 3.85Å; F241-T279 HydrophobicContact CD1-CG2 3.62Å; F241-T279 HydrophobicContact CE1-CG2 4.1Å; F241-T279 WeakPolarHBondContact CE1-OG1 3.17Å; F241-Y317 WeakPolarHBondContact CE1-OH 3.17Å; F241-R385 HydrophobicContact CE2-CB 4.43Å; F241-P386 HydrophobicContact CE2-CB 4.2Å; F241-P386 HydrophobicContact CE2-CG 4.01Å; F241-P386 HydrophobicContact CZ-CB 3.83Å; F241-P386 HydrophobicContact CZ-CG 3.92Å; F241-H389 VanDerWaalsContact CB-CE1 3.44Å; F241-H389 WeakPolarHBondContact CB-CE1 3.3Å; F241-H389 HydrophobicContact CD1-CB 4.32Å; F241-H389 AromaticContact CD1-CD2 3.25Å; F241-H389 WeakPolarHBondContact CD1-CD2 3.42Å; F241-H389 AromaticContact CD1-CE1 3.57Å; F241-H389 AromaticContact CD1-CG 3.49Å; F241-H389 VanDerWaalsContact CD1-CG 3.49Å; F241-H389 AromaticContact CD1-ND1 3.71Å; F241-H389 AromaticContact CD1-NE2 3.3Å; F241-H389 VanDerWaalsContact CD1-NE2 3.3Å; F241-H389 WeakPolarHBondContact CD1-NE2 3.25Å; F241-H389 HydrophobicContact CD2-CB 3.84Å; F241-H389 AromaticContact CD2-CG 3.67Å; F241-H389 AromaticContact CD2-ND1 3.75Å; F241-H389 HydrophobicContact CE1-CB 4.16Å; F241-H389 AromaticContact CE1-CD2 3.36Å; F241-H389 WeakPolarHBondContact CE1-CD2 3.43Å; F241-H389 AromaticContact CE1-CG 3.69Å; F241-H389 AromaticContact CE1-NE2 3.87Å; F241-H389 HydrophobicContact CE2-CB 3.67Å; F241-H389 AromaticContact CE2-CG 3.88Å; F241-H389 HydrophobicContact CG-CB 4.17Å; F241-H389 AromaticContact CG-CD2 3.76Å; F241-H389 AromaticContact CG-CE1 3.53Å; F241-H389 AromaticContact CG-CG 3.48Å; F241-H389 VanDerWaalsContact CG-CG 3.48Å; F241-H389 AromaticContact CG-ND1 3.35Å; F241-H389 WeakPolarHBondContact CG-ND1 3.49Å; F241-H389 AromaticContact CG-NE2 3.76Å; F241-H389 HydrophobicContact CZ-CB 3.84Å; F241-H389 AromaticContact CZ-CD2 3.95Å; F241-H389 AromaticContact CZ-CG 3.88Å
242	L	86.9	Confident	83.2	Confident	20 Å²	20	19.2 Å²	19.2	11%	0.105	10%	0.097	C	C	.	.	H	α-helix	trans	-59.8	-36.3	175.6	-169.7	67.8	0	0	0	112	E238 T239 V245 N246 Y276 T279 L283	E238-L242 WeakPolarHBondContact O-CB 3.49Å; E238-L242 PolarHBondContact O-N 3.15Å; T239-L242 PolarHBondContact O-N 3.4Å; L242-V245 PolarHBondContact O-N 3.42Å; L242-N246 WeakPolarHBondContact O-CB 3.4Å; L242-N246 PolarHBondContact O-N 3.37Å; L242-N246 PolarHBondContact O-ND2 3.29Å; L242-Y276 HydrophobicContact CD1-CD2 3.51Å; L242-Y276 HydrophobicContact CD1-CE2 3.61Å; L242-Y276 HydrophobicContact CD1-CG 4.37Å; L242-Y276 HydrophobicContact CG-CD2 4.47Å; L242-Y276 HydrophobicContact CG-CE2 4.23Å; L242-T279 HydrophobicContact CB-CG2 4.02Å; L242-T279 HydrophobicContact CD1-CG2 3.88Å; L242-L283 HydrophobicContact CD2-CD2 4.06Å
243	R	83.1	Confident	83.8	Confident	33 Å²	33	18.9 Å²	18.9	13%	0.125	9%	0.094	C	C	.	.	H	α-helix	trans	-64.2	-41.9	173.4	-169.9	-178.2	-175.3	115.8	6.2	112	N165 T239 Q240 F241 N246 M247 E645 L648	N165-R243 PolarHBondContact ND2-NH2 3.28Å; N165-R243 VanDerWaalsContact OD1-CZ 3.25Å; N165-R243 PolarHBondContact OD1-NH1 3.04Å; N165-R243 PolarHBondContact OD1-NH2 2.98Å; T239-R243 PolarHBondContact O-N 3.48Å; T239-R243 VanDerWaalsContact O-N 3.15Å; Q240-R243 WeakPolarHBondContact O-CB 3.15Å; Q240-R243 PolarHBondContact O-N 3.24Å; F241-R243 PolarHBondContact O-N 2.79Å; R243-N246 PolarHBondContact O-N 2.9Å; R243-M247 PolarHBondContact O-N 2.92Å; R243-E645 IonicContact CZ-OE2 3.75Å; R243-E645 IonicContact NE-OE1 3.51Å; R243-E645 IonicContact NE-OE2 3.03Å; R243-E645 PolarHBondContact NE-OE2 3.39Å; R243-E645 IonicContact NH2-OE2 3.34Å; R243-E645 PolarHBondContact NH2-OE2 3.2Å; R243-L648 HydrophobicContact CG-CD2 3.79Å
244	E	84	Confident	84.2	Confident	18 Å²	18	19.6 Å²	19.6	8%	0.084	9%	0.092	C	C	.	.	H	α-helix	trans	-65.3	-42.9	175.6	-69.8	173.7	-164.7	0	0	111.8	Q240 F241 N246 M247 I248 R385 F447	Q240-E244 PolarHBondContact NE2-OE1 3.43Å; Q240-E244 PolarHBondContact O-N 3.28Å; Q240-E244 VanDerWaalsContact O-N 3.08Å; F241-E244 WeakPolarHBondContact O-CB 3.21Å; F241-E244 PolarHBondContact O-N 3.03Å; E244-N246 VanDerWaalsContact C-N 3.35Å; E244-N246 PolarHBondContact O-N 3.41Å; E244-M247 VanDerWaalsContact O-CB 3.3Å; E244-M247 WeakPolarHBondContact O-CB 3.43Å; E244-M247 PolarHBondContact O-N 3.34Å; E244-M247 VanDerWaalsContact O-N 3.11Å; E244-I248 WeakPolarHBondContact O-CG1 3.13Å; E244-I248 PolarHBondContact O-N 3.41Å; E244-R385 VanDerWaalsContact OE2-CD 3.27Å; E244-R385 WeakPolarHBondContact OE2-CD 3.45Å; E244-R385 IonicContact OE2-NE 3.78Å; E244-R385 IonicContact OE2-NH1 3.92Å; E244-F447 WeakPolarHBondContact OE1-CD2 3.48Å
245	V	90.1	Very high	84	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-61.5	-43.8	174.4	174.7	0	0	0	0	110.8	F241 L242 M247 I248 I249 I272 I275 Y276	F241-V245 HydrophobicContact CD1-CG2 4.31Å; F241-V245 HydrophobicContact CD2-CG2 4.17Å; F241-V245 HydrophobicContact CE1-CG2 3.86Å; F241-V245 HydrophobicContact CE2-CG2 3.7Å; F241-V245 HydrophobicContact CG-CG2 4.46Å; F241-V245 HydrophobicContact CZ-CG2 3.52Å; F241-V245 WeakPolarHBondContact O-CG2 3.38Å; F241-V245 PolarHBondContact O-N 3.43Å; L242-V245 PolarHBondContact O-N 3.42Å; V245-M247 VanDerWaalsContact C-N 3.29Å; V245-M247 PolarHBondContact O-N 3.23Å; V245-I248 WeakPolarHBondContact O-CB 3.18Å; V245-I248 PolarHBondContact O-N 3.5Å; V245-I248 VanDerWaalsContact O-N 3.14Å; V245-I249 HydrophobicContact CG1-CD1 3.75Å; V245-I249 HydrophobicContact CG1-CG1 4.39Å; V245-I249 WeakPolarHBondContact O-CG1 3.43Å; V245-I249 PolarHBondContact O-N 3.49Å; V245-I272 HydrophobicContact CG1-CD1 4.07Å; V245-I272 HydrophobicContact CG1-CG1 4.14Å; V245-I275 HydrophobicContact CG2-CG2 4.29Å; V245-Y276 HydrophobicContact CG1-CD2 4.2Å; V245-Y276 HydrophobicContact CG1-CG 4.49Å
246	N	88.4	Confident	83.9	Confident	17 Å²	17	18.4 Å²	18.4	9%	0.091	9%	0.085	C	C	.	.	H	α-helix	trans	-61.4	-36	173	-84.4	-41	0	0	0	112.6	L242 R243 E244 I249 L250 Y276 L648	L242-N246 WeakPolarHBondContact O-CB 3.4Å; L242-N246 PolarHBondContact O-N 3.37Å; L242-N246 PolarHBondContact O-ND2 3.29Å; R243-N246 PolarHBondContact O-N 2.9Å; E244-N246 VanDerWaalsContact C-N 3.35Å; E244-N246 PolarHBondContact O-N 3.41Å; N246-I249 PolarHBondContact O-N 2.98Å; N246-L250 HydrophobicContact CB-CD1 4.27Å; N246-L250 VanDerWaalsContact O-CB 3.24Å; N246-L250 WeakPolarHBondContact O-CB 3.23Å; N246-L250 PolarHBondContact O-N 3.3Å; N246-Y276 WeakPolarHBondContact OD1-CE2 3.45Å; N246-L648 HydrophobicContact CB-CD1 3.94Å
247	M	85.7	Confident	84.3	Confident	19 Å²	19	21.4 Å²	21.4	9%	0.094	10%	0.1	C	C	.	.	H	α-helix	trans	-62	-44.4	173.3	-166.4	175.5	-67.7	0	0	111	R243 E244 V245 V251 F252 L644 E645 L648	R243-M247 PolarHBondContact O-N 2.92Å; E244-M247 VanDerWaalsContact O-CB 3.3Å; E244-M247 WeakPolarHBondContact O-CB 3.43Å; E244-M247 PolarHBondContact O-N 3.34Å; E244-M247 VanDerWaalsContact O-N 3.11Å; V245-M247 VanDerWaalsContact C-N 3.29Å; V245-M247 PolarHBondContact O-N 3.23Å; M247-V251 HydrophobicContact CG-CG2 4.46Å; M247-V251 VanDerWaalsContact O-CB 3.26Å; M247-V251 WeakPolarHBondContact O-CB 3.34Å; M247-V251 PolarHBondContact O-N 3.01Å; M247-V251 VanDerWaalsContact O-N 3.14Å; M247-F252 HydrophobicContact CG-CD2 4.39Å; M247-F252 HydrophobicContact CG-CE2 4.07Å; M247-F252 WeakPolarHBondContact O-CD2 3.37Å; M247-F252 PolarHBondContact O-N 2.97Å; M247-F252 HydrophobicContact SD-CE2 4.48Å; M247-L644 HydrophobicContact CE-CB 4.48Å; M247-L644 HydrophobicContact SD-CB 4.22Å; M247-L644 HydrophobicContact SD-CD1 4.49Å; M247-E645 HydrophobicContact CE-CG 4.39Å; M247-E645 WeakPolarHBondContact CE-OE1 3.49Å; M247-L648 HydrophobicContact CB-CD2 4.2Å; M247-L648 HydrophobicContact CE-CD2 4.09Å
248	I	90.1	Very high	84.1	Confident	1 Å²	1	25 Å²	25	1%	0.005	12%	0.117	C	C	.	.	I	π-helix	trans	-61.3	-47.7	176.2	-63.2	168	0	0	0	110.5	E244 V245 F252 R253 F269 I272 L382 L383	E244-I248 WeakPolarHBondContact O-CG1 3.13Å; E244-I248 PolarHBondContact O-N 3.41Å; V245-I248 WeakPolarHBondContact O-CB 3.18Å; V245-I248 PolarHBondContact O-N 3.5Å; V245-I248 VanDerWaalsContact O-N 3.14Å; I248-F252 PolarHBondContact O-N 2.9Å; I248-R253 WeakPolarHBondContact O-CB 3.42Å; I248-R253 PolarHBondContact O-N 3.36Å; I248-F269 HydrophobicContact CG2-CD1 3.66Å; I248-F269 HydrophobicContact CG2-CE1 3.8Å; I248-I272 HydrophobicContact CG2-CG1 4.21Å; I248-L382 HydrophobicContact CD1-CB 4.32Å; I248-L382 WeakPolarHBondContact CD1-O 3.5Å; I248-L382 HydrophobicContact CG1-CB 4.2Å; I248-L383 HydrophobicContact CG2-CD2 4.04Å
249	I	88.4	Confident	83.6	Confident	26 Å²	26	27.7 Å²	27.7	13%	0.133	13%	0.128	C	C	.	.	I	π-helix	trans	-73.2	-54.5	-175.4	-64.7	172.6	0	0	0	112	V245 N246 R253 R254 I272 Y276	V245-I249 HydrophobicContact CG1-CD1 3.75Å; V245-I249 HydrophobicContact CG1-CG1 4.39Å; V245-I249 WeakPolarHBondContact O-CG1 3.43Å; V245-I249 PolarHBondContact O-N 3.49Å; N246-I249 PolarHBondContact O-N 2.98Å; I249-R253 WeakPolarHBondContact O-CB 3.48Å; I249-R254 PolarHBondContact O-N 3.35Å; I249-R254 VanDerWaalsContact O-N 3.15Å; I249-I272 HydrophobicContact CD1-CG1 4.24Å; I249-I272 HydrophobicContact CD1-CG2 4.4Å; I249-I272 HydrophobicContact CG1-CG1 4.01Å; I249-I272 HydrophobicContact CG1-CG2 3.97Å; I249-Y276 HydrophobicContact CD1-CD2 4.44Å; I249-Y276 HydrophobicContact CD1-CG 4.22Å
250	L	84.2	Confident	83.6	Confident	20 Å²	20	26.3 Å²	26.3	11%	0.105	12%	0.122	C	C	.	.	I	π-helix	trans	-84.9	-22.5	-167.7	-59.8	176.2	0	0	0	113.6	N246 R254 L648 C651 L652	N246-L250 HydrophobicContact CB-CD1 4.27Å; N246-L250 VanDerWaalsContact O-CB 3.24Å; N246-L250 WeakPolarHBondContact O-CB 3.23Å; N246-L250 PolarHBondContact O-N 3.3Å; L250-R254 WeakPolarHBondContact O-CB 3.23Å; L250-L648 HydrophobicContact CB-CD1 4.38Å; L250-L648 HydrophobicContact CD1-CD1 4.15Å; L250-C651 HydrophobicContact CB-CB 3.86Å; L250-C651 HydrophobicContact CD1-CB 4.04Å; L250-C651 HydrophobicContact CG-CB 4.48Å; L250-C651 PolarHBondContact O-SG 3.4Å; L250-L652 HydrophobicContact CD1-CD2 3.69Å; L250-L652 HydrophobicContact CD1-CG 4.31Å
251	V	82.3	Confident	83.9	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.151	C	C	.	.	I	π-helix	trans	-107.4	-51.2	-178.8	-176.5	0	0	0	0	111.6	M247 Y371 L644 M647 L648	M247-V251 HydrophobicContact CG-CG2 4.46Å; M247-V251 VanDerWaalsContact O-CB 3.26Å; M247-V251 WeakPolarHBondContact O-CB 3.34Å; M247-V251 PolarHBondContact O-N 3.01Å; M247-V251 VanDerWaalsContact O-N 3.14Å; V251-Y371 HydrophobicContact CG1-CE2 4.07Å; V251-Y371 PolarHBondContact O-OH 3.28Å; V251-L644 HydrophobicContact CG1-CD2 4.07Å; V251-M647 HydrophobicContact CG1-CB 4.39Å; V251-M647 HydrophobicContact CG1-CE 3.9Å; V251-M647 HydrophobicContact CG1-SD 4.29Å; V251-M647 HydrophobicContact CG2-CB 4.33Å; V251-L648 HydrophobicContact CG2-CB 3.98Å; V251-L648 HydrophobicContact CG2-CD1 4.46Å
252	F	87.8	Confident	83.7	Confident	1 Å²	1	39.4 Å²	39.4	0%	0.004	18%	0.183	C	C	.	.	I	π-helix	trans	-86.1	-51.4	-175.8	-69.4	-81.6	0	0	0	113.1	M247 I248 R254 S255 M256 F269 Y371 V375 L379 L382 L644	M247-F252 HydrophobicContact CG-CD2 4.39Å; M247-F252 HydrophobicContact CG-CE2 4.07Å; M247-F252 WeakPolarHBondContact O-CD2 3.37Å; M247-F252 PolarHBondContact O-N 2.97Å; M247-F252 HydrophobicContact SD-CE2 4.48Å; I248-F252 PolarHBondContact O-N 2.9Å; F252-R254 PolarHBondContact O-N 3.41Å; F252-S255 PolarHBondContact O-N 3.06Å; F252-S255 PolarHBondContact O-OG 3.39Å; F252-M256 WeakPolarHBondContact O-CG 3.28Å; F252-M256 PolarHBondContact O-N 2.85Å; F252-F269 HydrophobicContact CB-CE1 4.33Å; F252-F269 HydrophobicContact CB-CZ 4.41Å; F252-Y371 HydrophobicContact CE1-CE2 4.4Å; F252-V375 HydrophobicContact CD1-CG2 4.09Å; F252-V375 HydrophobicContact CE1-CG2 4.17Å; F252-L379 HydrophobicContact CB-CD1 3.81Å; F252-L379 HydrophobicContact CB-CD2 4.36Å; F252-L379 HydrophobicContact CD1-CB 4.1Å; F252-L379 HydrophobicContact CD1-CD1 4.09Å; F252-L379 HydrophobicContact CD1-CD2 4.25Å; F252-L379 HydrophobicContact CD1-CG 4.38Å; F252-L379 HydrophobicContact CD2-CD1 4.31Å; F252-L379 HydrophobicContact CE1-CB 4.22Å; F252-L379 HydrophobicContact CG-CD1 3.83Å; F252-L382 HydrophobicContact CD2-CD1 4.15Å; F252-L382 HydrophobicContact CE2-CD1 3.44Å; F252-L382 VanDerWaalsContact CE2-CD1 3.44Å; F252-L382 HydrophobicContact CZ-CD1 3.9Å; F252-L644 HydrophobicContact CE2-CD2 4.4Å; F252-L644 HydrophobicContact CZ-CD1 4.13Å; F252-L644 HydrophobicContact CZ-CD2 4.01Å
253	R	89.1	Confident	83.7	Confident	44 Å²	44	42.7 Å²	42.7	17%	0.166	20%	0.204	C	C	.	.	I	π-helix	trans	-65	-43.7	-179.4	-173.1	-178.9	179.6	-103.5	-4.7	111.3	I248 I249 S255 M256 M257 F269	I248-R253 WeakPolarHBondContact O-CB 3.42Å; I248-R253 PolarHBondContact O-N 3.36Å; I249-R253 WeakPolarHBondContact O-CB 3.48Å; R253-S255 PolarHBondContact O-N 2.89Å; R253-M256 PolarHBondContact O-N 3.39Å; R253-M256 VanDerWaalsContact O-N 3.13Å; R253-M257 HydrophobicContact CG-CE 4.06Å; R253-M257 WeakPolarHBondContact O-CG 3.32Å; R253-M257 PolarHBondContact O-N 3.26Å; R253-F269 VanDerWaalsContact CA-CZ 3.46Å; R253-F269 HydrophobicContact CB-CD1 3.98Å; R253-F269 HydrophobicContact CB-CD2 4.06Å; R253-F269 HydrophobicContact CB-CE1 3.8Å; R253-F269 HydrophobicContact CB-CE2 3.9Å; R253-F269 HydrophobicContact CB-CG 4.1Å; R253-F269 HydrophobicContact CB-CZ 3.77Å; R253-F269 HydrophobicContact CG-CD1 4.31Å; R253-F269 HydrophobicContact CG-CD2 3.67Å; R253-F269 HydrophobicContact CG-CE1 4.47Å; R253-F269 HydrophobicContact CG-CE2 3.87Å; R253-F269 HydrophobicContact CG-CG 3.92Å; R253-F269 HydrophobicContact CG-CZ 4.27Å
254	R	82.5	Confident	83.9	Confident	82 Å²	82	44 Å²	44	31%	0.309	21%	0.213	S	C	.	.	H	α-helix	trans	-57.4	-33.9	175.6	-169.1	175.7	-178	-178.5	-2.5	112.5	I249 L250 F252 E654	I249-R254 PolarHBondContact O-N 3.35Å; I249-R254 VanDerWaalsContact O-N 3.15Å; L250-R254 WeakPolarHBondContact O-CB 3.23Å; F252-R254 PolarHBondContact O-N 3.41Å; R254-E654 IonicContact CZ-OE2 2.92Å; R254-E654 IonicContact NH1-OE2 3.85Å; R254-E654 PolarHBondContact NH1-OE2 2.95Å; R254-E654 IonicContact NH2-OE2 3.5Å
255	S	78.4	Confident	84.1	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-72.2	-37.1	177.3	76.6	0	0	0	0	113	F252 R253 F259 Y350 Y371	F252-S255 PolarHBondContact O-N 3.06Å; F252-S255 PolarHBondContact O-OG 3.39Å; R253-S255 PolarHBondContact O-N 2.89Å; S255-F259 WeakPolarHBondContact O-CD1 3.13Å; S255-F259 WeakPolarHBondContact O-CE1 3.46Å; S255-Y350 VanDerWaalsContact CA-OH 3.3Å; S255-Y350 WeakPolarHBondContact CA-OH 3.47Å; S255-Y350 VanDerWaalsContact CB-CE1 3.4Å; S255-Y350 WeakPolarHBondContact CB-OH 3.31Å; S255-Y350 PolarHBondContact N-OH 3.46Å; S255-Y371 VanDerWaalsContact CB-OH 3.23Å; S255-Y371 WeakPolarHBondContact CB-OH 3.29Å; S255-Y371 PolarHBondContact OG-OH 3.45Å
256	M	81.6	Confident	84.1	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-74.1	-25.5	179.2	-60.2	-166.7	76.1	0	0	113.4	F252 R253 E258 F259 A260 L265 I268 F269 L333 A336 L379	F252-M256 WeakPolarHBondContact O-CG 3.28Å; F252-M256 PolarHBondContact O-N 2.85Å; R253-M256 PolarHBondContact O-N 3.39Å; R253-M256 VanDerWaalsContact O-N 3.13Å; M256-E258 PolarHBondContact O-N 3.24Å; M256-E258 VanDerWaalsContact O-N 3.14Å; M256-F259 HydrophobicContact CB-CE1 4.46Å; M256-F259 HydrophobicContact CB-CE2 4.29Å; M256-F259 HydrophobicContact CB-CZ 3.97Å; M256-F259 HydrophobicContact CE-CE2 3.96Å; M256-F259 HydrophobicContact CE-CZ 4.16Å; M256-F259 HydrophobicContact CG-CE1 4.47Å; M256-F259 HydrophobicContact CG-CE2 4.33Å; M256-F259 HydrophobicContact CG-CZ 3.76Å; M256-F259 PolarHBondContact O-N 3.1Å; M256-F259 VanDerWaalsContact O-N 3.12Å; M256-A260 WeakPolarHBondContact O-CB 3.3Å; M256-A260 PolarHBondContact O-N 3.46Å; M256-L265 HydrophobicContact CB-CD2 3.55Å; M256-I268 HydrophobicContact CE-CD1 3.66Å; M256-I268 HydrophobicContact SD-CD1 4.3Å; M256-F269 HydrophobicContact CB-CE2 4.34Å; M256-F269 HydrophobicContact CG-CE2 4.4Å; M256-F269 HydrophobicContact CG-CZ 4.43Å; M256-F269 HydrophobicContact SD-CE2 3.74Å; M256-F269 HydrophobicContact SD-CZ 3.75Å; M256-L333 HydrophobicContact CE-CD1 3.81Å; M256-L333 HydrophobicContact SD-CD1 4.25Å; M256-A336 HydrophobicContact CE-CB 4.34Å; M256-L379 HydrophobicContact SD-CD2 4.15Å
257	M	81.1	Confident	84.2	Confident	88 Å²	88	47.3 Å²	47.3	43%	0.433	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-25.3	175.6	-74.6	177.7	-171.8	0	0	114.2	R253 F259 L265	R253-M257 HydrophobicContact CG-CE 4.06Å; R253-M257 WeakPolarHBondContact O-CG 3.32Å; R253-M257 PolarHBondContact O-N 3.26Å; M257-F259 PolarHBondContact O-N 3.32Å; M257-L265 HydrophobicContact CB-CD1 4.38Å; M257-L265 HydrophobicContact CG-CD1 3.74Å
258	E	73.1	Confident	84.4	Confident	97 Å²	97	46.4 Å²	46.4	45%	0.453	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-15.5	-179.5	-65.2	-172.2	-160.6	0	0	113.1	M256 H345	M256-E258 PolarHBondContact O-N 3.24Å; M256-E258 VanDerWaalsContact O-N 3.14Å; E258-H345 IonicContact OE2-CE1 2.78Å; E258-H345 PolarHBondContact OE2-CE1 3.27Å; E258-H345 IonicContact OE2-NE2 3.36Å; E258-H345 PolarHBondContact OE2-NE2 3.28Å
259	F	77	Confident	84.5	Confident	55 Å²	55	46.4 Å²	46.4	24%	0.241	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-142.4	-16.9	-173.3	59.8	-99.5	0	0	0	116.3	S255 M256 M257 V342 L346	S255-F259 WeakPolarHBondContact O-CD1 3.13Å; S255-F259 WeakPolarHBondContact O-CE1 3.46Å; M256-F259 HydrophobicContact CB-CE1 4.46Å; M256-F259 HydrophobicContact CB-CE2 4.29Å; M256-F259 HydrophobicContact CB-CZ 3.97Å; M256-F259 HydrophobicContact CE-CE2 3.96Å; M256-F259 HydrophobicContact CE-CZ 4.16Å; M256-F259 HydrophobicContact CG-CE1 4.47Å; M256-F259 HydrophobicContact CG-CE2 4.33Å; M256-F259 HydrophobicContact CG-CZ 3.76Å; M256-F259 PolarHBondContact O-N 3.1Å; M256-F259 VanDerWaalsContact O-N 3.12Å; M257-F259 PolarHBondContact O-N 3.32Å; F259-V342 HydrophobicContact CB-CG2 4.19Å; F259-V342 HydrophobicContact CD1-CG1 4.45Å; F259-V342 HydrophobicContact CD2-CB 4.33Å; F259-V342 HydrophobicContact CD2-CG1 3.85Å; F259-V342 HydrophobicContact CD2-CG2 3.51Å; F259-V342 HydrophobicContact CE1-CG1 4.07Å; F259-V342 HydrophobicContact CE2-CB 4.36Å; F259-V342 HydrophobicContact CE2-CG1 3.43Å; F259-V342 VanDerWaalsContact CE2-CG1 3.43Å; F259-V342 HydrophobicContact CE2-CG2 3.98Å; F259-V342 HydrophobicContact CG-CG1 4.34Å; F259-V342 HydrophobicContact CG-CG2 3.88Å; F259-V342 HydrophobicContact CZ-CG1 3.52Å; F259-L346 HydrophobicContact CE1-CD2 4.13Å; F259-L346 HydrophobicContact CZ-CD1 4.42Å; F259-L346 HydrophobicContact CZ-CD2 4.4Å
260	A	78.5	Confident	84.8	Confident	17 Å²	17	45.8 Å²	45.8	14%	0.14	23%	0.227	C	C	.	.	S	Bend	trans	-99.1	142.8	177.2	0	0	0	0	0	110.9	M256 D264 L265	M256-A260 WeakPolarHBondContact O-CB 3.3Å; M256-A260 PolarHBondContact O-N 3.46Å; A260-D264 HydrophobicContact CB-CB 4.3Å; A260-L265 HydrophobicContact CB-CD2 3.89Å; A260-L265 HydrophobicContact CB-CG 4.04Å
261	E	82.4	Confident	85.2	Confident	144 Å²	144	45.3 Å²	45.3	67%	0.673	23%	0.225	S	C	*	.			trans	-69.1	156.6	172.6	-65.1	-174.4	179.3	0	0	110.7	V263 D264 L265	E261-V263 PolarHBondContact O-N 3.48Å; E261-V263 VanDerWaalsContact O-N 3.16Å; E261-D264 PolarHBondContact O-N 3.24Å; E261-L265 WeakPolarHBondContact O-CG 3.23Å; E261-L265 PolarHBondContact O-N 3.47Å
262	E	83.5	Confident	85.7	Confident	145 Å²	145	45.3 Å²	45.3	68%	0.678	23%	0.225	S	C	*	.	H	α-helix	trans	-55.5	-36	-179.3	-168.7	171.4	-161.6	0	0	112.3	D264 L265 D266	E262-D264 PolarHBondContact O-N 2.59Å; E262-L265 PolarHBondContact O-N 2.92Å; E262-D266 WeakPolarHBondContact O-CB 3.34Å; E262-D266 VanDerWaalsContact O-CG 3.3Å; E262-D266 PolarHBondContact O-N 2.81Å
263	V	87	Confident	85.9	Confident	90 Å²	90	47.6 Å²	47.6	55%	0.545	24%	0.241	S	C	.	.	H	α-helix	trans	-63.8	-39.1	176.7	-176.9	0	0	0	0	112.4	E261 A267	E261-V263 PolarHBondContact O-N 3.48Å; E261-V263 VanDerWaalsContact O-N 3.16Å; V263-A267 WeakPolarHBondContact O-CB 3.33Å; V263-A267 PolarHBondContact O-N 2.91Å
264	D	87.2	Confident	86.2	Confident	60 Å²	60	48.7 Å²	48.7	32%	0.321	25%	0.25	S	S	.	.	H	α-helix	trans	-73.9	-38	178.1	-71.9	-25.1	0	0	0	110.8	A260 E261 E262 A267 I268 V332	A260-D264 HydrophobicContact CB-CB 4.3Å; E261-D264 PolarHBondContact O-N 3.24Å; E262-D264 PolarHBondContact O-N 2.59Å; D264-A267 PolarHBondContact O-N 3.31Å; D264-I268 VanDerWaalsContact O-CG1 3.31Å; D264-I268 WeakPolarHBondContact O-CG1 3.35Å; D264-I268 PolarHBondContact O-N 3.39Å; D264-V332 HydrophobicContact CB-CG1 3.83Å
265	L	88.1	Confident	86.7	Confident	8 Å²	8	44.8 Å²	44.8	4%	0.042	24%	0.235	C	C	.	.	H	α-helix	trans	-62.6	-42.9	173.8	-66.5	174.1	0	0	0	111.5	M256 M257 A260 E261 E262 A267 I268 F269	M256-L265 HydrophobicContact CB-CD2 3.55Å; M257-L265 HydrophobicContact CB-CD1 4.38Å; M257-L265 HydrophobicContact CG-CD1 3.74Å; A260-L265 HydrophobicContact CB-CD2 3.89Å; A260-L265 HydrophobicContact CB-CG 4.04Å; E261-L265 WeakPolarHBondContact O-CG 3.23Å; E261-L265 PolarHBondContact O-N 3.47Å; E262-L265 PolarHBondContact O-N 2.92Å; L265-A267 VanDerWaalsContact C-N 3.31Å; L265-A267 PolarHBondContact O-N 3.47Å; L265-I268 PolarHBondContact O-N 3.44Å; L265-F269 HydrophobicContact CD2-CD2 4.26Å; L265-F269 HydrophobicContact CD2-CE2 4.06Å; L265-F269 WeakPolarHBondContact O-CB 3.16Å; L265-F269 WeakPolarHBondContact O-CD2 3.39Å; L265-F269 PolarHBondContact O-N 3.36Å
266	D	89.8	Confident	87.4	Confident	78 Å²	78	47.7 Å²	47.7	42%	0.417	25%	0.247	S	C	.	.	H	α-helix	trans	-66.7	-34.3	176.7	-74.4	-8.2	0	0	0	111.5	E262 I268 S270	E262-D266 WeakPolarHBondContact O-CB 3.34Å; E262-D266 VanDerWaalsContact O-CG 3.3Å; E262-D266 PolarHBondContact O-N 2.81Å; D266-I268 VanDerWaalsContact C-N 3.34Å; D266-I268 PolarHBondContact O-N 3.01Å; D266-S270 WeakPolarHBondContact O-CA 3.4Å; D266-S270 PolarHBondContact O-N 3.32Å
267	A	90.3	Very high	87.9	Confident	18 Å²	18	53.9 Å²	53.9	15%	0.149	28%	0.276	C	S	.	.	H	α-helix	trans	-67.8	-31.3	174.4	0	0	0	0	0	113.4	V263 D264 L265 V332	V263-A267 WeakPolarHBondContact O-CB 3.33Å; V263-A267 PolarHBondContact O-N 2.91Å; D264-A267 PolarHBondContact O-N 3.31Å; L265-A267 VanDerWaalsContact C-N 3.31Å; L265-A267 PolarHBondContact O-N 3.47Å; A267-V332 HydrophobicContact CB-CG1 4.43Å; A267-V332 HydrophobicContact CB-CG2 4.22Å
268	I	90.3	Very high	88.5	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-87.4	-45.3	-179.6	-65	167.7	0	0	0	111.7	M256 D264 L265 D266 V332 L333 L383	M256-I268 HydrophobicContact CE-CD1 3.66Å; M256-I268 HydrophobicContact SD-CD1 4.3Å; D264-I268 VanDerWaalsContact O-CG1 3.31Å; D264-I268 WeakPolarHBondContact O-CG1 3.35Å; D264-I268 PolarHBondContact O-N 3.39Å; L265-I268 PolarHBondContact O-N 3.44Å; D266-I268 VanDerWaalsContact C-N 3.34Å; D266-I268 PolarHBondContact O-N 3.01Å; I268-V332 HydrophobicContact CD1-CG1 4.03Å; I268-V332 HydrophobicContact CG1-CB 4.37Å; I268-V332 HydrophobicContact CG1-CG1 4Å; I268-L333 HydrophobicContact CD1-CB 4.28Å; I268-L333 HydrophobicContact CD1-CD1 4.28Å; I268-L333 HydrophobicContact CG1-CB 4.38Å; I268-L383 HydrophobicContact CG2-CD1 3.98Å
269	F	92.8	Very high	89.4	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-103.8	-11.9	-170.9	-62.8	-79.8	0	0	0	113.5	I248 F252 R253 M256 L265 I272 Y320 L379 L383	I248-F269 HydrophobicContact CG2-CD1 3.66Å; I248-F269 HydrophobicContact CG2-CE1 3.8Å; F252-F269 HydrophobicContact CB-CE1 4.33Å; F252-F269 HydrophobicContact CB-CZ 4.41Å; R253-F269 VanDerWaalsContact CA-CZ 3.46Å; R253-F269 HydrophobicContact CB-CD1 3.98Å; R253-F269 HydrophobicContact CB-CD2 4.06Å; R253-F269 HydrophobicContact CB-CE1 3.8Å; R253-F269 HydrophobicContact CB-CE2 3.9Å; R253-F269 HydrophobicContact CB-CG 4.1Å; R253-F269 HydrophobicContact CB-CZ 3.77Å; R253-F269 HydrophobicContact CG-CD1 4.31Å; R253-F269 HydrophobicContact CG-CD2 3.67Å; R253-F269 HydrophobicContact CG-CE1 4.47Å; R253-F269 HydrophobicContact CG-CE2 3.87Å; R253-F269 HydrophobicContact CG-CG 3.92Å; R253-F269 HydrophobicContact CG-CZ 4.27Å; M256-F269 HydrophobicContact CB-CE2 4.34Å; M256-F269 HydrophobicContact CG-CE2 4.4Å; M256-F269 HydrophobicContact CG-CZ 4.43Å; M256-F269 HydrophobicContact SD-CE2 3.74Å; M256-F269 HydrophobicContact SD-CZ 3.75Å; L265-F269 HydrophobicContact CD2-CD2 4.26Å; L265-F269 HydrophobicContact CD2-CE2 4.06Å; L265-F269 WeakPolarHBondContact O-CB 3.16Å; L265-F269 WeakPolarHBondContact O-CD2 3.39Å; L265-F269 PolarHBondContact O-N 3.36Å; F269-I272 HydrophobicContact CB-CG2 4Å; F269-I272 VanDerWaalsContact O-CB 3.32Å; F269-I272 WeakPolarHBondContact O-CB 2.85Å; F269-I272 PolarHBondContact O-N 3.25Å; F269-Y320 WeakPolarHBondContact O-CE2 3.38Å; F269-L379 HydrophobicContact CE1-CD1 4.07Å; F269-L379 HydrophobicContact CE1-CD2 4.46Å; F269-L379 HydrophobicContact CZ-CD2 4.2Å; F269-L383 HydrophobicContact CD1-CD2 3.86Å; F269-L383 HydrophobicContact CE1-CD2 4.2Å
270	S	93.1	Very high	89.9	Confident	13 Å²	13	43.4 Å²	43.4	9%	0.091	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.3	-142	-179.8	-176.3	0	0	0	0	111.5	D266 I272 D323	D266-S270 WeakPolarHBondContact O-CA 3.4Å; D266-S270 PolarHBondContact O-N 3.32Å; S270-I272 VanDerWaalsContact C-N 3.26Å; S270-I272 PolarHBondContact O-N 3.46Å; S270-D323 WeakPolarHBondContact CB-OD2 3.32Å; S270-D323 WeakPolarHBondContact OG-CB 3.16Å; S270-D323 PolarHBondContact OG-OD2 3.32Å
271	N	93.8	Very high	90.4	Very high	10 Å²	10	46.4 Å²	46.4	5%	0.053	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	42.6	178.4	68.5	-46.6	0	0	0	113.3	S273 D274 I275 V316 K319 Y320	N271-S273 PolarHBondContact O-N 3.33Å; N271-D274 HydrophobicContact CB-CB 4.28Å; N271-D274 WeakPolarHBondContact CB-OD2 3.34Å; N271-D274 WeakPolarHBondContact O-CB 3.42Å; N271-D274 PolarHBondContact O-N 3.44Å; N271-I275 PolarHBondContact O-N 3.43Å; N271-V316 PolarHBondContact ND2-O 2.99Å; N271-K319 HydrophobicContact CB-CD 4.09Å; N271-Y320 VanDerWaalsContact OD1-CA 3.25Å; N271-Y320 WeakPolarHBondContact OD1-CA 3.41Å; N271-Y320 VanDerWaalsContact OD1-CB 3.3Å; N271-Y320 WeakPolarHBondContact OD1-CB 3.35Å; N271-Y320 PolarHBondContact OD1-N 3.49Å; N271-Y320 VanDerWaalsContact OD1-N 3.1Å
272	I	93.4	Very high	90.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-58.3	-29.4	179	-167.6	61.5	0	0	0	113.2	V245 I248 I249 F269 S270 I275 Y276 Y320 P386	V245-I272 HydrophobicContact CG1-CD1 4.07Å; V245-I272 HydrophobicContact CG1-CG1 4.14Å; I248-I272 HydrophobicContact CG2-CG1 4.21Å; I249-I272 HydrophobicContact CD1-CG1 4.24Å; I249-I272 HydrophobicContact CD1-CG2 4.4Å; I249-I272 HydrophobicContact CG1-CG1 4.01Å; I249-I272 HydrophobicContact CG1-CG2 3.97Å; F269-I272 HydrophobicContact CB-CG2 4Å; F269-I272 VanDerWaalsContact O-CB 3.32Å; F269-I272 WeakPolarHBondContact O-CB 2.85Å; F269-I272 PolarHBondContact O-N 3.25Å; S270-I272 VanDerWaalsContact C-N 3.26Å; S270-I272 PolarHBondContact O-N 3.46Å; I272-I275 HydrophobicContact CD1-CB 4.41Å; I272-I275 HydrophobicContact CD1-CD1 4.23Å; I272-I275 PolarHBondContact O-N 3.13Å; I272-Y276 PolarHBondContact O-N 2.97Å; I272-Y320 HydrophobicContact CB-CE2 4.04Å; I272-Y320 HydrophobicContact CD1-CE2 3.8Å; I272-Y320 HydrophobicContact CG1-CE2 4.47Å; I272-P386 HydrophobicContact CD1-CG 3.96Å
273	S	91.4	Very high	91.1	Very high	49 Å²	49	33.1 Å²	33.1	34%	0.343	18%	0.177	S	C	.	.	H	α-helix	trans	-63.8	-39.6	175.1	-57.1	0	0	0	0	111.9	N271 I275 Y276 E277	N271-S273 PolarHBondContact O-N 3.33Å; S273-I275 VanDerWaalsContact C-N 3.33Å; S273-I275 PolarHBondContact O-N 3.41Å; S273-Y276 WeakPolarHBondContact O-CB 3.42Å; S273-Y276 PolarHBondContact O-N 3.28Å; S273-E277 PolarHBondContact O-N 3.25Å
274	D	94	Very high	90.9	Very high	67 Å²	67	29.6 Å²	29.6	36%	0.358	16%	0.156	S	C	.	.	H	α-helix	trans	-68.3	-36.3	178.1	-55.9	-10.1	0	0	0	110.6	N271 Y276 E277 C278 V316	N271-D274 HydrophobicContact CB-CB 4.28Å; N271-D274 WeakPolarHBondContact CB-OD2 3.34Å; N271-D274 WeakPolarHBondContact O-CB 3.42Å; N271-D274 PolarHBondContact O-N 3.44Å; D274-Y276 VanDerWaalsContact C-N 3.34Å; D274-E277 PolarHBondContact O-N 2.88Å; D274-C278 VanDerWaalsContact O-CB 3.29Å; D274-C278 WeakPolarHBondContact O-CB 3.38Å; D274-C278 PolarHBondContact O-N 3.08Å; D274-V316 HydrophobicContact CB-CB 4.17Å; D274-V316 HydrophobicContact CB-CG1 3.98Å
275	I	94.8	Very high	90.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63	-42.1	172.5	-69.9	164.5	0	0	0	110.7	F241 V245 N271 I272 S273 C278 T279 V316 Y317 Y320 P386	F241-I275 HydrophobicContact CE1-CG2 3.94Å; F241-I275 HydrophobicContact CZ-CG2 3.85Å; V245-I275 HydrophobicContact CG2-CG2 4.29Å; N271-I275 PolarHBondContact O-N 3.43Å; I272-I275 HydrophobicContact CD1-CB 4.41Å; I272-I275 HydrophobicContact CD1-CD1 4.23Å; I272-I275 PolarHBondContact O-N 3.13Å; S273-I275 VanDerWaalsContact C-N 3.33Å; S273-I275 PolarHBondContact O-N 3.41Å; I275-C278 PolarHBondContact O-N 3.05Å; I275-T279 VanDerWaalsContact O-CB 3.25Å; I275-T279 WeakPolarHBondContact O-CB 3.37Å; I275-T279 PolarHBondContact O-N 3.26Å; I275-T279 PolarHBondContact O-OG1 3.23Å; I275-V316 HydrophobicContact CG1-CG2 4.19Å; I275-Y317 HydrophobicContact CD1-CD1 4.42Å; I275-Y317 HydrophobicContact CG1-CD1 4.44Å; I275-Y317 HydrophobicContact CG1-CE1 4.35Å; I275-Y317 HydrophobicContact CG2-CE1 4.17Å; I275-Y320 HydrophobicContact CD1-CD1 3.72Å; I275-Y320 HydrophobicContact CD1-CD2 3.33Å; I275-Y320 HydrophobicContact CD1-CE1 4.21Å; I275-Y320 HydrophobicContact CD1-CE2 3.87Å; I275-Y320 HydrophobicContact CD1-CG 3.23Å; I275-P386 HydrophobicContact CD1-CB 3.84Å; I275-P386 HydrophobicContact CD1-CG 4.26Å; I275-P386 HydrophobicContact CG2-CB 4.38Å
276	Y	93.1	Very high	90.7	Very high	61 Å²	61	28.9 Å²	28.9	24%	0.239	15%	0.15	C	C	.	.	H	α-helix	trans	-59.4	-46.8	175.3	171.3	-92.8	0	0	0	111.5	L242 V245 N246 I249 I272 S273 D274 T279 S280	L242-Y276 HydrophobicContact CD1-CD2 3.51Å; L242-Y276 HydrophobicContact CD1-CE2 3.61Å; L242-Y276 HydrophobicContact CD1-CG 4.37Å; L242-Y276 HydrophobicContact CG-CD2 4.47Å; L242-Y276 HydrophobicContact CG-CE2 4.23Å; V245-Y276 HydrophobicContact CG1-CD2 4.2Å; V245-Y276 HydrophobicContact CG1-CG 4.49Å; N246-Y276 WeakPolarHBondContact OD1-CE2 3.45Å; I249-Y276 HydrophobicContact CD1-CD2 4.44Å; I249-Y276 HydrophobicContact CD1-CG 4.22Å; I272-Y276 PolarHBondContact O-N 2.97Å; S273-Y276 WeakPolarHBondContact O-CB 3.42Å; S273-Y276 PolarHBondContact O-N 3.28Å; D274-Y276 VanDerWaalsContact C-N 3.34Å; Y276-T279 PolarHBondContact O-N 2.96Å; Y276-S280 VanDerWaalsContact O-CB 3.26Å; Y276-S280 WeakPolarHBondContact O-CB 3.3Å; Y276-S280 PolarHBondContact O-N 3.17Å
277	E	90.9	Very high	90.3	Very high	130 Å²	130	28.9 Å²	28.9	61%	0.607	15%	0.147	S	C	*	.	H	α-helix	trans	-64	-46.6	178.9	-70	-174	178.8	0	0	111.9	S273 D274 T279 S280 K281	S273-E277 PolarHBondContact O-N 3.25Å; D274-E277 PolarHBondContact O-N 2.88Å; E277-T279 PolarHBondContact O-N 3.42Å; E277-S280 PolarHBondContact O-N 3.33Å; E277-K281 VanDerWaalsContact O-CB 3.27Å; E277-K281 WeakPolarHBondContact O-CB 3.32Å; E277-K281 PolarHBondContact O-N 3.46Å
278	C	93.4	Very high	89.6	Confident	3 Å²	3	29.4 Å²	29.4	2%	0.02	15%	0.148	C	C	.	.	H	α-helix	trans	-58.4	-49.1	176.2	178.5	0	0	0	0	111.7	D274 I275 K281 F282 M308 E313 V316	D274-C278 VanDerWaalsContact O-CB 3.29Å; D274-C278 WeakPolarHBondContact O-CB 3.38Å; D274-C278 PolarHBondContact O-N 3.08Å; I275-C278 PolarHBondContact O-N 3.05Å; C278-K281 PolarHBondContact O-N 2.96Å; C278-F282 PolarHBondContact O-N 3.27Å; C278-M308 WeakPolarHBondContact O-CE 3.24Å; C278-M308 VanDerWaalsContact SG-CE 3.58Å; C278-E313 PolarHBondContact SG-O 3.4Å; C278-V316 HydrophobicContact CB-CG2 4.05Å
279	T	92.9	Very high	89.1	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.4	-46.1	178.4	-54.2	0	0	0	0	111.4	E238 F241 L242 I275 Y276 E277 K281 F282 L283	E238-T279 WeakPolarHBondContact OE2-CG2 3.38Å; F241-T279 HydrophobicContact CD1-CG2 3.62Å; F241-T279 HydrophobicContact CE1-CG2 4.1Å; F241-T279 WeakPolarHBondContact CE1-OG1 3.17Å; L242-T279 HydrophobicContact CB-CG2 4.02Å; L242-T279 HydrophobicContact CD1-CG2 3.88Å; I275-T279 VanDerWaalsContact O-CB 3.25Å; I275-T279 WeakPolarHBondContact O-CB 3.37Å; I275-T279 PolarHBondContact O-N 3.26Å; I275-T279 PolarHBondContact O-OG1 3.23Å; Y276-T279 PolarHBondContact O-N 2.96Å; E277-T279 PolarHBondContact O-N 3.42Å; T279-K281 VanDerWaalsContact C-N 3.28Å; T279-K281 PolarHBondContact O-N 3.05Å; T279-F282 PolarHBondContact O-N 3.49Å; T279-L283 WeakPolarHBondContact O-CB 3.47Å; T279-L283 PolarHBondContact O-N 3.32Å
280	S	88.2	Confident	88.4	Confident	18 Å²	18	32 Å²	32	13%	0.126	16%	0.164	C	C	.	.	H	α-helix	trans	-63.6	-35.3	178.2	-175.7	0	0	0	0	111.7	Y276 E277 S284	Y276-S280 VanDerWaalsContact O-CB 3.26Å; Y276-S280 WeakPolarHBondContact O-CB 3.3Å; Y276-S280 PolarHBondContact O-N 3.17Å; E277-S280 PolarHBondContact O-N 3.33Å; S280-S284 VanDerWaalsContact O-CB 3.25Å; S280-S284 WeakPolarHBondContact O-CB 3.37Å; S280-S284 PolarHBondContact O-N 3.22Å; S280-S284 PolarHBondContact O-OG 3.19Å
281	K	88.9	Confident	87.3	Confident	80 Å²	80	34 Å²	34	35%	0.348	17%	0.171	S	C	.	.	H	α-helix	trans	-70.5	-44.4	176.3	-176.7	178.5	177	177.5	0	111.5	E277 C278 T279 S284 F285 M308 E313	E277-K281 VanDerWaalsContact O-CB 3.27Å; E277-K281 WeakPolarHBondContact O-CB 3.32Å; E277-K281 PolarHBondContact O-N 3.46Å; C278-K281 PolarHBondContact O-N 2.96Å; T279-K281 VanDerWaalsContact C-N 3.28Å; T279-K281 PolarHBondContact O-N 3.05Å; K281-S284 VanDerWaalsContact O-CB 3.3Å; K281-S284 WeakPolarHBondContact O-CB 3.3Å; K281-S284 PolarHBondContact O-N 2.81Å; K281-F285 HydrophobicContact CG-CE2 4.05Å; K281-F285 HydrophobicContact CG-CZ 3.99Å; K281-F285 PolarHBondContact O-N 2.99Å; K281-F285 VanDerWaalsContact O-N 3.14Å; K281-M308 HydrophobicContact CD-SD 4.1Å; K281-M308 HydrophobicContact CG-SD 4.04Å; K281-E313 IonicContact NZ-OE1 2.98Å; K281-E313 PolarHBondContact NZ-OE1 3.08Å
282	F	92.2	Very high	86.2	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65.9	-48.3	178.4	-176	-131.1	0	0	0	112.5	L234 E238 C278 T279 S284 F285 L286 C304 F305 M308 Y393	L234-F282 HydrophobicContact CD2-CZ 4.33Å; E238-F282 HydrophobicContact CG-CD1 4.03Å; E238-F282 HydrophobicContact CG-CE1 4.15Å; C278-F282 PolarHBondContact O-N 3.27Å; T279-F282 PolarHBondContact O-N 3.49Å; F282-S284 PolarHBondContact O-N 3.05Å; F282-F285 PolarHBondContact O-N 3.49Å; F282-F285 VanDerWaalsContact O-N 3.09Å; F282-L286 HydrophobicContact CD1-CD1 4.04Å; F282-L286 HydrophobicContact CD2-CG 4.34Å; F282-L286 HydrophobicContact CE1-CD1 3.63Å; F282-L286 HydrophobicContact CE1-CG 4.32Å; F282-L286 HydrophobicContact CE2-CD1 4.23Å; F282-L286 HydrophobicContact CE2-CD2 4.04Å; F282-L286 HydrophobicContact CE2-CG 4.02Å; F282-L286 HydrophobicContact CG-CD1 4.49Å; F282-L286 HydrophobicContact CZ-CD1 3.74Å; F282-L286 HydrophobicContact CZ-CD2 3.98Å; F282-L286 HydrophobicContact CZ-CG 4Å; F282-L286 WeakPolarHBondContact O-CG 3.42Å; F282-L286 PolarHBondContact O-N 3.28Å; F282-C304 HydrophobicContact CE2-CB 4.21Å; F282-F305 HydrophobicContact CE1-CE1 4.27Å; F282-F305 HydrophobicContact CE1-CZ 4.24Å; F282-F305 HydrophobicContact CE2-CD1 4.23Å; F282-F305 HydrophobicContact CE2-CD2 4.4Å; F282-F305 HydrophobicContact CE2-CE1 4.34Å; F282-F305 HydrophobicContact CE2-CG 4.27Å; F282-F305 HydrophobicContact CE2-CZ 4.5Å; F282-F305 AromaticContact CZ-CD1 3.94Å; F282-F305 HydrophobicContact CZ-CD1 3.94Å; F282-F305 HydrophobicContact CZ-CD2 4.13Å; F282-F305 AromaticContact CZ-CE1 3.6Å; F282-F305 HydrophobicContact CZ-CE1 3.6Å; F282-F305 AromaticContact CZ-CE2 3.82Å; F282-F305 HydrophobicContact CZ-CE2 3.82Å; F282-F305 HydrophobicContact CZ-CG 4.2Å; F282-F305 AromaticContact CZ-CZ 3.54Å; F282-F305 HydrophobicContact CZ-CZ 3.54Å; F282-M308 HydrophobicContact CB-CE 3.9Å; F282-M308 HydrophobicContact CB-CG 4.3Å; F282-M308 HydrophobicContact CB-SD 4.33Å; F282-M308 HydrophobicContact CD2-CG 3.63Å; F282-M308 HydrophobicContact CE2-CG 4.39Å; F282-M308 HydrophobicContact CG-CG 4.31Å; F282-Y393 HydrophobicContact CD1-CE1 4.18Å; F282-Y393 AromaticContact CE1-CE1 3.78Å; F282-Y393 HydrophobicContact CE1-CE1 3.78Å
283	L	87.4	Confident	84.9	Confident	10 Å²	10	37.5 Å²	37.5	5%	0.052	19%	0.186	C	C	.	.	H	α-helix	trans	-55.8	-40	175.1	178.5	61.3	0	0	0	110.9	V235 E238 L242 T279 F285 L286 E287	V235-L283 HydrophobicContact CG1-CD1 4.07Å; E238-L283 HydrophobicContact CB-CB 4.34Å; E238-L283 HydrophobicContact CB-CD1 3.82Å; L242-L283 HydrophobicContact CD2-CD2 4.06Å; T279-L283 WeakPolarHBondContact O-CB 3.47Å; T279-L283 PolarHBondContact O-N 3.32Å; L283-F285 PolarHBondContact O-N 3.45Å; L283-L286 PolarHBondContact O-N 2.81Å; L283-E287 HydrophobicContact CD1-CG 3.97Å; L283-E287 HydrophobicContact CG-CG 4.26Å; L283-E287 WeakPolarHBondContact O-CB 3.23Å; L283-E287 WeakPolarHBondContact O-CG 3.24Å; L283-E287 PolarHBondContact O-N 2.77Å
284	S	83.6	Confident	83.3	Confident	16 Å²	16	37 Å²	37	11%	0.112	18%	0.177	C	C	.	.	H	α-helix	trans	-58.7	-47.5	176.2	-70.1	0	0	0	0	112.7	S280 K281 F282 L286 E287 D288 R801	S280-S284 VanDerWaalsContact O-CB 3.25Å; S280-S284 WeakPolarHBondContact O-CB 3.37Å; S280-S284 PolarHBondContact O-N 3.22Å; S280-S284 PolarHBondContact O-OG 3.19Å; K281-S284 VanDerWaalsContact O-CB 3.3Å; K281-S284 WeakPolarHBondContact O-CB 3.3Å; K281-S284 PolarHBondContact O-N 2.81Å; F282-S284 PolarHBondContact O-N 3.05Å; S284-L286 PolarHBondContact O-N 3.11Å; S284-E287 PolarHBondContact O-N 3.06Å; S284-D288 WeakPolarHBondContact O-CB 3.46Å; S284-D288 PolarHBondContact O-N 3.47Å; S284-R801 VanDerWaalsContact C-NH2 3.29Å; S284-R801 PolarHBondContact O-NH2 3Å; S284-R801 PolarHBondContact OG-NH1 2.87Å; S284-R801 PolarHBondContact OG-NH2 3.33Å
285	F	85	Confident	81.3	Confident	52 Å²	52	39.2 Å²	39.2	23%	0.228	19%	0.189	C	C	.	.	H	α-helix	trans	-64.6	-38.6	177.4	-65.2	-20.3	0	0	0	113.1	K281 F282 L283 T289 C304 E307 M308	K281-F285 HydrophobicContact CG-CE2 4.05Å; K281-F285 HydrophobicContact CG-CZ 3.99Å; K281-F285 PolarHBondContact O-N 2.99Å; K281-F285 VanDerWaalsContact O-N 3.14Å; F282-F285 PolarHBondContact O-N 3.49Å; F282-F285 VanDerWaalsContact O-N 3.09Å; L283-F285 PolarHBondContact O-N 3.45Å; F285-T289 WeakPolarHBondContact O-CB 3.48Å; F285-T289 PolarHBondContact O-N 3.16Å; F285-T289 VanDerWaalsContact O-N 3.08Å; F285-T289 PolarHBondContact O-OG1 2.79Å; F285-C304 HydrophobicContact CB-CB 4.09Å; F285-C304 PolarHBondContact O-SG 3.12Å; F285-E307 HydrophobicContact CE2-CB 4.31Å; F285-M308 HydrophobicContact CD2-CG 4.27Å; F285-M308 HydrophobicContact CD2-SD 4.04Å; F285-M308 HydrophobicContact CE2-CG 4.49Å; F285-M308 HydrophobicContact CE2-SD 3.85Å
286	L	86	Confident	79.3	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65.3	-48.3	176.6	-66.8	176.4	0	0	0	111.4	L234 V235 E238 F282 L283 S284 T289 V290 I301 C304	L234-L286 HydrophobicContact CD2-CD1 3.99Å; L234-L286 HydrophobicContact CD2-CD2 4.23Å; L234-L286 HydrophobicContact CG-CD1 4.02Å; V235-L286 HydrophobicContact CG2-CB 3.94Å; V235-L286 HydrophobicContact CG2-CD1 4.37Å; E238-L286 HydrophobicContact CG-CD1 4.09Å; F282-L286 HydrophobicContact CD1-CD1 4.04Å; F282-L286 HydrophobicContact CD2-CG 4.34Å; F282-L286 HydrophobicContact CE1-CD1 3.63Å; F282-L286 HydrophobicContact CE1-CG 4.32Å; F282-L286 HydrophobicContact CE2-CD1 4.23Å; F282-L286 HydrophobicContact CE2-CD2 4.04Å; F282-L286 HydrophobicContact CE2-CG 4.02Å; F282-L286 HydrophobicContact CG-CD1 4.49Å; F282-L286 HydrophobicContact CZ-CD1 3.74Å; F282-L286 HydrophobicContact CZ-CD2 3.98Å; F282-L286 HydrophobicContact CZ-CG 4Å; F282-L286 WeakPolarHBondContact O-CG 3.42Å; F282-L286 PolarHBondContact O-N 3.28Å; L283-L286 PolarHBondContact O-N 2.81Å; S284-L286 PolarHBondContact O-N 3.11Å; L286-T289 PolarHBondContact O-N 3.37Å; L286-V290 WeakPolarHBondContact O-CB 2.94Å; L286-V290 VanDerWaalsContact O-CG2 3.26Å; L286-V290 WeakPolarHBondContact O-CG2 3.31Å; L286-V290 PolarHBondContact O-N 3.39Å; L286-I301 HydrophobicContact CD2-CB 4.02Å; L286-I301 HydrophobicContact CD2-CD1 3.91Å; L286-I301 HydrophobicContact CD2-CG2 4.12Å; L286-C304 HydrophobicContact CD2-CB 4.04Å
287	E	80.8	Confident	78	Confident	78 Å²	78	45.7 Å²	45.7	36%	0.364	23%	0.234	S	C	.	.	H	α-helix	trans	-61.5	-44.8	178.1	-73.2	175.6	159.9	0	0	111.4	V235 L283 S284 T289 V290 E291	V235-E287 HydrophobicContact CG1-CG 4.33Å; L283-E287 HydrophobicContact CD1-CG 3.97Å; L283-E287 HydrophobicContact CG-CG 4.26Å; L283-E287 WeakPolarHBondContact O-CB 3.23Å; L283-E287 WeakPolarHBondContact O-CG 3.24Å; L283-E287 PolarHBondContact O-N 2.77Å; S284-E287 PolarHBondContact O-N 3.06Å; E287-T289 VanDerWaalsContact C-N 3.31Å; E287-T289 PolarHBondContact O-N 3.21Å; E287-V290 PolarHBondContact O-N 3.14Å; E287-E291 VanDerWaalsContact O-CB 3.23Å; E287-E291 WeakPolarHBondContact O-CB 3.45Å; E287-E291 PolarHBondContact O-N 3.01Å
288	D	76.5	Confident	76.8	Confident	29 Å²	29	41.7 Å²	41.7	16%	0.155	22%	0.218	C	C	.	.	H	α-helix	trans	-60.2	-42.9	178.4	-70.5	-5	0	0	0	111.4	S284 E291 M292 R801 I805	S284-D288 WeakPolarHBondContact O-CB 3.46Å; S284-D288 PolarHBondContact O-N 3.47Å; D288-E291 PolarHBondContact O-N 3.14Å; D288-M292 WeakPolarHBondContact O-CB 3.44Å; D288-M292 PolarHBondContact O-N 3.5Å; D288-R801 IonicContact OD1-CZ 3.98Å; D288-R801 VanDerWaalsContact OD1-CZ 3.31Å; D288-R801 IonicContact OD1-NE 3.37Å; D288-R801 PolarHBondContact OD1-NE 3.07Å; D288-R801 IonicContact OD1-NH2 2.7Å; D288-R801 PolarHBondContact OD1-NH2 2.86Å; D288-R801 IonicContact OD2-CZ 3.99Å; D288-R801 IonicContact OD2-NE 3.76Å; D288-R801 PolarHBondContact OD2-NE 3.27Å; D288-R801 IonicContact OD2-NH2 3.27Å; D288-R801 PolarHBondContact OD2-NH2 3.47Å; D288-I805 HydrophobicContact CB-CD1 4.12Å; D288-I805 WeakPolarHBondContact OD1-CD1 3.36Å
289	T	79.1	Confident	75.9	Confident	13 Å²	13	41.9 Å²	41.9	8%	0.08	22%	0.219	C	C	.	.	H	α-helix	trans	-66.8	-50.4	178	-58.4	0	0	0	0	110.2	F285 L286 E287 E291 M292 Y293 F300 I301 C304	F285-T289 WeakPolarHBondContact O-CB 3.48Å; F285-T289 PolarHBondContact O-N 3.16Å; F285-T289 VanDerWaalsContact O-N 3.08Å; F285-T289 PolarHBondContact O-OG1 2.79Å; L286-T289 PolarHBondContact O-N 3.37Å; E287-T289 VanDerWaalsContact C-N 3.31Å; E287-T289 PolarHBondContact O-N 3.21Å; T289-E291 VanDerWaalsContact C-N 3.26Å; T289-E291 PolarHBondContact O-N 3.28Å; T289-M292 PolarHBondContact O-N 3.02Å; T289-Y293 HydrophobicContact CG2-CD2 4.11Å; T289-Y293 HydrophobicContact CG2-CE2 3.88Å; T289-Y293 WeakPolarHBondContact O-CD2 3.11Å; T289-Y293 PolarHBondContact O-N 3.28Å; T289-F300 WeakPolarHBondContact CG2-O 3.4Å; T289-I301 HydrophobicContact CG2-CG2 4.25Å; T289-C304 PolarHBondContact OG1-SG 3.37Å
290	V	78.1	Confident	75.4	Confident	44 Å²	44	44.1 Å²	44.1	27%	0.267	23%	0.229	S	C	.	.	H	α-helix	trans	-59.8	-37.2	177.9	171.4	0	0	0	0	111.7	V231 V235 L286 E287 P299	V231-V290 HydrophobicContact CG1-CG2 3.79Å; V235-V290 HydrophobicContact CG2-CG2 4.31Å; L286-V290 WeakPolarHBondContact O-CB 2.94Å; L286-V290 VanDerWaalsContact O-CG2 3.26Å; L286-V290 WeakPolarHBondContact O-CG2 3.31Å; L286-V290 PolarHBondContact O-N 3.39Å; E287-V290 PolarHBondContact O-N 3.14Å; V290-P299 HydrophobicContact CG2-CB 4.19Å; V290-P299 HydrophobicContact CG2-CG 4.22Å
291	E	69.7	Low	75.5	Confident	53 Å²	53	43.2 Å²	43.2	25%	0.248	22%	0.223	C	C	.	.	H	α-helix	trans	-70.8	-32.8	179	-175.4	171.8	-170.2	0	0	113	E287 D288 T289 K809	E287-E291 VanDerWaalsContact O-CB 3.23Å; E287-E291 WeakPolarHBondContact O-CB 3.45Å; E287-E291 PolarHBondContact O-N 3.01Å; D288-E291 PolarHBondContact O-N 3.14Å; T289-E291 VanDerWaalsContact C-N 3.26Å; T289-E291 PolarHBondContact O-N 3.28Å; E291-K809 HydrophobicContact CG-CD 4.37Å; E291-K809 VanDerWaalsContact CG-NZ 3.32Å; E291-K809 WeakPolarHBondContact O-CD 3.44Å; E291-K809 WeakPolarHBondContact O-CE 3.45Å; E291-K809 PolarHBondContact O-NZ 2.95Å; E291-K809 IonicContact OE1-NZ 3.83Å
292	M	70.3	Confident	75.5	Confident	28 Å²	28	39.4 Å²	39.4	14%	0.138	21%	0.206	C	C	.	.	H	α-helix	trans	-71.4	-30.2	179.5	-172.7	-178	64.9	0	0	113	D288 T289 K812 C848	D288-M292 WeakPolarHBondContact O-CB 3.44Å; D288-M292 PolarHBondContact O-N 3.5Å; T289-M292 PolarHBondContact O-N 3.02Å; M292-K812 HydrophobicContact CG-CD 4.07Å; M292-C848 HydrophobicContact SD-CB 4.32Å; M292-C848 PolarHBondContact SD-SG 3.24Å
293	Y	67.4	Low	75.2	Confident	57 Å²	57	41.3 Å²	41.3	22%	0.224	22%	0.216	C	C	.	.	S	Bend	trans	-90.4	148	176.1	-67.2	-82.7	0	0	0	111.6	T289 D297 P299	T289-Y293 HydrophobicContact CG2-CD2 4.11Å; T289-Y293 HydrophobicContact CG2-CE2 3.88Å; T289-Y293 WeakPolarHBondContact O-CD2 3.11Å; T289-Y293 PolarHBondContact O-N 3.28Å; Y293-D297 HydrophobicContact CD1-CB 4.03Å; Y293-P299 HydrophobicContact CD2-CB 3.93Å; Y293-P299 HydrophobicContact CG-CB 4.28Å
294	R	56.8	Low	75.3	Confident	38 Å²	38	40.9 Å²	40.9	14%	0.143	21%	0.214	C	C	.	.			trans	-114.9	148.5	176.1	-82	-175.1	-172.3	-169	-6.3	109.6	P296 D297 Q813	R294-P296 CarbonylContact O-C 3.5Å; R294-D297 WeakPolarHBondContact O-CA 3.42Å; R294-D297 VanDerWaalsContact O-CB 3.3Å; R294-D297 WeakPolarHBondContact O-CB 3.14Å; R294-D297 PolarHBondContact O-N 3.22Å; R294-Q813 VanDerWaalsContact CZ-CD 3.46Å
295	D	53	Low	75.7	Confident	114 Å²	114	40.1 Å²	40.1	61%	0.61	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.7	122.8	160.3	-76	-36.3	0	0	0	109.8
296	P	52.7	Low	76.1	Confident	117 Å²	117	38.4 Å²	38.4	76%	0.76	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	cis	-100.9	4.9	17.1	39.1	-34.7	0	0	0	117	R294 V298	R294-P296 CarbonylContact O-C 3.5Å; P296-V298 PolarHBondContact O-N 2.83Å
297	D	64	Low	76.2	Confident	80 Å²	80	41 Å²	41	43%	0.428	21%	0.214	S	C	.	.	S	Bend	trans	-63.3	127.4	177.2	-59.8	-23.9	0	0	0	110.6	Y293 R294	Y293-D297 HydrophobicContact CD1-CB 4.03Å; R294-D297 WeakPolarHBondContact O-CA 3.42Å; R294-D297 VanDerWaalsContact O-CB 3.3Å; R294-D297 WeakPolarHBondContact O-CB 3.14Å; R294-D297 PolarHBondContact O-N 3.22Å
298	V	66.9	Low	76.8	Confident	45 Å²	45	37.4 Å²	37.4	27%	0.273	20%	0.197	S	C	.	.			trans	-77	126.5	177.3	-178.8	0	0	0	0	109.1	Y227 P296 F300	Y227-V298 HydrophobicContact CD1-CG1 3.58Å; Y227-V298 HydrophobicContact CE1-CG1 4.31Å; Y227-V298 HydrophobicContact CG-CG1 4.27Å; P296-V298 PolarHBondContact O-N 2.83Å; V298-F300 HydrophobicContact CB-CE1 4.43Å; V298-F300 HydrophobicContact CB-CZ 4.3Å; V298-F300 HydrophobicContact CG1-CE1 4.24Å; V298-F300 PolarHBondContact O-N 3.07Å; V298-F300 VanDerWaalsContact O-N 3.15Å
299	P	74.4	Confident	77.6	Confident	7 Å²	7	36.5 Å²	36.5	5%	0.045	19%	0.194	C	C	.	.			trans	-74.9	104.7	177.3	29.2	-32.3	0	0	0	109.6	Y227 V231 V290 Y293	Y227-P299 VanDerWaalsContact CE1-O 3.3Å; Y227-P299 WeakPolarHBondContact CE1-O 2.93Å; V231-P299 HydrophobicContact CG1-CG 4.28Å; V290-P299 HydrophobicContact CG2-CB 4.19Å; V290-P299 HydrophobicContact CG2-CG 4.22Å; Y293-P299 HydrophobicContact CD2-CB 3.93Å; Y293-P299 HydrophobicContact CG-CB 4.28Å
300	F	83.4	Confident	78.1	Confident	47 Å²	47	42.1 Å²	42.1	21%	0.206	22%	0.22	C	C	.	.			trans	-76.4	122.9	174.3	-67.2	-56.3	0	0	0	110	Y227 T289 V298 C406 D409	Y227-F300 HydrophobicContact CE1-CD1 4.27Å; T289-F300 WeakPolarHBondContact CG2-O 3.4Å; V298-F300 HydrophobicContact CB-CE1 4.43Å; V298-F300 HydrophobicContact CB-CZ 4.3Å; V298-F300 HydrophobicContact CG1-CE1 4.24Å; V298-F300 PolarHBondContact O-N 3.07Å; V298-F300 VanDerWaalsContact O-N 3.15Å; F300-C406 HydrophobicContact CD1-CB 3.95Å; F300-C406 HydrophobicContact CD2-CB 3.9Å; F300-C406 HydrophobicContact CE1-CB 3.61Å; F300-C406 HydrophobicContact CE2-CB 3.55Å; F300-C406 HydrophobicContact CG-CB 4.11Å; F300-C406 HydrophobicContact CZ-CB 3.41Å; F300-C406 VanDerWaalsContact CZ-CB 3.41Å; F300-D409 HydrophobicContact CB-CB 3.78Å; F300-D409 WeakPolarHBondContact CB-OD1 3.39Å; F300-D409 HydrophobicContact CD1-CB 3.77Å; F300-D409 HydrophobicContact CG-CB 3.87Å
301	I	88.8	Confident	78.7	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.228	C	C	.	.			trans	-114.9	5.4	-169.7	63	161.5	0	0	0	114.2	Y227 V231 L234 L286 T289 N303 C304 F305 L400 D409	Y227-I301 HydrophobicContact CE1-CG1 4.41Å; Y227-I301 WeakPolarHBondContact OH-CG1 3.45Å; Y227-I301 PolarHBondContact OH-N 3.19Å; Y227-I301 VanDerWaalsContact OH-N 3.11Å; V231-I301 HydrophobicContact CB-CD1 4.48Å; V231-I301 HydrophobicContact CG1-CD1 4.34Å; V231-I301 HydrophobicContact CG1-CG2 3.79Å; V231-I301 HydrophobicContact CG2-CD1 3.83Å; V231-I301 HydrophobicContact CG2-CG1 3.96Å; V231-I301 HydrophobicContact CG2-CG2 4.16Å; L234-I301 HydrophobicContact CD2-CD1 3.67Å; L286-I301 HydrophobicContact CD2-CB 4.02Å; L286-I301 HydrophobicContact CD2-CD1 3.91Å; L286-I301 HydrophobicContact CD2-CG2 4.12Å; T289-I301 HydrophobicContact CG2-CG2 4.25Å; I301-N303 PolarHBondContact O-N 3.13Å; I301-C304 WeakPolarHBondContact O-CB 3.41Å; I301-C304 PolarHBondContact O-N 2.89Å; I301-F305 HydrophobicContact CD1-CD2 4.29Å; I301-F305 HydrophobicContact CD1-CE2 3.86Å; I301-F305 PolarHBondContact O-N 3.14Å; I301-L400 HydrophobicContact CD1-CD1 4.01Å; I301-L400 HydrophobicContact CD1-CD2 4.35Å; I301-D409 PolarHBondContact N-OD1 2.84Å
302	G	88.7	Confident	79.7	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-58	-36.9	-178.6	0	0	0	0	0	112.8	C304 F305 L306 D409	G302-C304 VanDerWaalsContact C-N 3.35Å; G302-C304 PolarHBondContact O-N 3.27Å; G302-F305 PolarHBondContact O-N 3.26Å; G302-L306 WeakPolarHBondContact O-CB 3.4Å; G302-L306 PolarHBondContact O-N 3.27Å; G302-D409 VanDerWaalsContact CA-OD1 3.3Å; G302-D409 WeakPolarHBondContact CA-OD1 3.45Å; G302-D409 PolarHBondContact N-OD1 3.18Å
303	N	87.3	Confident	80.7	Confident	40 Å²	40	43 Å²	43	21%	0.214	24%	0.24	C	C	.	.	H	α-helix	trans	-60.9	-38.6	173.9	67.1	-38.4	0	0	0	113.2	I301 F305 L306 E307	I301-N303 PolarHBondContact O-N 3.13Å; N303-F305 VanDerWaalsContact C-N 3.32Å; N303-F305 PolarHBondContact O-N 2.69Å; N303-L306 PolarHBondContact O-N 2.93Å; N303-E307 WeakPolarHBondContact O-CG 3.31Å; N303-E307 PolarHBondContact O-N 2.66Å
304	C	89.6	Confident	82	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.007	23%	0.23	C	C	.	.	H	α-helix	trans	-62.6	-43.1	179.2	-56.7	0	0	0	0	110.7	F282 F285 L286 T289 I301 G302 M308	F282-C304 HydrophobicContact CE2-CB 4.21Å; F285-C304 HydrophobicContact CB-CB 4.09Å; F285-C304 PolarHBondContact O-SG 3.12Å; L286-C304 HydrophobicContact CD2-CB 4.04Å; T289-C304 PolarHBondContact OG1-SG 3.37Å; I301-C304 WeakPolarHBondContact O-CB 3.41Å; I301-C304 PolarHBondContact O-N 2.89Å; G302-C304 VanDerWaalsContact C-N 3.35Å; G302-C304 PolarHBondContact O-N 3.27Å; C304-M308 WeakPolarHBondContact O-CG 3.45Å; C304-M308 PolarHBondContact O-N 3.23Å
305	F	92.2	Very high	83.7	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-65.8	-45.2	175.5	-90	-74.6	0	0	0	111.8	L234 F282 I301 G302 N303 E307 M308 A309 F314 Y393 L397 L400 L413 T416	L234-F305 HydrophobicContact CD2-CE2 3.61Å; L234-F305 HydrophobicContact CD2-CZ 3.68Å; F282-F305 HydrophobicContact CE1-CE1 4.27Å; F282-F305 HydrophobicContact CE1-CZ 4.24Å; F282-F305 HydrophobicContact CE2-CD1 4.23Å; F282-F305 HydrophobicContact CE2-CD2 4.4Å; F282-F305 HydrophobicContact CE2-CE1 4.34Å; F282-F305 HydrophobicContact CE2-CG 4.27Å; F282-F305 HydrophobicContact CE2-CZ 4.5Å; F282-F305 AromaticContact CZ-CD1 3.94Å; F282-F305 HydrophobicContact CZ-CD1 3.94Å; F282-F305 HydrophobicContact CZ-CD2 4.13Å; F282-F305 AromaticContact CZ-CE1 3.6Å; F282-F305 HydrophobicContact CZ-CE1 3.6Å; F282-F305 AromaticContact CZ-CE2 3.82Å; F282-F305 HydrophobicContact CZ-CE2 3.82Å; F282-F305 HydrophobicContact CZ-CG 4.2Å; F282-F305 AromaticContact CZ-CZ 3.54Å; F282-F305 HydrophobicContact CZ-CZ 3.54Å; I301-F305 HydrophobicContact CD1-CD2 4.29Å; I301-F305 HydrophobicContact CD1-CE2 3.86Å; I301-F305 PolarHBondContact O-N 3.14Å; G302-F305 PolarHBondContact O-N 3.26Å; N303-F305 VanDerWaalsContact C-N 3.32Å; N303-F305 PolarHBondContact O-N 2.69Å; F305-E307 PolarHBondContact O-N 3.28Å; F305-M308 PolarHBondContact O-N 2.92Å; F305-A309 WeakPolarHBondContact O-CB 3.33Å; F305-A309 PolarHBondContact O-N 3.41Å; F305-F314 HydrophobicContact CD1-CZ 4.4Å; F305-Y393 HydrophobicContact CE1-CD1 4.23Å; F305-L397 HydrophobicContact CD1-CD2 3.95Å; F305-L397 HydrophobicContact CD2-CD2 4.46Å; F305-L397 HydrophobicContact CE1-CD2 4.15Å; F305-L397 HydrophobicContact CG-CD2 4.1Å; F305-L397 HydrophobicContact CZ-CD2 4.48Å; F305-L400 HydrophobicContact CD2-CD1 4.4Å; F305-L400 HydrophobicContact CE2-CD1 3.66Å; F305-L400 HydrophobicContact CZ-CD1 4.28Å; F305-L413 HydrophobicContact CD2-CD2 4.16Å; F305-T416 HydrophobicContact CB-CG2 3.71Å; F305-T416 HydrophobicContact CD1-CG2 4.29Å; F305-T416 HydrophobicContact CG-CG2 4.41Å
306	L	92.1	Very high	85.6	Confident	16 Å²	16	39.9 Å²	39.9	8%	0.084	23%	0.227	C	C	.	.	H	α-helix	trans	-60.9	-43.9	-178.7	-177	61.4	0	0	0	111.6	G302 N303 M308 A309 E310 D412 Q415 T416 L419	G302-L306 WeakPolarHBondContact O-CB 3.4Å; G302-L306 PolarHBondContact O-N 3.27Å; N303-L306 PolarHBondContact O-N 2.93Å; L306-M308 PolarHBondContact O-N 2.82Å; L306-A309 PolarHBondContact O-N 2.88Å; L306-E310 HydrophobicContact CD1-CG 3.96Å; L306-E310 HydrophobicContact CG-CG 4.2Å; L306-E310 WeakPolarHBondContact O-CB 3.25Å; L306-E310 WeakPolarHBondContact O-CG 3.32Å; L306-E310 PolarHBondContact O-N 3.49Å; L306-D412 HydrophobicContact CB-CB 4.4Å; L306-D412 HydrophobicContact CD2-CB 4.12Å; L306-Q415 HydrophobicContact CD1-CB 3.83Å; L306-T416 VanDerWaalsContact CA-OG1 3.29Å; L306-T416 WeakPolarHBondContact CA-OG1 3.37Å; L306-T416 PolarHBondContact N-OG1 2.74Å; L306-L419 HydrophobicContact CD1-CD1 3.91Å
307	E	88.8	Confident	87.6	Confident	55 Å²	55	34.3 Å²	34.3	26%	0.257	19%	0.191	S	C	.	.	H	α-helix	trans	-59.5	-45.1	176.8	-76	175.3	-136.1	0	0	113	F285 N303 F305 A309 G311 K847	F285-E307 HydrophobicContact CE2-CB 4.31Å; N303-E307 WeakPolarHBondContact O-CG 3.31Å; N303-E307 PolarHBondContact O-N 2.66Å; F305-E307 PolarHBondContact O-N 3.28Å; E307-A309 VanDerWaalsContact C-N 3.3Å; E307-A309 PolarHBondContact O-N 3.31Å; E307-G311 PolarHBondContact O-N 3.44Å; E307-K847 VanDerWaalsContact CD-CE 3.47Å; E307-K847 WeakPolarHBondContact OE1-CD 3.32Å; E307-K847 WeakPolarHBondContact OE1-CE 3.35Å; E307-K847 IonicContact OE1-NZ 2.88Å; E307-K847 PolarHBondContact OE1-NZ 3.12Å
308	M	92.5	Very high	88.9	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-66.6	-35.5	179.2	-67.6	-61.1	-69.7	0	0	111.4	C278 K281 F282 F285 C304 F305 L306 A312 E313 F314	C278-M308 WeakPolarHBondContact O-CE 3.24Å; C278-M308 VanDerWaalsContact SG-CE 3.58Å; K281-M308 HydrophobicContact CD-SD 4.1Å; K281-M308 HydrophobicContact CG-SD 4.04Å; F282-M308 HydrophobicContact CB-CE 3.9Å; F282-M308 HydrophobicContact CB-CG 4.3Å; F282-M308 HydrophobicContact CB-SD 4.33Å; F282-M308 HydrophobicContact CD2-CG 3.63Å; F282-M308 HydrophobicContact CE2-CG 4.39Å; F282-M308 HydrophobicContact CG-CG 4.31Å; F285-M308 HydrophobicContact CD2-CG 4.27Å; F285-M308 HydrophobicContact CD2-SD 4.04Å; F285-M308 HydrophobicContact CE2-CG 4.49Å; F285-M308 HydrophobicContact CE2-SD 3.85Å; C304-M308 WeakPolarHBondContact O-CG 3.45Å; C304-M308 PolarHBondContact O-N 3.23Å; F305-M308 PolarHBondContact O-N 2.92Å; L306-M308 PolarHBondContact O-N 2.82Å; M308-A312 PolarHBondContact O-N 2.9Å; M308-E313 HydrophobicContact CE-CB 3.49Å; M308-E313 VanDerWaalsContact CE-CB 3.49Å; M308-E313 HydrophobicContact CE-CG 3.96Å; M308-E313 WeakPolarHBondContact O-CB 3.48Å; M308-E313 PolarHBondContact O-N 2.93Å; M308-E313 HydrophobicContact SD-CB 4.23Å; M308-E313 HydrophobicContact SD-CG 4.11Å; M308-F314 HydrophobicContact CB-CD2 4Å; M308-F314 HydrophobicContact CB-CE2 3.28Å; M308-F314 HydrophobicContact CB-CZ 3.68Å; M308-F314 HydrophobicContact CG-CE2 4.41Å; M308-F314 HydrophobicContact CG-CZ 4.38Å
309	A	92.8	Very high	90.1	Very high	11 Å²	11	35.6 Å²	35.6	9%	0.091	19%	0.19	C	C	.	.	H	α-helix	trans	-74	-44	177.3	0	0	0	0	0	112.7	F305 L306 E307 G311 A312 T416 L419 L420	F305-A309 WeakPolarHBondContact O-CB 3.33Å; F305-A309 PolarHBondContact O-N 3.41Å; L306-A309 PolarHBondContact O-N 2.88Å; E307-A309 VanDerWaalsContact C-N 3.3Å; E307-A309 PolarHBondContact O-N 3.31Å; A309-G311 VanDerWaalsContact C-N 3.31Å; A309-G311 PolarHBondContact O-N 2.68Å; A309-A312 PolarHBondContact O-N 2.85Å; A309-T416 HydrophobicContact CB-CG2 3.91Å; A309-L419 HydrophobicContact CB-CB 4.13Å; A309-L419 HydrophobicContact CB-CD1 4.06Å; A309-L420 HydrophobicContact CB-CD2 4.01Å; A309-L420 HydrophobicContact CB-CG 4.09Å
310	E	90.9	Very high	91	Very high	131 Å²	131	35.3 Å²	35.3	61%	0.612	19%	0.187	S	C	*	.	H	α-helix	trans	-63.7	-36.7	176.5	-75.2	-178.6	158.1	0	0	112	L306 A312 L419	L306-E310 HydrophobicContact CD1-CG 3.96Å; L306-E310 HydrophobicContact CG-CG 4.2Å; L306-E310 WeakPolarHBondContact O-CB 3.25Å; L306-E310 WeakPolarHBondContact O-CG 3.32Å; L306-E310 PolarHBondContact O-N 3.49Å; E310-A312 PolarHBondContact O-N 3.42Å; E310-L419 HydrophobicContact CG-CD1 3.84Å
311	G	89.6	Confident	91.4	Very high	44 Å²	44	33.1 Å²	33.1	45%	0.454	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-0.2	173.6	0	0	0	0	0	114.7	E307 A309 E313	E307-G311 PolarHBondContact O-N 3.44Å; A309-G311 VanDerWaalsContact C-N 3.31Å; A309-G311 PolarHBondContact O-N 2.68Å; G311-E313 PolarHBondContact O-N 2.92Å; G311-E313 VanDerWaalsContact O-N 3.12Å
312	A	91.1	Very high	91.5	Very high	44 Å²	44	36.4 Å²	36.4	36%	0.364	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	25.3	-174.1	0	0	0	0	0	114	M308 A309 E310 F314 E315	M308-A312 PolarHBondContact O-N 2.9Å; A309-A312 PolarHBondContact O-N 2.85Å; E310-A312 PolarHBondContact O-N 3.42Å; A312-F314 PolarHBondContact O-N 3.34Å; A312-E315 HydrophobicContact CB-CG 4.04Å; A312-E315 WeakPolarHBondContact O-CB 3.42Å; A312-E315 WeakPolarHBondContact O-CG 3.47Å; A312-E315 PolarHBondContact O-N 3.27Å
313	E	92.3	Very high	91.6	Very high	55 Å²	55	39.1 Å²	39.1	26%	0.257	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-66.6	-26.1	-173.5	-60.5	-74.2	177.8	0	0	112.3	C278 K281 M308 G311 E315 V316	C278-E313 PolarHBondContact SG-O 3.4Å; K281-E313 IonicContact NZ-OE1 2.98Å; K281-E313 PolarHBondContact NZ-OE1 3.08Å; M308-E313 HydrophobicContact CE-CB 3.49Å; M308-E313 VanDerWaalsContact CE-CB 3.49Å; M308-E313 HydrophobicContact CE-CG 3.96Å; M308-E313 WeakPolarHBondContact O-CB 3.48Å; M308-E313 PolarHBondContact O-N 2.93Å; M308-E313 HydrophobicContact SD-CB 4.23Å; M308-E313 HydrophobicContact SD-CG 4.11Å; G311-E313 PolarHBondContact O-N 2.92Å; G311-E313 VanDerWaalsContact O-N 3.12Å; E313-E315 VanDerWaalsContact C-N 3.27Å; E313-E315 PolarHBondContact O-N 3.38Å; E313-V316 WeakPolarHBondContact O-CG2 3.45Å
314	F	93.2	Very high	91.7	Very high	4 Å²	4	37.9 Å²	37.9	2%	0.018	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-75.3	-10.9	176.7	-65.8	-71.5	0	0	0	113.6	F305 M308 A312 V316 Y317 Y393 L420 L423	F305-F314 HydrophobicContact CD1-CZ 4.4Å; M308-F314 HydrophobicContact CB-CD2 4Å; M308-F314 HydrophobicContact CB-CE2 3.28Å; M308-F314 HydrophobicContact CB-CZ 3.68Å; M308-F314 HydrophobicContact CG-CE2 4.41Å; M308-F314 HydrophobicContact CG-CZ 4.38Å; A312-F314 PolarHBondContact O-N 3.34Å; F314-V316 PolarHBondContact O-N 3Å; F314-Y317 HydrophobicContact CD1-CE2 4.31Å; F314-Y317 WeakPolarHBondContact O-CD2 3.46Å; F314-Y317 PolarHBondContact O-N 3.08Å; F314-Y393 HydrophobicContact CD1-CD2 4.13Å; F314-Y393 AromaticContact CD1-CE2 3.98Å; F314-Y393 HydrophobicContact CD1-CE2 3.98Å; F314-Y393 AromaticContact CE1-CD2 3.89Å; F314-Y393 HydrophobicContact CE1-CD2 3.89Å; F314-Y393 HydrophobicContact CE1-CE1 4.5Å; F314-Y393 AromaticContact CE1-CE2 3.64Å; F314-Y393 HydrophobicContact CE1-CE2 3.64Å; F314-Y393 HydrophobicContact CE1-CG 4.43Å; F314-Y393 AromaticContact CE1-CZ 3.97Å; F314-L420 HydrophobicContact CB-CD2 4.14Å; F314-L420 HydrophobicContact CD2-CD1 4.13Å; F314-L420 HydrophobicContact CD2-CD2 3.76Å; F314-L420 HydrophobicContact CE2-CD1 4.2Å; F314-L420 HydrophobicContact CG-CD2 4.26Å; F314-L423 HydrophobicContact CB-CD2 3.81Å
315	E	92.4	Very high	91.5	Very high	110 Å²	110	40.1 Å²	40.1	51%	0.514	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-66.7	-20.8	-179.6	-66.9	-164.2	158.7	0	0	113	A312 E313 Y317 E318	A312-E315 HydrophobicContact CB-CG 4.04Å; A312-E315 WeakPolarHBondContact O-CB 3.42Å; A312-E315 WeakPolarHBondContact O-CG 3.47Å; A312-E315 PolarHBondContact O-N 3.27Å; E313-E315 VanDerWaalsContact C-N 3.27Å; E313-E315 PolarHBondContact O-N 3.38Å; E315-Y317 PolarHBondContact O-N 3.26Å; E315-Y317 VanDerWaalsContact O-N 3.09Å; E315-E318 WeakPolarHBondContact O-CB 3.46Å; E315-E318 PolarHBondContact O-N 2.92Å
316	V	94	Very high	91.3	Very high	30 Å²	30	43.8 Å²	43.8	18%	0.182	24%	0.235	C	C	.	.	H	α-helix	trans	-55.5	-29.6	176.6	-57.9	0	0	0	0	112.8	N271 D274 I275 C278 E313 F314 E318 Y320	N271-V316 PolarHBondContact ND2-O 2.99Å; D274-V316 HydrophobicContact CB-CB 4.17Å; D274-V316 HydrophobicContact CB-CG1 3.98Å; I275-V316 HydrophobicContact CG1-CG2 4.19Å; C278-V316 HydrophobicContact CB-CG2 4.05Å; E313-V316 WeakPolarHBondContact O-CG2 3.45Å; F314-V316 PolarHBondContact O-N 3Å; V316-E318 VanDerWaalsContact C-N 3.3Å; V316-E318 PolarHBondContact O-N 3.36Å; V316-Y320 PolarHBondContact O-N 3.32Å
317	Y	93.7	Very high	91.1	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-68	-27.7	177.6	-74.7	-81.2	0	0	0	112.9	F241 I275 F314 E315 Y320 M321 P386 C390 Y393	F241-Y317 WeakPolarHBondContact CE1-OH 3.17Å; I275-Y317 HydrophobicContact CD1-CD1 4.42Å; I275-Y317 HydrophobicContact CG1-CD1 4.44Å; I275-Y317 HydrophobicContact CG1-CE1 4.35Å; I275-Y317 HydrophobicContact CG2-CE1 4.17Å; F314-Y317 HydrophobicContact CD1-CE2 4.31Å; F314-Y317 WeakPolarHBondContact O-CD2 3.46Å; F314-Y317 PolarHBondContact O-N 3.08Å; E315-Y317 PolarHBondContact O-N 3.26Å; E315-Y317 VanDerWaalsContact O-N 3.09Å; Y317-Y320 PolarHBondContact O-N 3.22Å; Y317-M321 VanDerWaalsContact O-CB 3.32Å; Y317-M321 WeakPolarHBondContact O-CB 3.5Å; Y317-M321 VanDerWaalsContact O-CG 3.25Å; Y317-M321 WeakPolarHBondContact O-CG 3.27Å; Y317-M321 PolarHBondContact O-N 3.35Å; Y317-P386 HydrophobicContact CD1-CB 4.36Å; Y317-P386 HydrophobicContact CE1-CB 4.03Å; Y317-P386 WeakPolarHBondContact CE1-O 3.32Å; Y317-C390 HydrophobicContact CD1-CB 3.55Å; Y317-C390 HydrophobicContact CD2-CB 4.35Å; Y317-C390 HydrophobicContact CE1-CB 3.9Å; Y317-C390 HydrophobicContact CG-CB 3.79Å; Y317-Y393 HydrophobicContact CE2-CE2 4.16Å
318	E	92.1	Very high	91.1	Very high	39 Å²	39	51.5 Å²	51.5	18%	0.182	27%	0.273	C	S	.	.	H	α-helix	trans	-67.5	-44.5	-179.4	-179.6	163.5	-166.5	0	0	111.8	E315 V316 N322 L423 R426 L427 K430	E315-E318 WeakPolarHBondContact O-CB 3.46Å; E315-E318 PolarHBondContact O-N 2.92Å; V316-E318 VanDerWaalsContact C-N 3.3Å; V316-E318 PolarHBondContact O-N 3.36Å; E318-N322 PolarHBondContact O-N 3.3Å; E318-N322 VanDerWaalsContact O-N 3.13Å; E318-N322 PolarHBondContact O-ND2 3.36Å; E318-N322 VanDerWaalsContact O-ND2 3.13Å; E318-L423 HydrophobicContact CB-CD1 4.07Å; E318-R426 IonicContact OE1-NE 3.15Å; E318-R426 PolarHBondContact OE1-NE 3.29Å; E318-R426 IonicContact OE2-CZ 3.36Å; E318-R426 VanDerWaalsContact OE2-CZ 3.29Å; E318-R426 IonicContact OE2-NE 2.89Å; E318-R426 PolarHBondContact OE2-NE 2.9Å; E318-R426 IonicContact OE2-NH2 3.81Å; E318-R426 PolarHBondContact OE2-NH2 3.37Å; E318-L427 HydrophobicContact CB-CD2 4.06Å; E318-L427 HydrophobicContact CG-CD2 4.28Å; E318-K430 IonicContact OE1-NZ 3.7Å; E318-K430 PolarHBondContact OE1-NZ 3.47Å
319	K	92.2	Very high	90.9	Very high	113 Å²	113	51.8 Å²	51.8	49%	0.491	28%	0.275	S	S	.	.	H	α-helix	trans	-61.4	-49.8	174.5	-179.1	-179.4	172	-170.6	0	110.6	N271 M321 N322 D323	N271-K319 HydrophobicContact CB-CD 4.09Å; K319-M321 VanDerWaalsContact C-N 3.33Å; K319-M321 PolarHBondContact O-N 3.05Å; K319-N322 WeakPolarHBondContact O-CB 3.13Å; K319-N322 PolarHBondContact O-N 2.72Å; K319-N322 VanDerWaalsContact O-N 3.08Å; K319-D323 PolarHBondContact O-N 2.8Å; K319-D323 VanDerWaalsContact O-N 3.17Å
320	Y	93.7	Very high	90.5	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-57.3	-45.7	-179.8	-170.8	-98	0	0	0	112.7	F269 N271 I272 I275 V316 Y317 N322 D323 V324 L383 P386	F269-Y320 WeakPolarHBondContact O-CE2 3.38Å; N271-Y320 VanDerWaalsContact OD1-CA 3.25Å; N271-Y320 WeakPolarHBondContact OD1-CA 3.41Å; N271-Y320 VanDerWaalsContact OD1-CB 3.3Å; N271-Y320 WeakPolarHBondContact OD1-CB 3.35Å; N271-Y320 PolarHBondContact OD1-N 3.49Å; N271-Y320 VanDerWaalsContact OD1-N 3.1Å; I272-Y320 HydrophobicContact CB-CE2 4.04Å; I272-Y320 HydrophobicContact CD1-CE2 3.8Å; I272-Y320 HydrophobicContact CG1-CE2 4.47Å; I275-Y320 HydrophobicContact CD1-CD1 3.72Å; I275-Y320 HydrophobicContact CD1-CD2 3.33Å; I275-Y320 HydrophobicContact CD1-CE1 4.21Å; I275-Y320 HydrophobicContact CD1-CE2 3.87Å; I275-Y320 HydrophobicContact CD1-CG 3.23Å; V316-Y320 PolarHBondContact O-N 3.32Å; Y317-Y320 PolarHBondContact O-N 3.22Å; Y320-N322 VanDerWaalsContact C-N 3.32Å; Y320-N322 PolarHBondContact O-N 2.7Å; Y320-D323 PolarHBondContact O-N 2.87Å; Y320-V324 HydrophobicContact CD1-CG2 4.07Å; Y320-V324 HydrophobicContact CD2-CG2 4.24Å; Y320-V324 HydrophobicContact CE1-CB 4.32Å; Y320-V324 HydrophobicContact CE1-CG2 3.67Å; Y320-V324 HydrophobicContact CE2-CG2 3.87Å; Y320-V324 HydrophobicContact CG-CG2 4.34Å; Y320-V324 WeakPolarHBondContact O-CB 3.45Å; Y320-V324 WeakPolarHBondContact O-CG2 3.43Å; Y320-V324 PolarHBondContact O-N 2.97Å; Y320-L383 WeakPolarHBondContact CE1-O 3.35Å; Y320-L383 PolarHBondContact OH-O 3.33Å; Y320-L383 VanDerWaalsContact OH-O 3.05Å; Y320-P386 HydrophobicContact CD1-CB 3.87Å; Y320-P386 HydrophobicContact CD1-CG 4.3Å; Y320-P386 HydrophobicContact CE1-CB 3.56Å; Y320-P386 HydrophobicContact CE1-CG 3.53Å
321	M	90.8	Very high	90.5	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-64.9	-33.8	178.1	-76.6	179.3	56.6	0	0	112.8	Y317 K319 D323 L325 V387 L427 C431	Y317-M321 VanDerWaalsContact O-CB 3.32Å; Y317-M321 WeakPolarHBondContact O-CB 3.5Å; Y317-M321 VanDerWaalsContact O-CG 3.25Å; Y317-M321 WeakPolarHBondContact O-CG 3.27Å; Y317-M321 PolarHBondContact O-N 3.35Å; K319-M321 VanDerWaalsContact C-N 3.33Å; K319-M321 PolarHBondContact O-N 3.05Å; M321-D323 VanDerWaalsContact C-N 3.35Å; M321-L325 VanDerWaalsContact O-CB 3.23Å; M321-L325 WeakPolarHBondContact O-CB 3.43Å; M321-L325 WeakPolarHBondContact O-CG 3.47Å; M321-L325 PolarHBondContact O-N 3.46Å; M321-V387 HydrophobicContact CE-CG1 3.86Å; M321-V387 HydrophobicContact CG-CB 4.31Å; M321-V387 HydrophobicContact CG-CG1 4.04Å; M321-V387 HydrophobicContact CG-CG2 3.84Å; M321-V387 HydrophobicContact SD-CG1 3.99Å; M321-L427 HydrophobicContact CE-CB 3.87Å; M321-L427 HydrophobicContact CE-CD2 3.92Å; M321-L427 HydrophobicContact CE-CG 4.31Å; M321-L427 HydrophobicContact SD-CB 4.17Å; M321-L427 HydrophobicContact SD-CD1 3.86Å; M321-L427 HydrophobicContact SD-CD2 3.6Å; M321-L427 HydrophobicContact SD-CG 4.05Å; M321-C431 WeakPolarHBondContact CE-SG 2.95Å
322	N	90.4	Very high	90.5	Very high	70 Å²	70	53 Å²	53	37%	0.374	27%	0.268	S	S	.	.	H	α-helix	trans	-64.8	-41.9	175.5	-71	-31.8	0	0	0	111.8	E318 K319 Y320 N326 K430	E318-N322 PolarHBondContact O-N 3.3Å; E318-N322 VanDerWaalsContact O-N 3.13Å; E318-N322 PolarHBondContact O-ND2 3.36Å; E318-N322 VanDerWaalsContact O-ND2 3.13Å; K319-N322 WeakPolarHBondContact O-CB 3.13Å; K319-N322 PolarHBondContact O-N 2.72Å; K319-N322 VanDerWaalsContact O-N 3.08Å; Y320-N322 VanDerWaalsContact C-N 3.32Å; Y320-N322 PolarHBondContact O-N 2.7Å; N322-N326 WeakPolarHBondContact O-CB 3.4Å; N322-K430 PolarHBondContact ND2-NZ 3.3Å; N322-K430 VanDerWaalsContact OD1-CD 3.31Å; N322-K430 WeakPolarHBondContact OD1-CD 3.4Å; N322-K430 WeakPolarHBondContact OD1-CE 3.44Å; N322-K430 PolarHBondContact OD1-NZ 3.04Å
323	D	91.4	Very high	90.4	Very high	56 Å²	56	50.9 Å²	50.9	30%	0.299	25%	0.251	S	S	.	.	H	α-helix	trans	-79.7	-45.8	-172.7	-63.9	-17.9	0	0	0	111.4	S270 K319 Y320 M321 N326	S270-D323 WeakPolarHBondContact CB-OD2 3.32Å; S270-D323 WeakPolarHBondContact OG-CB 3.16Å; S270-D323 PolarHBondContact OG-OD2 3.32Å; K319-D323 PolarHBondContact O-N 2.8Å; K319-D323 VanDerWaalsContact O-N 3.17Å; Y320-D323 PolarHBondContact O-N 2.87Å; M321-D323 VanDerWaalsContact C-N 3.35Å; D323-N326 VanDerWaalsContact O-CB 3.24Å; D323-N326 WeakPolarHBondContact O-CB 3.27Å; D323-N326 PolarHBondContact O-N 3.2Å
324	V	88.9	Confident	90.1	Very high	15 Å²	15	51 Å²	51	9%	0.091	25%	0.253	C	S	.	.	H	α-helix	trans	-72.8	-31.6	-177	174.2	0	0	0	0	112.9	Y320 N326 L383 L384	Y320-V324 HydrophobicContact CD1-CG2 4.07Å; Y320-V324 HydrophobicContact CD2-CG2 4.24Å; Y320-V324 HydrophobicContact CE1-CB 4.32Å; Y320-V324 HydrophobicContact CE1-CG2 3.67Å; Y320-V324 HydrophobicContact CE2-CG2 3.87Å; Y320-V324 HydrophobicContact CG-CG2 4.34Å; Y320-V324 WeakPolarHBondContact O-CB 3.45Å; Y320-V324 WeakPolarHBondContact O-CG2 3.43Å; Y320-V324 PolarHBondContact O-N 2.97Å; V324-N326 VanDerWaalsContact C-N 3.26Å; V324-L383 HydrophobicContact CG1-CB 4Å; V324-L384 HydrophobicContact CG1-CD2 4.1Å
325	L	87.3	Confident	89.8	Confident	47 Å²	47	55 Å²	55	25%	0.246	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-7.5	175.6	-57.6	-178.2	0	0	0	112.8	M321 L384 L434	M321-L325 VanDerWaalsContact O-CB 3.23Å; M321-L325 WeakPolarHBondContact O-CB 3.43Å; M321-L325 WeakPolarHBondContact O-CG 3.47Å; M321-L325 PolarHBondContact O-N 3.46Å; L325-L384 HydrophobicContact CD2-CD2 3.76Å; L325-L434 HydrophobicContact CD1-CD1 3.91Å; L325-L434 HydrophobicContact CD2-CD1 3.71Å; L325-L434 HydrophobicContact CD2-CD2 4.11Å; L325-L434 HydrophobicContact CD2-CG 4.26Å; L325-L434 HydrophobicContact CG-CD1 4.48Å
326	N	88	Confident	89.5	Confident	78 Å²	78	50.3 Å²	50.3	42%	0.417	25%	0.254	S	S	.	.	S	Bend	trans	-72.7	129.9	174.3	-166.6	-37.5	0	0	0	109.8	N322 D323 V324 R328 C329	N322-N326 WeakPolarHBondContact O-CB 3.4Å; D323-N326 VanDerWaalsContact O-CB 3.24Å; D323-N326 WeakPolarHBondContact O-CB 3.27Å; D323-N326 PolarHBondContact O-N 3.2Å; V324-N326 VanDerWaalsContact C-N 3.26Å; N326-R328 PolarHBondContact O-N 3.4Å; N326-R328 WeakPolarHBondContact OD1-CB 3.43Å; N326-R328 PolarHBondContact OD1-N 3.29Å; N326-C329 WeakPolarHBondContact O-CB 3.26Å; N326-C329 PolarHBondContact O-N 3.36Å
327	P	86.4	Confident	89.1	Confident	91 Å²	91	49.3 Å²	49.3	59%	0.591	25%	0.248	S	C	*	.	H	α-helix	trans	-50.9	-28.9	175	-28.7	35.4	0	0	0	114	C329 Q330 E331	P327-C329 PolarHBondContact O-N 3.02Å; P327-Q330 PolarHBondContact O-N 3.15Å; P327-Q330 VanDerWaalsContact O-N 3.15Å; P327-E331 WeakPolarHBondContact O-CG 3.3Å; P327-E331 PolarHBondContact O-N 2.97Å; P327-E331 VanDerWaalsContact O-N 3.08Å
328	R	89.3	Confident	88.6	Confident	141 Å²	141	58.1 Å²	58.1	53%	0.532	28%	0.281	S	S	.	.	H	α-helix	trans	-52.9	-37.4	175	-174.7	177.2	176.7	-178	-2.4	113.1	N326 Q330 E331 V332	N326-R328 PolarHBondContact O-N 3.4Å; N326-R328 WeakPolarHBondContact OD1-CB 3.43Å; N326-R328 PolarHBondContact OD1-N 3.29Å; R328-Q330 PolarHBondContact O-N 3.01Å; R328-E331 PolarHBondContact O-N 3.3Å; R328-V332 HydrophobicContact CG-CG2 4.13Å; R328-V332 VanDerWaalsContact O-CG2 3.26Å; R328-V332 WeakPolarHBondContact O-CG2 3.5Å; R328-V332 PolarHBondContact O-N 2.93Å
329	C	87.6	Confident	88.2	Confident	8 Å²	8	61 Å²	61	5%	0.054	30%	0.295	C	S	.	.	H	α-helix	trans	-58.3	-47.7	178.9	176.2	0	0	0	0	111.2	N326 P327 L333	N326-C329 WeakPolarHBondContact O-CB 3.26Å; N326-C329 PolarHBondContact O-N 3.36Å; P327-C329 PolarHBondContact O-N 3.02Å; C329-L333 PolarHBondContact O-N 3.46Å
330	Q	86.2	Confident	87.6	Confident	74 Å²	74	60.1 Å²	60.1	35%	0.346	30%	0.301	S	S	.	.	H	α-helix	trans	-71.2	-38.2	179.2	-171.4	65.5	37.7	0	0	111.6	P327 R328 L333 D334	P327-Q330 PolarHBondContact O-N 3.15Å; P327-Q330 VanDerWaalsContact O-N 3.15Å; R328-Q330 PolarHBondContact O-N 3.01Å; Q330-L333 PolarHBondContact O-N 3.48Å; Q330-D334 PolarHBondContact NE2-OD1 3.24Å; Q330-D334 WeakPolarHBondContact O-CB 3.45Å; Q330-D334 VanDerWaalsContact O-CG 3.27Å; Q330-D334 PolarHBondContact O-N 3.5Å
331	E	89.4	Confident	86.9	Confident	117 Å²	117	64.7 Å²	64.7	55%	0.547	33%	0.329	S	S	.	.	H	α-helix	trans	-61.5	-44	177.7	-71.2	175.2	-177	0	0	112.3	P327 R328 D334 N335	P327-E331 WeakPolarHBondContact O-CG 3.3Å; P327-E331 PolarHBondContact O-N 2.97Å; P327-E331 VanDerWaalsContact O-N 3.08Å; R328-E331 PolarHBondContact O-N 3.3Å; E331-D334 PolarHBondContact O-N 3.46Å; E331-N335 VanDerWaalsContact O-CB 3.32Å; E331-N335 WeakPolarHBondContact O-CB 3.3Å; E331-N335 PolarHBondContact O-N 3.22Å; E331-N335 PolarHBondContact O-ND2 3.06Å; E331-N335 VanDerWaalsContact O-ND2 3.11Å
332	V	90	Very high	86.4	Confident	19 Å²	19	64.8 Å²	64.8	12%	0.115	33%	0.329	C	S	.	.	H	α-helix	trans	-65.1	-44	177.6	175.5	0	0	0	0	110.5	D264 A267 I268 R328 N335 A336	D264-V332 HydrophobicContact CB-CG1 3.83Å; A267-V332 HydrophobicContact CB-CG1 4.43Å; A267-V332 HydrophobicContact CB-CG2 4.22Å; I268-V332 HydrophobicContact CD1-CG1 4.03Å; I268-V332 HydrophobicContact CG1-CB 4.37Å; I268-V332 HydrophobicContact CG1-CG1 4Å; R328-V332 HydrophobicContact CG-CG2 4.13Å; R328-V332 VanDerWaalsContact O-CG2 3.26Å; R328-V332 WeakPolarHBondContact O-CG2 3.5Å; R328-V332 PolarHBondContact O-N 2.93Å; V332-N335 PolarHBondContact O-N 3.02Å; V332-A336 PolarHBondContact O-N 3.19Å
333	L	88.2	Confident	85.8	Confident	1 Å²	1	62.6 Å²	62.6	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-61.4	-47.2	176	-180	60.8	0	0	0	112	M256 I268 C329 Q330 N335 A336 L337 V375 L379 P380	M256-L333 HydrophobicContact CE-CD1 3.81Å; M256-L333 HydrophobicContact SD-CD1 4.25Å; I268-L333 HydrophobicContact CD1-CB 4.28Å; I268-L333 HydrophobicContact CD1-CD1 4.28Å; I268-L333 HydrophobicContact CG1-CB 4.38Å; C329-L333 PolarHBondContact O-N 3.46Å; Q330-L333 PolarHBondContact O-N 3.48Å; L333-N335 VanDerWaalsContact C-N 3.31Å; L333-N335 PolarHBondContact O-N 3.01Å; L333-A336 PolarHBondContact O-N 3.3Å; L333-L337 HydrophobicContact CD1-CD1 4.08Å; L333-L337 HydrophobicContact CD1-CG 4.28Å; L333-L337 HydrophobicContact CG-CD1 4.11Å; L333-L337 WeakPolarHBondContact O-CG 3.3Å; L333-L337 PolarHBondContact O-N 2.92Å; L333-V375 HydrophobicContact CD1-CG1 4.46Å; L333-L379 HydrophobicContact CD1-CD2 4.31Å; L333-P380 HydrophobicContact CD2-CG 3.78Å
334	D	87	Confident	84.9	Confident	58 Å²	58	66 Å²	66	31%	0.31	33%	0.333	S	S	.	.	H	α-helix	trans	-63	-38.1	178.3	-74.4	-8.1	0	0	0	111.5	Q330 E331 L337 R338	Q330-D334 PolarHBondContact NE2-OD1 3.24Å; Q330-D334 WeakPolarHBondContact O-CB 3.45Å; Q330-D334 VanDerWaalsContact O-CG 3.27Å; Q330-D334 PolarHBondContact O-N 3.5Å; E331-D334 PolarHBondContact O-N 3.46Å; D334-L337 PolarHBondContact O-N 2.94Å; D334-R338 VanDerWaalsContact O-CG 3.28Å; D334-R338 WeakPolarHBondContact O-CG 3.45Å; D334-R338 PolarHBondContact O-N 3.49Å; D334-R338 VanDerWaalsContact O-N 3.11Å
335	N	87.7	Confident	84.1	Confident	87 Å²	87	66.5 Å²	66.5	47%	0.465	33%	0.334	S	S	.	.	H	α-helix	trans	-66.9	-41.3	176.4	-73.6	-26.5	0	0	0	112.2	E331 V332 L333 L337 R338	E331-N335 VanDerWaalsContact O-CB 3.32Å; E331-N335 WeakPolarHBondContact O-CB 3.3Å; E331-N335 PolarHBondContact O-N 3.22Å; E331-N335 PolarHBondContact O-ND2 3.06Å; E331-N335 VanDerWaalsContact O-ND2 3.11Å; V332-N335 PolarHBondContact O-N 3.02Å; L333-N335 VanDerWaalsContact C-N 3.31Å; L333-N335 PolarHBondContact O-N 3.01Å; N335-L337 VanDerWaalsContact C-N 3.34Å; N335-R338 PolarHBondContact O-N 3.34Å
336	A	85.2	Confident	83.5	Confident	11 Å²	11	64.5 Å²	64.5	9%	0.091	32%	0.323	C	S	.	.	H	α-helix	trans	-62.2	-42.6	174.5	0	0	0	0	0	111.3	M256 V332 L333 R338 Q339	M256-A336 HydrophobicContact CE-CB 4.34Å; V332-A336 PolarHBondContact O-N 3.19Å; L333-A336 PolarHBondContact O-N 3.3Å; A336-R338 VanDerWaalsContact C-N 3.31Å; A336-R338 PolarHBondContact O-N 3.41Å; A336-Q339 PolarHBondContact O-N 3.43Å
337	L	85.3	Confident	82.6	Confident	9 Å²	9	63.4 Å²	63.4	5%	0.047	32%	0.316	C	S	.	.	H	α-helix	trans	-74.1	-14.3	-179.5	-67.7	176.6	0	0	0	114.7	L333 D334 N335 Q339 V343 L346 Y372 V375 K376	L333-L337 HydrophobicContact CD1-CD1 4.08Å; L333-L337 HydrophobicContact CD1-CG 4.28Å; L333-L337 HydrophobicContact CG-CD1 4.11Å; L333-L337 WeakPolarHBondContact O-CG 3.3Å; L333-L337 PolarHBondContact O-N 2.92Å; D334-L337 PolarHBondContact O-N 2.94Å; N335-L337 VanDerWaalsContact C-N 3.34Å; L337-Q339 VanDerWaalsContact C-N 3.33Å; L337-V343 WeakPolarHBondContact O-CG2 3.4Å; L337-L346 HydrophobicContact CD2-CD1 3.72Å; L337-Y372 HydrophobicContact CD2-CD2 4.42Å; L337-Y372 HydrophobicContact CD2-CE2 4.07Å; L337-V375 HydrophobicContact CD1-CG1 4.48Å; L337-V375 HydrophobicContact CD2-CG1 3.89Å; L337-K376 HydrophobicContact CD1-CB 4.01Å; L337-K376 HydrophobicContact CD1-CG 4.21Å
338	R	83.8	Confident	81.4	Confident	185 Å²	185	62.8 Å²	62.8	70%	0.698	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-18.4	172.9	-78.3	171.2	-169.4	-177	6	113.2	D334 N335 A336 P340	D334-R338 VanDerWaalsContact O-CG 3.28Å; D334-R338 WeakPolarHBondContact O-CG 3.45Å; D334-R338 PolarHBondContact O-N 3.49Å; D334-R338 VanDerWaalsContact O-N 3.11Å; N335-R338 PolarHBondContact O-N 3.34Å; A336-R338 VanDerWaalsContact C-N 3.31Å; A336-R338 PolarHBondContact O-N 3.41Å; R338-P340 WeakPolarHBondContact O-CD 3.33Å
339	Q	83.2	Confident	79.7	Confident	99 Å²	99	64.1 Å²	64.1	46%	0.463	32%	0.315	S	S	.	.			trans	-73	120.2	-178.8	-62.1	-171.3	11.7	0	0	110.4	A336 L337 T341 V342 V343	A336-Q339 PolarHBondContact O-N 3.43Å; L337-Q339 VanDerWaalsContact C-N 3.33Å; Q339-T341 PolarHBondContact O-N 2.95Å; Q339-T341 VanDerWaalsContact O-N 3.15Å; Q339-V342 HydrophobicContact CB-CB 4.2Å; Q339-V342 HydrophobicContact CB-CG2 3.86Å; Q339-V342 WeakPolarHBondContact O-CB 3.34Å; Q339-V342 PolarHBondContact O-N 3.14Å; Q339-V343 PolarHBondContact O-N 3.37Å; Q339-V343 VanDerWaalsContact O-N 3.12Å
340	P	79.7	Confident	78.3	Confident	96 Å²	96	63.9 Å²	63.9	62%	0.623	31%	0.313	S	S	*	.	H	α-helix	trans	-59.6	-30.5	-176.7	-26	34.9	0	0	0	114	R338 V343 Q344	R338-P340 WeakPolarHBondContact O-CD 3.33Å; P340-V343 PolarHBondContact O-N 2.9Å; P340-Q344 WeakPolarHBondContact O-CG 3.06Å; P340-Q344 PolarHBondContact O-N 3.44Å
341	T	79.4	Confident	76.8	Confident	96 Å²	96	61.9 Å²	61.9	59%	0.589	30%	0.304	S	S	*	.	H	α-helix	trans	-63	-42.7	175.5	45.1	0	0	0	0	112	Q339 H345	Q339-T341 PolarHBondContact O-N 2.95Å; Q339-T341 VanDerWaalsContact O-N 3.15Å; T341-H345 WeakPolarHBondContact O-CB 3.4Å; T341-H345 PolarHBondContact O-N 3.2Å
342	V	80.1	Confident	75	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.012	28%	0.283	C	S	.	.	H	α-helix	trans	-68.1	-44.9	177.4	176.6	0	0	0	0	110.3	F259 Q339 Q344 H345 L346	F259-V342 HydrophobicContact CB-CG2 4.19Å; F259-V342 HydrophobicContact CD1-CG1 4.45Å; F259-V342 HydrophobicContact CD2-CB 4.33Å; F259-V342 HydrophobicContact CD2-CG1 3.85Å; F259-V342 HydrophobicContact CD2-CG2 3.51Å; F259-V342 HydrophobicContact CE1-CG1 4.07Å; F259-V342 HydrophobicContact CE2-CB 4.36Å; F259-V342 HydrophobicContact CE2-CG1 3.43Å; F259-V342 VanDerWaalsContact CE2-CG1 3.43Å; F259-V342 HydrophobicContact CE2-CG2 3.98Å; F259-V342 HydrophobicContact CG-CG1 4.34Å; F259-V342 HydrophobicContact CG-CG2 3.88Å; F259-V342 HydrophobicContact CZ-CG1 3.52Å; Q339-V342 HydrophobicContact CB-CB 4.2Å; Q339-V342 HydrophobicContact CB-CG2 3.86Å; Q339-V342 WeakPolarHBondContact O-CB 3.34Å; Q339-V342 PolarHBondContact O-N 3.14Å; V342-Q344 PolarHBondContact O-N 3.44Å; V342-H345 WeakPolarHBondContact O-CB 3.36Å; V342-H345 PolarHBondContact O-N 2.95Å; V342-L346 HydrophobicContact CG1-CD1 3.76Å; V342-L346 HydrophobicContact CG1-CG 4.22Å; V342-L346 WeakPolarHBondContact O-CG 2.99Å; V342-L346 PolarHBondContact O-N 3.41Å
343	V	77.8	Confident	73.1	Confident	25 Å²	25	57 Å²	57	15%	0.152	28%	0.282	C	S	.	.	H	α-helix	trans	-57.7	-51.6	177.4	179.7	0	0	0	0	110.9	L337 Q339 P340 H345 L346 E347 Y372	L337-V343 WeakPolarHBondContact O-CG2 3.4Å; Q339-V343 PolarHBondContact O-N 3.37Å; Q339-V343 VanDerWaalsContact O-N 3.12Å; P340-V343 PolarHBondContact O-N 2.9Å; V343-H345 VanDerWaalsContact C-N 3.27Å; V343-H345 PolarHBondContact O-N 3.01Å; V343-L346 PolarHBondContact O-N 3.4Å; V343-E347 HydrophobicContact CG1-CG 4.19Å; V343-E347 WeakPolarHBondContact O-CB 3.34Å; V343-E347 VanDerWaalsContact O-CG 3.3Å; V343-E347 WeakPolarHBondContact O-CG 3.31Å; V343-E347 PolarHBondContact O-N 2.89Å; V343-Y372 HydrophobicContact CB-CE2 4.29Å; V343-Y372 HydrophobicContact CG1-CD2 4.25Å; V343-Y372 HydrophobicContact CG1-CE2 4.04Å; V343-Y372 HydrophobicContact CG2-CE2 3.79Å
344	Q	73.2	Confident	71.6	Confident	126 Å²	126	57.7 Å²	57.7	59%	0.589	29%	0.285	S	S	*	.	H	α-helix	trans	-60.6	-37.3	177.9	-72.9	176.6	1	0	0	112.6	P340 V342 V348	P340-Q344 WeakPolarHBondContact O-CG 3.06Å; P340-Q344 PolarHBondContact O-N 3.44Å; V342-Q344 PolarHBondContact O-N 3.44Å; Q344-V348 PolarHBondContact O-N 3.31Å
345	H	71.4	Confident	69.9	Low	27 Å²	27	55.7 Å²	55.7	13%	0.125	28%	0.275	C	S	.	.	I	π-helix	trans	-64.9	-48	177	-173.2	98.9	0	0	0	111.2	E258 T341 V342 V343 R349 Y350	E258-H345 IonicContact OE2-CE1 2.78Å; E258-H345 PolarHBondContact OE2-CE1 3.27Å; E258-H345 IonicContact OE2-NE2 3.36Å; E258-H345 PolarHBondContact OE2-NE2 3.28Å; T341-H345 WeakPolarHBondContact O-CB 3.4Å; T341-H345 PolarHBondContact O-N 3.2Å; V342-H345 WeakPolarHBondContact O-CB 3.36Å; V342-H345 PolarHBondContact O-N 2.95Å; V343-H345 VanDerWaalsContact C-N 3.27Å; V343-H345 PolarHBondContact O-N 3.01Å; H345-R349 HydrophobicContact CB-CB 4.48Å; H345-R349 CarbonylContact O-C 3.52Å; H345-R349 WeakPolarHBondContact O-CA 3.44Å; H345-R349 WeakPolarHBondContact O-CB 3.03Å; H345-R349 PolarHBondContact O-N 2.9Å; H345-Y350 AromaticContact NE2-CD2 3.52Å; H345-Y350 PolarHBondContact O-N 3.45Å
346	L	75.1	Confident	67.9	Low	4 Å²	4	55.5 Å²	55.5	2%	0.021	27%	0.27	C	S	.	.	I	π-helix	trans	-70.4	-30.3	-179.4	-65.3	175.5	0	0	0	113	F259 L337 V342 V343 Y371 Y372 V375	F259-L346 HydrophobicContact CE1-CD2 4.13Å; F259-L346 HydrophobicContact CZ-CD1 4.42Å; F259-L346 HydrophobicContact CZ-CD2 4.4Å; L337-L346 HydrophobicContact CD2-CD1 3.72Å; V342-L346 HydrophobicContact CG1-CD1 3.76Å; V342-L346 HydrophobicContact CG1-CG 4.22Å; V342-L346 WeakPolarHBondContact O-CG 2.99Å; V342-L346 PolarHBondContact O-N 3.41Å; V343-L346 PolarHBondContact O-N 3.4Å; L346-Y371 HydrophobicContact CB-CD1 4.5Å; L346-Y371 HydrophobicContact CD2-CD1 4.08Å; L346-Y371 HydrophobicContact CD2-CE1 3.71Å; L346-Y372 HydrophobicContact CB-CD2 4.22Å; L346-Y372 HydrophobicContact CD1-CD2 4.15Å; L346-V375 HydrophobicContact CD1-CB 4.39Å; L346-V375 HydrophobicContact CD1-CG1 4.33Å; L346-V375 HydrophobicContact CD1-CG2 4.33Å; L346-V375 HydrophobicContact CD2-CG2 4.34Å
347	E	69.2	Low	66.2	Low	55 Å²	55	62.4 Å²	62.4	26%	0.257	30%	0.298	S	S	.	.	I	π-helix	trans	-77.2	-43.4	178	-74.6	-178.7	158.3	0	0	113.1	V343 N369 Y372	V343-E347 HydrophobicContact CG1-CG 4.19Å; V343-E347 WeakPolarHBondContact O-CB 3.34Å; V343-E347 VanDerWaalsContact O-CG 3.3Å; V343-E347 WeakPolarHBondContact O-CG 3.31Å; V343-E347 PolarHBondContact O-N 2.89Å; E347-N369 PolarHBondContact OE1-ND2 3.4Å; E347-Y372 HydrophobicContact CG-CG 4.15Å
348	V	61	Low	64.3	Low	79 Å²	79	64.1 Å²	64.1	48%	0.479	31%	0.311	S	S	.	.	I	π-helix	trans	-115.2	-41.2	-168.7	-175.5	0	0	0	0	112	Q344 L352	Q344-V348 PolarHBondContact O-N 3.31Å; V348-L352 HydrophobicContact CG1-CD1 4.34Å; V348-L352 WeakPolarHBondContact O-CD1 3.21Å
349	R	54	Low	62.1	Low	169 Å²	169	58.4 Å²	58.4	64%	0.638	31%	0.31	S	S	*	.	I	π-helix	trans	-98.2	-25.8	-158.6	-148	174.1	-177.8	170.7	-1.7	114.6	H345 L352 S353	H345-R349 HydrophobicContact CB-CB 4.48Å; H345-R349 CarbonylContact O-C 3.52Å; H345-R349 WeakPolarHBondContact O-CA 3.44Å; H345-R349 WeakPolarHBondContact O-CB 3.03Å; H345-R349 PolarHBondContact O-N 2.9Å; R349-L352 CarbonylContact O-C 3.54Å; R349-L352 WeakPolarHBondContact O-CA 2.83Å; R349-L352 VanDerWaalsContact O-CB 3.23Å; R349-L352 WeakPolarHBondContact O-CB 3.45Å; R349-L352 PolarHBondContact O-N 3.27Å; R349-S353 PolarHBondContact O-N 3.28Å
350	Y	57.2	Low	60	Low	2 Å²	2	60 Å²	60	1%	0.008	31%	0.313	C	S	.	.	H	α-helix	trans	-73.2	-41	-176.1	-164.3	-105.9	0	0	0	112.8	S255 H345 L352 S353 F354 Y371 M647	S255-Y350 VanDerWaalsContact CA-OH 3.3Å; S255-Y350 WeakPolarHBondContact CA-OH 3.47Å; S255-Y350 VanDerWaalsContact CB-CE1 3.4Å; S255-Y350 WeakPolarHBondContact CB-OH 3.31Å; S255-Y350 PolarHBondContact N-OH 3.46Å; H345-Y350 AromaticContact NE2-CD2 3.52Å; H345-Y350 PolarHBondContact O-N 3.45Å; Y350-L352 PolarHBondContact O-N 3.08Å; Y350-S353 WeakPolarHBondContact CA-OG 3.31Å; Y350-S353 PolarHBondContact O-N 3.35Å; Y350-S353 PolarHBondContact O-OG 2.65Å; Y350-F354 AromaticContact CE1-CD2 3.98Å; Y350-F354 HydrophobicContact CE1-CD2 3.98Å; Y350-F354 HydrophobicContact CE1-CE2 4.37Å; Y350-F354 PolarHBondContact O-N 3.32Å; Y350-F354 VanDerWaalsContact O-N 3.08Å; Y350-Y371 HydrophobicContact CD1-CD1 4.1Å; Y350-Y371 AromaticContact CD1-CE1 3.49Å; Y350-Y371 HydrophobicContact CD1-CE1 3.49Å; Y350-Y371 VanDerWaalsContact CD1-CE1 3.49Å; Y350-Y371 AromaticContact CD1-CZ 3.76Å; Y350-Y371 HydrophobicContact CE1-CE1 4.09Å; Y350-Y371 AromaticContact CE1-CZ 3.92Å; Y350-Y371 HydrophobicContact CG-CE1 4.07Å; Y350-M647 HydrophobicContact CD1-CE 4.02Å; Y350-M647 HydrophobicContact CE1-CE 3.76Å
351	M	56	Low	57.8	Low	32 Å²	32	65.3 Å²	65.3	16%	0.158	32%	0.322	C	S	.	.	H	α-helix	trans	-60.6	-34.2	169.9	-83.2	-104	-101.6	0	0	111.6	L355 F364 M643	M351-L355 WeakPolarHBondContact O-CG 3.03Å; M351-F364 HydrophobicContact CB-CD1 4.32Å; M351-F364 HydrophobicContact CE-CD1 4.35Å; M351-F364 HydrophobicContact CE-CE1 3.41Å; M351-F364 VanDerWaalsContact CE-CE1 3.41Å; M351-F364 HydrophobicContact CE-CZ 3.58Å; M351-F364 HydrophobicContact SD-CE1 4.46Å; M351-F364 HydrophobicContact SD-CZ 4.44Å; M351-M643 HydrophobicContact CE-CG 4.46Å; M351-M643 HydrophobicContact CE-SD 3.77Å; M351-M643 HydrophobicContact SD-CG 4.36Å; M351-M643 HydrophobicContact SD-SD 4.09Å
352	L	49.8	Very low	55.8	Low	18 Å²	18	62.8 Å²	62.8	9%	0.094	30%	0.304	C	S	.	.	H	α-helix	trans	-68.8	-48.8	174.2	-87.9	169.3	0	0	0	112	V348 R349 Y350 F354 L355 F356 I362 F364	V348-L352 HydrophobicContact CG1-CD1 4.34Å; V348-L352 WeakPolarHBondContact O-CD1 3.21Å; R349-L352 CarbonylContact O-C 3.54Å; R349-L352 WeakPolarHBondContact O-CA 2.83Å; R349-L352 VanDerWaalsContact O-CB 3.23Å; R349-L352 WeakPolarHBondContact O-CB 3.45Å; R349-L352 PolarHBondContact O-N 3.27Å; Y350-L352 PolarHBondContact O-N 3.08Å; L352-F354 VanDerWaalsContact C-N 3.27Å; L352-F354 PolarHBondContact O-N 3.32Å; L352-L355 CarbonylContact O-C 3.51Å; L352-L355 WeakPolarHBondContact O-CA 3.47Å; L352-L355 WeakPolarHBondContact O-CB 3.45Å; L352-L355 PolarHBondContact O-N 2.79Å; L352-F356 VanDerWaalsContact C-CD2 3.4Å; L352-F356 HydrophobicContact CB-CD2 3.96Å; L352-F356 HydrophobicContact CB-CE2 3.8Å; L352-F356 HydrophobicContact CD2-CD2 4.41Å; L352-F356 HydrophobicContact CD2-CE2 3.72Å; L352-F356 HydrophobicContact CD2-CZ 4.44Å; L352-F356 HydrophobicContact CG-CE2 4.28Å; L352-F356 WeakPolarHBondContact O-CD2 3.18Å; L352-F356 PolarHBondContact O-N 3.02Å; L352-I362 WeakPolarHBondContact CD2-O 3.48Å; L352-F364 HydrophobicContact CD1-CB 4.23Å; L352-F364 HydrophobicContact CD2-CB 3.75Å; L352-F364 HydrophobicContact CG-CB 3.65Å
353	S	51.7	Low	53.5	Low	15 Å²	15	69 Å²	69	11%	0.105	34%	0.342	C	S	.	.	H	α-helix	trans	-61.9	-36.4	-177.5	65.4	0	0	0	0	111.8	R349 Y350 L355 F356 F357	R349-S353 PolarHBondContact O-N 3.28Å; Y350-S353 WeakPolarHBondContact CA-OG 3.31Å; Y350-S353 PolarHBondContact O-N 3.35Å; Y350-S353 PolarHBondContact O-OG 2.65Å; S353-L355 PolarHBondContact O-N 3.35Å; S353-F356 PolarHBondContact O-N 3.38Å; S353-F356 VanDerWaalsContact O-N 3.08Å; S353-F357 PolarHBondContact O-N 3.21Å
354	F	55.1	Low	51.5	Low	16 Å²	16	69 Å²	69	7%	0.07	34%	0.34	C	S	.	.	H	α-helix	trans	-59.8	-29.9	172.6	-130.3	-87.2	0	0	0	113.6	Y350 L352 M647 C651	Y350-F354 AromaticContact CE1-CD2 3.98Å; Y350-F354 HydrophobicContact CE1-CD2 3.98Å; Y350-F354 HydrophobicContact CE1-CE2 4.37Å; Y350-F354 PolarHBondContact O-N 3.32Å; Y350-F354 VanDerWaalsContact O-N 3.08Å; L352-F354 VanDerWaalsContact C-N 3.27Å; L352-F354 PolarHBondContact O-N 3.32Å; F354-M647 HydrophobicContact CD2-CE 4.24Å; F354-C651 WeakPolarHBondContact CZ-SG 3.39Å
355	L	51.4	Low	49.7	Very low	16 Å²	16	72.1 Å²	72.1	8%	0.084	36%	0.355	C	S	.	.	H	α-helix	trans	-88.5	-29.4	174	-63.8	169.3	0	0	0	111.9	A86 K90 M351 L352 S353 F357 F364	A86-L355 HydrophobicContact CB-CD1 4.12Å; K90-L355 HydrophobicContact CD-CD2 4.07Å; M351-L355 WeakPolarHBondContact O-CG 3.03Å; L352-L355 CarbonylContact O-C 3.51Å; L352-L355 WeakPolarHBondContact O-CA 3.47Å; L352-L355 WeakPolarHBondContact O-CB 3.45Å; L352-L355 PolarHBondContact O-N 2.79Å; S353-L355 PolarHBondContact O-N 3.35Å; L355-F357 PolarHBondContact O-N 2.97Å; L355-F364 HydrophobicContact CD1-CD2 4.23Å
356	F	46.4	Very low	48.2	Very low	83 Å²	83	72.5 Å²	72.5	36%	0.364	36%	0.363	S	S	.	.	H	α-helix	trans	-70.2	-25.2	-175.7	-89.2	-70.7	0	0	0	115.5	L352 S353 S358 G359 Y361	L352-F356 VanDerWaalsContact C-CD2 3.4Å; L352-F356 HydrophobicContact CB-CD2 3.96Å; L352-F356 HydrophobicContact CB-CE2 3.8Å; L352-F356 HydrophobicContact CD2-CD2 4.41Å; L352-F356 HydrophobicContact CD2-CE2 3.72Å; L352-F356 HydrophobicContact CD2-CZ 4.44Å; L352-F356 HydrophobicContact CG-CE2 4.28Å; L352-F356 WeakPolarHBondContact O-CD2 3.18Å; L352-F356 PolarHBondContact O-N 3.02Å; S353-F356 PolarHBondContact O-N 3.38Å; S353-F356 VanDerWaalsContact O-N 3.08Å; F356-S358 PolarHBondContact O-N 2.88Å; F356-G359 PolarHBondContact O-N 3.06Å; F356-G359 VanDerWaalsContact O-N 3.09Å; F356-Y361 AromaticContact CE1-CD1 3.71Å; F356-Y361 HydrophobicContact CE1-CD1 3.71Å; F356-Y361 HydrophobicContact CE1-CE1 4.11Å; F356-Y361 HydrophobicContact CE1-CG 4.38Å; F356-Y361 HydrophobicContact CZ-CD1 4.17Å
357	F	49	Very low	46.7	Very low	156 Å²	156	81.4 Å²	81.4	68%	0.684	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-3.3	-177.7	-97.2	-84.1	0	0	0	114.6	S353 L355	S353-F357 PolarHBondContact O-N 3.21Å; L355-F357 PolarHBondContact O-N 2.97Å
358	S	45.1	Very low	45.9	Very low	46 Å²	46	80 Å²	80	32%	0.322	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	16.4	173.8	85.6	0	0	0	0	116.4	F356 Y360	F356-S358 PolarHBondContact O-N 2.88Å; S358-Y360 WeakPolarHBondContact O-CD2 3.37Å
359	G	38.6	Very low	45.7	Very low	65 Å²	65	79.9 Å²	79.9	67%	0.67	40%	0.401	S	S	*	.	S	Bend	trans	82.4	16.8	163.6	0	0	0	0	0	118.1	F356	F356-G359 PolarHBondContact O-N 3.06Å; F356-G359 VanDerWaalsContact O-N 3.09Å
360	Y	39.2	Very low	46.5	Very low	133 Å²	133	72.5 Å²	72.5	52%	0.522	38%	0.377	S	S	.	.			trans	-128.3	139.6	175.2	-70.7	-88.3	0	0	0	111.9	V97 S358 I362	V97-Y360 HydrophobicContact CG2-CE2 4.42Å; S358-Y360 WeakPolarHBondContact O-CD2 3.37Å; Y360-I362 PolarHBondContact O-N 3.25Å
361	Y	32.1	Very low	47.5	Very low	207 Å²	207	72.8 Å²	72.8	81%	0.812	38%	0.378	S	S	*	.			trans	-81.2	112	178.8	-65.7	-91.2	0	0	0	110.4	F356	F356-Y361 AromaticContact CE1-CD1 3.71Å; F356-Y361 HydrophobicContact CE1-CD1 3.71Å; F356-Y361 HydrophobicContact CE1-CE1 4.11Å; F356-Y361 HydrophobicContact CE1-CG 4.38Å; F356-Y361 HydrophobicContact CZ-CD1 4.17Å
362	I	37.9	Very low	48.8	Very low	42 Å²	42	72.7 Å²	72.7	22%	0.215	38%	0.377	C	S	.	.			trans	-120.7	114	159.9	-62.4	175.5	0	0	0	105.9	V89 L352 Y360	V89-I362 HydrophobicContact CG1-CD1 4.29Å; L352-I362 WeakPolarHBondContact CD2-O 3.48Å; Y360-I362 PolarHBondContact O-N 3.25Å
363	T	33.3	Very low	50.4	Low	133 Å²	133	72.3 Å²	72.3	82%	0.816	38%	0.375	S	S	*	.			trans	-77.9	124.3	175.4	41.6	0	0	0	0	110
364	F	35	Very low	51.9	Low	25 Å²	25	71.6 Å²	71.6	11%	0.11	37%	0.37	C	S	.	.			trans	-101.8	119.2	-177.8	-151.5	-95.4	0	0	0	107.5	A82 A86 M351 L352 L355 A366	A82-F364 HydrophobicContact CB-CZ 4.29Å; A86-F364 HydrophobicContact CB-CE2 4.04Å; M351-F364 HydrophobicContact CB-CD1 4.32Å; M351-F364 HydrophobicContact CE-CD1 4.35Å; M351-F364 HydrophobicContact CE-CE1 3.41Å; M351-F364 VanDerWaalsContact CE-CE1 3.41Å; M351-F364 HydrophobicContact CE-CZ 3.58Å; M351-F364 HydrophobicContact SD-CE1 4.46Å; M351-F364 HydrophobicContact SD-CZ 4.44Å; L352-F364 HydrophobicContact CD1-CB 4.23Å; L352-F364 HydrophobicContact CD2-CB 3.75Å; L352-F364 HydrophobicContact CG-CB 3.65Å; L355-F364 HydrophobicContact CD1-CD2 4.23Å; F364-A366 VanDerWaalsContact CD1-CA 3.49Å; F364-A366 HydrophobicContact CD1-CB 3.48Å; F364-A366 VanDerWaalsContact CD1-CB 3.48Å; F364-A366 HydrophobicContact CE1-CB 3.35Å
365	Q	35.8	Very low	53.5	Low	191 Å²	191	70.8 Å²	70.8	89%	0.893	37%	0.366	S	S	*	.			trans	-98.4	88.5	153.6	-80.7	-176.9	-36.3	0	0	105.8	Q367	Q365-Q367 VanDerWaalsContact C-N 3.33Å; Q365-Q367 PolarHBondContact O-N 3.46Å
366	A	40	Very low	55.2	Low	36 Å²	36	72.2 Å²	72.2	30%	0.298	37%	0.372	S	S	.	.			trans	-62.3	104.2	163.1	0	0	0	0	0	105.4	F364 G368	F364-A366 VanDerWaalsContact CD1-CA 3.49Å; F364-A366 HydrophobicContact CD1-CB 3.48Å; F364-A366 VanDerWaalsContact CD1-CB 3.48Å; F364-A366 HydrophobicContact CE1-CB 3.35Å; A366-G368 VanDerWaalsContact C-N 3.26Å; A366-G368 PolarHBondContact O-N 3.5Å
367	Q	43	Very low	57.1	Low	191 Å²	191	68.9 Å²	68.9	89%	0.893	36%	0.357	S	S	*	.	S	Bend	trans	-64.8	98.8	157.8	-76	-176.9	-13.4	0	0	106.4	Q365	Q365-Q367 VanDerWaalsContact C-N 3.33Å; Q365-Q367 PolarHBondContact O-N 3.46Å
368	G	51.9	Low	58.8	Low	26 Å²	26	61.7 Å²	61.7	27%	0.268	33%	0.326	S	S	.	.	S	Bend	trans	132.8	126.3	167.5	0	0	0	0	0	114	A366 G370	A366-G368 VanDerWaalsContact C-N 3.26Å; A366-G368 PolarHBondContact O-N 3.5Å; G368-G370 PolarHBondContact O-N 2.82Å
369	N	58.1	Low	60.9	Low	76 Å²	76	59.5 Å²	59.5	41%	0.406	31%	0.31	S	S	.	.			trans	-67.4	27.3	176	-63.5	-2.3	0	0	0	113.3	E347 Y371 Y372 L373	E347-N369 PolarHBondContact OE1-ND2 3.4Å; N369-Y371 PolarHBondContact O-N 3.31Å; N369-Y372 PolarHBondContact O-N 3.21Å; N369-L373 HydrophobicContact CB-CD1 4.16Å; N369-L373 HydrophobicContact CB-CG 4.22Å; N369-L373 WeakPolarHBondContact O-CB 3.12Å; N369-L373 WeakPolarHBondContact O-CG 3.3Å; N369-L373 PolarHBondContact O-N 3.09Å
370	G	69.5	Low	63.3	Low	13 Å²	13	57.3 Å²	57.3	13%	0.134	29%	0.285	C	S	.	.	H	α-helix	trans	-64.6	-42.7	-164	0	0	0	0	0	114.2	G368 A374	G368-G370 PolarHBondContact O-N 2.82Å; G370-A374 WeakPolarHBondContact O-CB 3.47Å; G370-A374 PolarHBondContact O-N 2.68Å
371	Y	79.2	Confident	65.5	Low	8 Å²	8	52.8 Å²	52.8	3%	0.031	27%	0.268	C	S	.	.	H	α-helix	trans	-71.1	-46.7	179.2	-172.9	-106.5	0	0	0	111.7	V251 F252 S255 L346 Y350 N369 L373 A374 V375 M643 L644 M647	V251-Y371 HydrophobicContact CG1-CE2 4.07Å; V251-Y371 PolarHBondContact O-OH 3.28Å; F252-Y371 HydrophobicContact CE1-CE2 4.4Å; S255-Y371 VanDerWaalsContact CB-OH 3.23Å; S255-Y371 WeakPolarHBondContact CB-OH 3.29Å; S255-Y371 PolarHBondContact OG-OH 3.45Å; L346-Y371 HydrophobicContact CB-CD1 4.5Å; L346-Y371 HydrophobicContact CD2-CD1 4.08Å; L346-Y371 HydrophobicContact CD2-CE1 3.71Å; Y350-Y371 HydrophobicContact CD1-CD1 4.1Å; Y350-Y371 AromaticContact CD1-CE1 3.49Å; Y350-Y371 HydrophobicContact CD1-CE1 3.49Å; Y350-Y371 VanDerWaalsContact CD1-CE1 3.49Å; Y350-Y371 AromaticContact CD1-CZ 3.76Å; Y350-Y371 HydrophobicContact CE1-CE1 4.09Å; Y350-Y371 AromaticContact CE1-CZ 3.92Å; Y350-Y371 HydrophobicContact CG-CE1 4.07Å; N369-Y371 PolarHBondContact O-N 3.31Å; Y371-L373 VanDerWaalsContact C-N 3.31Å; Y371-L373 PolarHBondContact O-N 2.91Å; Y371-A374 CarbonylContact O-C 3.59Å; Y371-A374 WeakPolarHBondContact O-CA 3.36Å; Y371-A374 WeakPolarHBondContact O-CB 3.3Å; Y371-A374 PolarHBondContact O-N 3.27Å; Y371-V375 HydrophobicContact CD1-CG2 4.18Å; Y371-V375 HydrophobicContact CE1-CG2 3.83Å; Y371-V375 WeakPolarHBondContact O-CG2 3.31Å; Y371-V375 PolarHBondContact O-N 3.27Å; Y371-M643 HydrophobicContact CD2-CE 3.92Å; Y371-M643 HydrophobicContact CG-CE 4.47Å; Y371-L644 HydrophobicContact CD2-CD2 4.1Å; Y371-L644 HydrophobicContact CE2-CD2 4Å; Y371-M647 HydrophobicContact CD2-CE 4.47Å; Y371-M647 HydrophobicContact CD2-SD 4.44Å; Y371-M647 HydrophobicContact CE2-CE 4.08Å; Y371-M647 HydrophobicContact CE2-SD 4.42Å
372	Y	83	Confident	68.1	Low	30 Å²	30	43.8 Å²	43.8	12%	0.118	23%	0.234	C	C	.	.	H	α-helix	trans	-53.1	-48.8	172.8	168	-104	0	0	0	111.9	L337 V343 L346 E347 N369 A374 V375 K376	L337-Y372 HydrophobicContact CD2-CD2 4.42Å; L337-Y372 HydrophobicContact CD2-CE2 4.07Å; V343-Y372 HydrophobicContact CB-CE2 4.29Å; V343-Y372 HydrophobicContact CG1-CD2 4.25Å; V343-Y372 HydrophobicContact CG1-CE2 4.04Å; V343-Y372 HydrophobicContact CG2-CE2 3.79Å; L346-Y372 HydrophobicContact CB-CD2 4.22Å; L346-Y372 HydrophobicContact CD1-CD2 4.15Å; E347-Y372 HydrophobicContact CG-CG 4.15Å; N369-Y372 PolarHBondContact O-N 3.21Å; Y372-A374 VanDerWaalsContact C-N 3.29Å; Y372-A374 PolarHBondContact O-N 2.9Å; Y372-V375 PolarHBondContact O-N 3.12Å; Y372-V375 VanDerWaalsContact O-N 3.15Å; Y372-K376 HydrophobicContact CE1-CD 4.27Å; Y372-K376 PolarHBondContact O-N 3.35Å
373	L	83.1	Confident	70.6	Confident	10 Å²	10	42 Å²	42	5%	0.052	22%	0.224	C	C	.	.	H	α-helix	trans	-62.9	-35.3	177.1	-70.6	175.1	0	0	0	112.2	N369 Y371 K376 H377 E576 M632 L636	N369-L373 HydrophobicContact CB-CD1 4.16Å; N369-L373 HydrophobicContact CB-CG 4.22Å; N369-L373 WeakPolarHBondContact O-CB 3.12Å; N369-L373 WeakPolarHBondContact O-CG 3.3Å; N369-L373 PolarHBondContact O-N 3.09Å; Y371-L373 VanDerWaalsContact C-N 3.31Å; Y371-L373 PolarHBondContact O-N 2.91Å; L373-K376 PolarHBondContact O-N 3.47Å; L373-H377 PolarHBondContact O-N 3.24Å; L373-E576 HydrophobicContact CD2-CB 3.67Å; L373-E576 WeakPolarHBondContact CD2-OE2 3.27Å; L373-M632 HydrophobicContact CD2-CE 4.48Å; L373-L636 HydrophobicContact CB-CD1 3.75Å; L373-L636 HydrophobicContact CB-CD2 3.74Å; L373-L636 HydrophobicContact CB-CG 4.42Å; L373-L636 HydrophobicContact CD1-CD2 4.19Å; L373-L636 WeakPolarHBondContact O-CD1 3.29Å
374	A	84	Confident	73.2	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.193	C	C	.	.	I	π-helix	trans	-65.3	-41.8	172.8	0	0	0	0	0	111.9	G370 Y371 Y372 K376 L378 L379	G370-A374 WeakPolarHBondContact O-CB 3.47Å; G370-A374 PolarHBondContact O-N 2.68Å; Y371-A374 CarbonylContact O-C 3.59Å; Y371-A374 WeakPolarHBondContact O-CA 3.36Å; Y371-A374 WeakPolarHBondContact O-CB 3.3Å; Y371-A374 PolarHBondContact O-N 3.27Å; Y372-A374 VanDerWaalsContact C-N 3.29Å; Y372-A374 PolarHBondContact O-N 2.9Å; A374-K376 VanDerWaalsContact C-N 3.31Å; A374-K376 PolarHBondContact O-N 2.94Å; A374-L378 HydrophobicContact CB-CB 4.32Å; A374-L378 HydrophobicContact CB-CD2 4.36Å; A374-L378 CarbonylContact O-C 3.52Å; A374-L378 VanDerWaalsContact O-CA 3.31Å; A374-L378 WeakPolarHBondContact O-CA 3.48Å; A374-L378 WeakPolarHBondContact O-CB 3.34Å; A374-L378 PolarHBondContact O-N 3.44Å; A374-L379 PolarHBondContact O-N 3.13Å
375	V	87.2	Confident	75.6	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.19	C	C	.	.	I	π-helix	trans	-62.7	-40	173.7	-176.9	0	0	0	0	110.8	F252 L333 L337 L346 Y371 Y372 L379	F252-V375 HydrophobicContact CD1-CG2 4.09Å; F252-V375 HydrophobicContact CE1-CG2 4.17Å; L333-V375 HydrophobicContact CD1-CG1 4.46Å; L337-V375 HydrophobicContact CD1-CG1 4.48Å; L337-V375 HydrophobicContact CD2-CG1 3.89Å; L346-V375 HydrophobicContact CD1-CB 4.39Å; L346-V375 HydrophobicContact CD1-CG1 4.33Å; L346-V375 HydrophobicContact CD1-CG2 4.33Å; L346-V375 HydrophobicContact CD2-CG2 4.34Å; Y371-V375 HydrophobicContact CD1-CG2 4.18Å; Y371-V375 HydrophobicContact CE1-CG2 3.83Å; Y371-V375 WeakPolarHBondContact O-CG2 3.31Å; Y371-V375 PolarHBondContact O-N 3.27Å; Y372-V375 PolarHBondContact O-N 3.12Å; Y372-V375 VanDerWaalsContact O-N 3.15Å; V375-L379 HydrophobicContact CG1-CD2 4.09Å; V375-L379 WeakPolarHBondContact O-CB 3.23Å
376	K	87.5	Confident	78.2	Confident	46 Å²	46	27.4 Å²	27.4	20%	0.2	15%	0.147	C	C	.	.	I	π-helix	trans	-71	-45.6	-178	-172.8	175.6	176.9	-173.6	0	114	L337 Y372 L373 A374 E576	L337-K376 HydrophobicContact CD1-CB 4.01Å; L337-K376 HydrophobicContact CD1-CG 4.21Å; Y372-K376 HydrophobicContact CE1-CD 4.27Å; Y372-K376 PolarHBondContact O-N 3.35Å; L373-K376 PolarHBondContact O-N 3.47Å; A374-K376 VanDerWaalsContact C-N 3.31Å; A374-K376 PolarHBondContact O-N 2.94Å; K376-E576 WeakPolarHBondContact CD-OE2 3.49Å; K376-E576 WeakPolarHBondContact CE-OE2 3.38Å; K376-E576 IonicContact NZ-OE1 2.93Å; K376-E576 PolarHBondContact NZ-OE1 2.96Å; K376-E576 IonicContact NZ-OE2 3.88Å; K376-E576 PolarHBondContact NZ-OE2 3.26Å
377	H	86.3	Confident	80.4	Confident	12 Å²	12	25.7 Å²	25.7	6%	0.056	13%	0.133	C	C	.	.	I	π-helix	trans	-110.7	-31.4	-171.2	-62.6	-74.7	0	0	0	114.1	L373 E576 M632 A633 L636	L373-H377 PolarHBondContact O-N 3.24Å; H377-E576 IonicContact CD2-OE2 2.72Å; H377-E576 IonicContact CE1-OE1 3.69Å; H377-E576 PolarHBondContact CE1-OE1 3.15Å; H377-E576 IonicContact CE1-OE2 3.18Å; H377-E576 IonicContact NE2-OE1 2.65Å; H377-E576 PolarHBondContact NE2-OE1 3.42Å; H377-E576 IonicContact NE2-OE2 3.29Å; H377-E576 PolarHBondContact NE2-OE2 3.32Å; H377-M632 HydrophobicContact CB-CB 4.05Å; H377-A633 HydrophobicContact CB-CB 4.48Å; H377-A633 VanDerWaalsContact O-CB 3.3Å; H377-A633 WeakPolarHBondContact O-CB 3.23Å; H377-L636 HydrophobicContact CB-CD1 3.94Å
378	L	85.7	Confident	82.4	Confident	5 Å²	5	20.1 Å²	20.1	3%	0.026	11%	0.105	C	C	.	.	I	π-helix	trans	-89.1	-43.3	-175.9	-179.9	62.5	0	0	0	112.4	A374 K381 L382 M637 L644	A374-L378 HydrophobicContact CB-CB 4.32Å; A374-L378 HydrophobicContact CB-CD2 4.36Å; A374-L378 CarbonylContact O-C 3.52Å; A374-L378 VanDerWaalsContact O-CA 3.31Å; A374-L378 WeakPolarHBondContact O-CA 3.48Å; A374-L378 WeakPolarHBondContact O-CB 3.34Å; A374-L378 PolarHBondContact O-N 3.44Å; L378-K381 WeakPolarHBondContact O-CB 3.34Å; L378-K381 PolarHBondContact O-N 3.34Å; L378-L382 HydrophobicContact CD1-CG 4.33Å; L378-L382 HydrophobicContact CD2-CD1 4.45Å; L378-L382 HydrophobicContact CG-CD1 4.04Å; L378-L382 HydrophobicContact CG-CG 4.17Å; L378-L382 PolarHBondContact O-N 3.16Å; L378-M637 HydrophobicContact CD1-CB 3.91Å; L378-M637 HydrophobicContact CD1-CG 4.42Å; L378-M637 HydrophobicContact CD2-CB 4.35Å; L378-L644 HydrophobicContact CD2-CD1 3.81Å
379	L	89.2	Confident	84.1	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-54.9	-45.8	-179.7	175.1	62.1	0	0	0	113.2	F252 M256 F269 L333 A374 V375 K381 L382 L383	F252-L379 HydrophobicContact CB-CD1 3.81Å; F252-L379 HydrophobicContact CB-CD2 4.36Å; F252-L379 HydrophobicContact CD1-CB 4.1Å; F252-L379 HydrophobicContact CD1-CD1 4.09Å; F252-L379 HydrophobicContact CD1-CD2 4.25Å; F252-L379 HydrophobicContact CD1-CG 4.38Å; F252-L379 HydrophobicContact CD2-CD1 4.31Å; F252-L379 HydrophobicContact CE1-CB 4.22Å; F252-L379 HydrophobicContact CG-CD1 3.83Å; M256-L379 HydrophobicContact SD-CD2 4.15Å; F269-L379 HydrophobicContact CE1-CD1 4.07Å; F269-L379 HydrophobicContact CE1-CD2 4.46Å; F269-L379 HydrophobicContact CZ-CD2 4.2Å; L333-L379 HydrophobicContact CD1-CD2 4.31Å; A374-L379 PolarHBondContact O-N 3.13Å; V375-L379 HydrophobicContact CG1-CD2 4.09Å; V375-L379 WeakPolarHBondContact O-CB 3.23Å; L379-K381 PolarHBondContact O-N 3.45Å; L379-K381 VanDerWaalsContact O-N 3.15Å; L379-L382 WeakPolarHBondContact O-CA 3.33Å; L379-L382 WeakPolarHBondContact O-CB 3.3Å; L379-L382 PolarHBondContact O-N 3.29Å; L379-L383 HydrophobicContact CD1-CD1 4.38Å; L379-L383 HydrophobicContact CD1-CD2 4.22Å; L379-L383 HydrophobicContact CD1-CG 4Å; L379-L383 HydrophobicContact CG-CD1 4.25Å; L379-L383 HydrophobicContact CG-CG 4.34Å; L379-L383 WeakPolarHBondContact O-CG 3.4Å; L379-L383 PolarHBondContact O-N 2.94Å
380	P	88.2	Confident	85.5	Confident	20 Å²	20	15.5 Å²	15.5	13%	0.13	7%	0.074	C	C	.	.	H	α-helix	trans	-55.5	-34.4	175.6	-27	34.8	0	0	0	113.6	L333	L333-P380 HydrophobicContact CD2-CG 3.78Å
381	K	85	Confident	86.3	Confident	37 Å²	37	16.8 Å²	16.8	16%	0.161	8%	0.077	C	C	.	.	H	α-helix	trans	-77.2	-31.9	177.2	-57.1	-59.5	-174.3	-179.2	0	112.1	L378 L379 L384 L445 A633	L378-K381 WeakPolarHBondContact O-CB 3.34Å; L378-K381 PolarHBondContact O-N 3.34Å; L379-K381 PolarHBondContact O-N 3.45Å; L379-K381 VanDerWaalsContact O-N 3.15Å; K381-L384 PolarHBondContact O-N 3.44Å; K381-L445 HydrophobicContact CB-CD2 4.41Å; K381-A633 HydrophobicContact CG-CB 3.89Å
382	L	86.8	Confident	86.5	Confident	19 Å²	19	17.5 Å²	17.5	10%	0.099	8%	0.08	C	C	.	.	H	α-helix	trans	-69.6	-37.1	174.4	-68	177.1	0	0	0	112.2	I248 F252 L378 L379 L384 R385	I248-L382 HydrophobicContact CD1-CB 4.32Å; I248-L382 WeakPolarHBondContact CD1-O 3.5Å; I248-L382 HydrophobicContact CG1-CB 4.2Å; F252-L382 HydrophobicContact CD2-CD1 4.15Å; F252-L382 HydrophobicContact CE2-CD1 3.44Å; F252-L382 VanDerWaalsContact CE2-CD1 3.44Å; F252-L382 HydrophobicContact CZ-CD1 3.9Å; L378-L382 HydrophobicContact CD1-CG 4.33Å; L378-L382 HydrophobicContact CD2-CD1 4.45Å; L378-L382 HydrophobicContact CG-CD1 4.04Å; L378-L382 HydrophobicContact CG-CG 4.17Å; L378-L382 PolarHBondContact O-N 3.16Å; L379-L382 WeakPolarHBondContact O-CA 3.33Å; L379-L382 WeakPolarHBondContact O-CB 3.3Å; L379-L382 PolarHBondContact O-N 3.29Å; L382-L384 PolarHBondContact O-N 3.5Å; L382-R385 HydrophobicContact CD2-CG 4.42Å; L382-R385 WeakPolarHBondContact O-CB 3.22Å; L382-R385 WeakPolarHBondContact O-CG 3.44Å; L382-R385 PolarHBondContact O-N 3.1Å
383	L	90.3	Very high	86.7	Confident	4 Å²	4	16.2 Å²	16.2	2%	0.021	8%	0.075	C	C	.	.	H	α-helix	trans	-63.1	-23.1	176	-67.1	173.1	0	0	0	113	I248 I268 F269 Y320 V324 L379 R385 P386	I248-L383 HydrophobicContact CG2-CD2 4.04Å; I268-L383 HydrophobicContact CG2-CD1 3.98Å; F269-L383 HydrophobicContact CD1-CD2 3.86Å; F269-L383 HydrophobicContact CE1-CD2 4.2Å; Y320-L383 WeakPolarHBondContact CE1-O 3.35Å; Y320-L383 PolarHBondContact OH-O 3.33Å; Y320-L383 VanDerWaalsContact OH-O 3.05Å; V324-L383 HydrophobicContact CG1-CB 4Å; L379-L383 HydrophobicContact CD1-CD1 4.38Å; L379-L383 HydrophobicContact CD1-CD2 4.22Å; L379-L383 HydrophobicContact CD1-CG 4Å; L379-L383 HydrophobicContact CG-CD1 4.25Å; L379-L383 HydrophobicContact CG-CG 4.34Å; L379-L383 WeakPolarHBondContact O-CG 3.4Å; L379-L383 PolarHBondContact O-N 2.94Å; L383-R385 VanDerWaalsContact C-N 3.28Å; L383-R385 PolarHBondContact O-N 3.37Å; L383-P386 WeakPolarHBondContact O-CD 3.39Å
384	L	88	Confident	86.9	Confident	29 Å²	29	16.6 Å²	16.6	15%	0.152	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-8.7	173.7	-62.6	175.3	0	0	0	113.4	V324 L325 K381 L382 V387 Y388 L445	V324-L384 HydrophobicContact CG1-CD2 4.1Å; L325-L384 HydrophobicContact CD2-CD2 3.76Å; K381-L384 PolarHBondContact O-N 3.44Å; L382-L384 PolarHBondContact O-N 3.5Å; L384-V387 WeakPolarHBondContact O-CB 3.23Å; L384-V387 PolarHBondContact O-N 2.6Å; L384-Y388 HydrophobicContact CB-CD2 4.31Å; L384-Y388 HydrophobicContact CB-CE2 3.83Å; L384-Y388 WeakPolarHBondContact O-CD2 3.5Å; L384-Y388 PolarHBondContact O-N 3.02Å; L384-L445 HydrophobicContact CB-CD1 4.32Å
385	R	84.8	Confident	86.8	Confident	13 Å²	13	23 Å²	23	5%	0.049	11%	0.107	C	C	.	.	H	α-helix	trans	-59.6	-47.7	-176.5	-67.7	-72.2	-174.1	170.8	-9.8	113.4	F241 E244 L382 L383 V387 Y388 H389 L445	F241-R385 HydrophobicContact CE2-CB 4.43Å; E244-R385 VanDerWaalsContact OE2-CD 3.27Å; E244-R385 WeakPolarHBondContact OE2-CD 3.45Å; E244-R385 IonicContact OE2-NE 3.78Å; E244-R385 IonicContact OE2-NH1 3.92Å; L382-R385 HydrophobicContact CD2-CG 4.42Å; L382-R385 WeakPolarHBondContact O-CB 3.22Å; L382-R385 WeakPolarHBondContact O-CG 3.44Å; L382-R385 PolarHBondContact O-N 3.1Å; L383-R385 VanDerWaalsContact C-N 3.28Å; L383-R385 PolarHBondContact O-N 3.37Å; R385-V387 PolarHBondContact O-N 2.98Å; R385-Y388 PolarHBondContact O-N 3.4Å; R385-H389 WeakPolarHBondContact O-CB 3.48Å; R385-H389 PolarHBondContact O-N 3.2Å; R385-L445 VanDerWaalsContact CZ-CD2 3.49Å; R385-L445 PolarHBondContact NH1-O 3.22Å
386	P	90.9	Very high	86.7	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-60.9	-29.5	177.5	-25.5	37.5	0	0	0	113.7	F241 I272 I275 Y317 Y320 L383 H389 C390	F241-P386 HydrophobicContact CE2-CB 4.2Å; F241-P386 HydrophobicContact CE2-CG 4.01Å; F241-P386 HydrophobicContact CZ-CB 3.83Å; F241-P386 HydrophobicContact CZ-CG 3.92Å; I272-P386 HydrophobicContact CD1-CG 3.96Å; I275-P386 HydrophobicContact CD1-CB 3.84Å; I275-P386 HydrophobicContact CD1-CG 4.26Å; I275-P386 HydrophobicContact CG2-CB 4.38Å; Y317-P386 HydrophobicContact CD1-CB 4.36Å; Y317-P386 HydrophobicContact CE1-CB 4.03Å; Y317-P386 WeakPolarHBondContact CE1-O 3.32Å; Y320-P386 HydrophobicContact CD1-CB 3.87Å; Y320-P386 HydrophobicContact CD1-CG 4.3Å; Y320-P386 HydrophobicContact CE1-CB 3.56Å; Y320-P386 HydrophobicContact CE1-CG 3.53Å; L383-P386 WeakPolarHBondContact O-CD 3.39Å; P386-H389 PolarHBondContact O-N 2.87Å; P386-C390 WeakPolarHBondContact O-CB 3.49Å; P386-C390 PolarHBondContact O-N 2.76Å
387	V	87.4	Confident	86.7	Confident	1 Å²	1	22.9 Å²	22.9	1%	0.006	11%	0.106	C	C	.	.	H	α-helix	trans	-64.2	-49.7	176.9	-174.2	0	0	0	0	110.8	M321 L384 R385 H389 L391 L434	M321-V387 HydrophobicContact CE-CG1 3.86Å; M321-V387 HydrophobicContact CG-CB 4.31Å; M321-V387 HydrophobicContact CG-CG1 4.04Å; M321-V387 HydrophobicContact CG-CG2 3.84Å; M321-V387 HydrophobicContact SD-CG1 3.99Å; L384-V387 WeakPolarHBondContact O-CB 3.23Å; L384-V387 PolarHBondContact O-N 2.6Å; R385-V387 PolarHBondContact O-N 2.98Å; V387-H389 VanDerWaalsContact C-N 3.34Å; V387-L391 WeakPolarHBondContact O-CG 3.4Å; V387-L391 PolarHBondContact O-N 3.09Å; V387-L434 HydrophobicContact CG1-CD1 4.44Å
388	Y	83.5	Confident	86.6	Confident	74 Å²	74	25.1 Å²	25.1	29%	0.29	12%	0.122	S	C	.	.	H	α-helix	trans	-69	-33.4	177.4	-65.3	-69.7	0	0	0	112.6	L384 R385 L391 K392 L445	L384-Y388 HydrophobicContact CB-CD2 4.31Å; L384-Y388 HydrophobicContact CB-CE2 3.83Å; L384-Y388 WeakPolarHBondContact O-CD2 3.5Å; L384-Y388 PolarHBondContact O-N 3.02Å; R385-Y388 PolarHBondContact O-N 3.4Å; Y388-L391 PolarHBondContact O-N 3.08Å; Y388-K392 PolarHBondContact O-N 3.24Å; Y388-L445 HydrophobicContact CD2-CB 3.98Å; Y388-L445 HydrophobicContact CD2-CD1 3.84Å; Y388-L445 HydrophobicContact CE2-CB 4.1Å; Y388-L445 HydrophobicContact CE2-CD1 3.25Å; Y388-L445 HydrophobicContact CE2-CG 4.28Å
389	H	87.7	Confident	86.5	Confident	4 Å²	4	27.7 Å²	27.7	2%	0.019	14%	0.138	C	C	.	.	H	α-helix	trans	-62.7	-47.9	177.8	-167.7	74.5	0	0	0	111.7	H237 E238 F241 R385 P386 V387 L391 K392 Y393	H237-H389 AromaticContact CE1-CE1 3.17Å; H237-H389 PolarHBondContact CE1-CE1 3.27Å; H237-H389 AromaticContact CE1-ND1 2.94Å; H237-H389 PolarHBondContact CE1-ND1 3.42Å; H237-H389 AromaticContact ND1-CE1 3.59Å; H237-H389 AromaticContact ND1-ND1 3.82Å; H237-H389 AromaticContact NE2-CE1 3.78Å; H237-H389 AromaticContact NE2-ND1 3.33Å; H237-H389 PolarHBondContact NE2-ND1 3.17Å; E238-H389 IonicContact OE1-CD2 2.76Å; E238-H389 IonicContact OE1-CE1 3.85Å; E238-H389 PolarHBondContact OE1-CE1 3.33Å; E238-H389 VanDerWaalsContact OE1-CE1 3.27Å; E238-H389 IonicContact OE1-NE2 3.29Å; E238-H389 PolarHBondContact OE1-NE2 2.94Å; E238-H389 IonicContact OE2-NE2 3.66Å; F241-H389 VanDerWaalsContact CB-CE1 3.44Å; F241-H389 WeakPolarHBondContact CB-CE1 3.3Å; F241-H389 HydrophobicContact CD1-CB 4.32Å; F241-H389 AromaticContact CD1-CD2 3.25Å; F241-H389 WeakPolarHBondContact CD1-CD2 3.42Å; F241-H389 AromaticContact CD1-CE1 3.57Å; F241-H389 AromaticContact CD1-CG 3.49Å; F241-H389 VanDerWaalsContact CD1-CG 3.49Å; F241-H389 AromaticContact CD1-ND1 3.71Å; F241-H389 AromaticContact CD1-NE2 3.3Å; F241-H389 VanDerWaalsContact CD1-NE2 3.3Å; F241-H389 WeakPolarHBondContact CD1-NE2 3.25Å; F241-H389 HydrophobicContact CD2-CB 3.84Å; F241-H389 AromaticContact CD2-CG 3.67Å; F241-H389 AromaticContact CD2-ND1 3.75Å; F241-H389 HydrophobicContact CE1-CB 4.16Å; F241-H389 AromaticContact CE1-CD2 3.36Å; F241-H389 WeakPolarHBondContact CE1-CD2 3.43Å; F241-H389 AromaticContact CE1-CG 3.69Å; F241-H389 AromaticContact CE1-NE2 3.87Å; F241-H389 HydrophobicContact CE2-CB 3.67Å; F241-H389 AromaticContact CE2-CG 3.88Å; F241-H389 HydrophobicContact CG-CB 4.17Å; F241-H389 AromaticContact CG-CD2 3.76Å; F241-H389 AromaticContact CG-CE1 3.53Å; F241-H389 AromaticContact CG-CG 3.48Å; F241-H389 VanDerWaalsContact CG-CG 3.48Å; F241-H389 AromaticContact CG-ND1 3.35Å; F241-H389 WeakPolarHBondContact CG-ND1 3.49Å; F241-H389 AromaticContact CG-NE2 3.76Å; F241-H389 HydrophobicContact CZ-CB 3.84Å; F241-H389 AromaticContact CZ-CD2 3.95Å; F241-H389 AromaticContact CZ-CG 3.88Å; R385-H389 WeakPolarHBondContact O-CB 3.48Å; R385-H389 PolarHBondContact O-N 3.2Å; P386-H389 PolarHBondContact O-N 2.87Å; V387-H389 VanDerWaalsContact C-N 3.34Å; H389-L391 VanDerWaalsContact C-N 3.31Å; H389-L391 PolarHBondContact O-N 3.35Å; H389-K392 WeakPolarHBondContact O-CB 3.36Å; H389-K392 PolarHBondContact O-N 3.48Å; H389-K392 VanDerWaalsContact O-N 3.09Å; H389-Y393 AromaticContact CD2-CE2 3.89Å; H389-Y393 AromaticContact CD2-CZ 3.68Å; H389-Y393 PolarHBondContact CD2-OH 2.86Å; H389-Y393 AromaticContact NE2-CE1 3.95Å; H389-Y393 AromaticContact NE2-CZ 3.44Å; H389-Y393 PolarHBondContact NE2-OH 3.05Å
390	C	89.1	Confident	86.4	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.007	14%	0.138	C	C	.	.	H	α-helix	trans	-57.8	-43.5	177.3	-171.4	0	0	0	0	112.3	Y317 P386 K392 Y393 L427	Y317-C390 HydrophobicContact CD1-CB 3.55Å; Y317-C390 HydrophobicContact CD2-CB 4.35Å; Y317-C390 HydrophobicContact CE1-CB 3.9Å; Y317-C390 HydrophobicContact CG-CB 3.79Å; P386-C390 WeakPolarHBondContact O-CB 3.49Å; P386-C390 PolarHBondContact O-N 2.76Å; C390-K392 PolarHBondContact O-N 2.79Å; C390-Y393 WeakPolarHBondContact O-CB 3.32Å; C390-Y393 PolarHBondContact O-N 2.99Å; C390-Y393 VanDerWaalsContact O-N 3.16Å; C390-L427 WeakPolarHBondContact SG-CD1 3.31Å
391	L	84.7	Confident	86.4	Confident	39 Å²	39	28 Å²	28	20%	0.204	14%	0.138	C	C	.	.	H	α-helix	trans	-62.9	-30.7	178.9	-66.2	176.3	0	0	0	113	V387 Y388 H389 Y393 F394	V387-L391 WeakPolarHBondContact O-CG 3.4Å; V387-L391 PolarHBondContact O-N 3.09Å; Y388-L391 PolarHBondContact O-N 3.08Å; H389-L391 VanDerWaalsContact C-N 3.31Å; H389-L391 PolarHBondContact O-N 3.35Å; L391-Y393 VanDerWaalsContact C-N 3.31Å; L391-Y393 PolarHBondContact O-N 2.96Å; L391-F394 HydrophobicContact CD2-CD2 4.29Å; L391-F394 HydrophobicContact CD2-CE2 4.4Å; L391-F394 PolarHBondContact O-N 3.23Å
392	K	83.8	Confident	86.5	Confident	23 Å²	23	34.9 Å²	34.9	10%	0.1	17%	0.168	C	C	.	.	H	α-helix	trans	-66.4	-29.8	176.7	-77.2	-180	169.4	-170	0	112.9	H237 Y388 H389 C390 F394 E395 F396 F447	H237-K392 PolarHBondContact CD2-NZ 3.44Å; H237-K392 WeakPolarHBondContact CE1-CD 3.25Å; H237-K392 PolarHBondContact NE2-NZ 3.29Å; Y388-K392 PolarHBondContact O-N 3.24Å; H389-K392 WeakPolarHBondContact O-CB 3.36Å; H389-K392 PolarHBondContact O-N 3.48Å; H389-K392 VanDerWaalsContact O-N 3.09Å; C390-K392 PolarHBondContact O-N 2.79Å; K392-F394 PolarHBondContact O-N 3.08Å; K392-E395 WeakPolarHBondContact O-CA 3.32Å; K392-E395 WeakPolarHBondContact O-CB 3.14Å; K392-E395 PolarHBondContact O-N 3.49Å; K392-F396 HydrophobicContact CB-CD2 4.44Å; K392-F396 HydrophobicContact CB-CE2 4.46Å; K392-F396 VanDerWaalsContact O-CD2 3.32Å; K392-F396 WeakPolarHBondContact O-CD2 3.42Å; K392-F396 PolarHBondContact O-N 2.91Å; K392-F447 PolarHBondContact NZ-O 3.26Å
393	Y	87.5	Confident	86.4	Confident	3 Å²	3	36.5 Å²	36.5	1%	0.012	18%	0.176	C	C	.	.	H	α-helix	trans	-56.5	-38.8	174.2	-65.8	-48.6	0	0	0	111.6	E238 F282 F305 F314 Y317 H389 C390 L391 E395 F396 L397	E238-Y393 WeakPolarHBondContact OE1-CE1 3.4Å; E238-Y393 PolarHBondContact OE1-OH 2.9Å; E238-Y393 PolarHBondContact OE2-OH 2.88Å; F282-Y393 HydrophobicContact CD1-CE1 4.18Å; F282-Y393 AromaticContact CE1-CE1 3.78Å; F282-Y393 HydrophobicContact CE1-CE1 3.78Å; F305-Y393 HydrophobicContact CE1-CD1 4.23Å; F314-Y393 HydrophobicContact CD1-CD2 4.13Å; F314-Y393 AromaticContact CD1-CE2 3.98Å; F314-Y393 HydrophobicContact CD1-CE2 3.98Å; F314-Y393 AromaticContact CE1-CD2 3.89Å; F314-Y393 HydrophobicContact CE1-CD2 3.89Å; F314-Y393 HydrophobicContact CE1-CE1 4.5Å; F314-Y393 AromaticContact CE1-CE2 3.64Å; F314-Y393 HydrophobicContact CE1-CE2 3.64Å; F314-Y393 HydrophobicContact CE1-CG 4.43Å; F314-Y393 AromaticContact CE1-CZ 3.97Å; Y317-Y393 HydrophobicContact CE2-CE2 4.16Å; H389-Y393 AromaticContact CD2-CE2 3.89Å; H389-Y393 AromaticContact CD2-CZ 3.68Å; H389-Y393 PolarHBondContact CD2-OH 2.86Å; H389-Y393 AromaticContact NE2-CE1 3.95Å; H389-Y393 AromaticContact NE2-CZ 3.44Å; H389-Y393 PolarHBondContact NE2-OH 3.05Å; C390-Y393 WeakPolarHBondContact O-CB 3.32Å; C390-Y393 PolarHBondContact O-N 2.99Å; C390-Y393 VanDerWaalsContact O-N 3.16Å; L391-Y393 VanDerWaalsContact C-N 3.31Å; L391-Y393 PolarHBondContact O-N 2.96Å; Y393-E395 VanDerWaalsContact C-N 3.25Å; Y393-E395 PolarHBondContact O-N 3.4Å; Y393-F396 PolarHBondContact O-N 3.15Å; Y393-L397 WeakPolarHBondContact O-CG 3.39Å; Y393-L397 PolarHBondContact O-N 3.49Å; Y393-L397 VanDerWaalsContact O-N 3.15Å
394	F	87.2	Confident	86.2	Confident	19 Å²	19	37.1 Å²	37.1	8%	0.083	18%	0.182	C	C	.	.	H	α-helix	trans	-72.6	-15.6	177.7	-50.4	-46.4	0	0	0	113.9	L391 K392 P398 L420 K424 L427	L391-F394 HydrophobicContact CD2-CD2 4.29Å; L391-F394 HydrophobicContact CD2-CE2 4.4Å; L391-F394 PolarHBondContact O-N 3.23Å; K392-F394 PolarHBondContact O-N 3.08Å; F394-P398 VanDerWaalsContact O-CD 3.23Å; F394-P398 WeakPolarHBondContact O-CD 3.24Å; F394-L420 HydrophobicContact CE1-CB 4.11Å; F394-L420 HydrophobicContact CE1-CD1 4.47Å; F394-K424 HydrophobicContact CB-CD 4.04Å; F394-K424 HydrophobicContact CD1-CB 4.07Å; F394-K424 HydrophobicContact CD1-CD 4.13Å; F394-K424 HydrophobicContact CD1-CG 4.23Å; F394-K424 HydrophobicContact CD2-CB 4.14Å; F394-K424 HydrophobicContact CD2-CD 4.26Å; F394-K424 HydrophobicContact CD2-CG 3.81Å; F394-K424 HydrophobicContact CE1-CB 3.85Å; F394-K424 HydrophobicContact CE1-CG 4.45Å; F394-K424 HydrophobicContact CE2-CB 3.92Å; F394-K424 HydrophobicContact CE2-CG 4.04Å; F394-K424 HydrophobicContact CG-CB 4.23Å; F394-K424 HydrophobicContact CG-CD 3.88Å; F394-K424 HydrophobicContact CG-CG 3.92Å; F394-K424 HydrophobicContact CZ-CB 3.77Å; F394-K424 HydrophobicContact CZ-CG 4.36Å; F394-L427 HydrophobicContact CE2-CD1 4.33Å; F394-L427 HydrophobicContact CZ-CD1 4.45Å
395	E	82.3	Confident	85.9	Confident	134 Å²	134	40.3 Å²	40.3	63%	0.626	21%	0.207	S	C	*	.	H	α-helix	trans	-88	-34.8	172	-63.2	-177.1	172.8	0	0	111.7	K392 Y393	K392-E395 WeakPolarHBondContact O-CA 3.32Å; K392-E395 WeakPolarHBondContact O-CB 3.14Å; K392-E395 PolarHBondContact O-N 3.49Å; Y393-E395 VanDerWaalsContact C-N 3.25Å; Y393-E395 PolarHBondContact O-N 3.4Å
396	F	84.4	Confident	85.8	Confident	39 Å²	39	41.5 Å²	41.5	17%	0.171	22%	0.217	C	C	.	.	H	α-helix	trans	-69.8	-42.3	177.5	-84.8	-72	0	0	0	113.1	T230 L234 H237 K392 Y393 V399 L400	T230-F396 HydrophobicContact CG2-CD1 4Å; T230-F396 HydrophobicContact CG2-CE1 4.22Å; L234-F396 HydrophobicContact CB-CE1 4.23Å; L234-F396 HydrophobicContact CB-CZ 4.42Å; L234-F396 HydrophobicContact CD1-CD2 3.93Å; L234-F396 HydrophobicContact CD1-CE2 3.95Å; L234-F396 HydrophobicContact CD1-CG 4.24Å; L234-F396 HydrophobicContact CD1-CZ 4.27Å; H237-F396 AromaticContact ND1-CE2 3.97Å; K392-F396 HydrophobicContact CB-CD2 4.44Å; K392-F396 HydrophobicContact CB-CE2 4.46Å; K392-F396 VanDerWaalsContact O-CD2 3.32Å; K392-F396 WeakPolarHBondContact O-CD2 3.42Å; K392-F396 PolarHBondContact O-N 2.91Å; Y393-F396 PolarHBondContact O-N 3.15Å; F396-V399 PolarHBondContact O-N 3.11Å; F396-V399 VanDerWaalsContact O-N 3.12Å; F396-L400 WeakPolarHBondContact O-CG 3.44Å; F396-L400 PolarHBondContact O-N 3.23Å
397	L	87.3	Confident	85.5	Confident	4 Å²	4	48 Å²	48	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-55.5	-50.4	-174.4	-74.8	169.1	0	0	0	113.5	F305 Y393 V399 L400 I401 L413 T416 L420	F305-L397 HydrophobicContact CD1-CD2 3.95Å; F305-L397 HydrophobicContact CD2-CD2 4.46Å; F305-L397 HydrophobicContact CE1-CD2 4.15Å; F305-L397 HydrophobicContact CG-CD2 4.1Å; F305-L397 HydrophobicContact CZ-CD2 4.48Å; Y393-L397 WeakPolarHBondContact O-CG 3.39Å; Y393-L397 PolarHBondContact O-N 3.49Å; Y393-L397 VanDerWaalsContact O-N 3.15Å; L397-V399 VanDerWaalsContact C-N 3.27Å; L397-V399 PolarHBondContact O-N 2.92Å; L397-L400 PolarHBondContact O-N 3.47Å; L397-I401 VanDerWaalsContact O-CG1 3.28Å; L397-I401 WeakPolarHBondContact O-CG1 3.35Å; L397-I401 PolarHBondContact O-N 3.41Å; L397-L413 HydrophobicContact CD2-CD2 4.08Å; L397-T416 HydrophobicContact CD1-CG2 4.38Å; L397-T416 HydrophobicContact CD2-CG2 4.13Å; L397-L420 HydrophobicContact CD1-CD1 4.08Å
398	P	85.9	Confident	85.3	Confident	59 Å²	59	53 Å²	53	38%	0.383	28%	0.275	S	S	.	.	H	α-helix	trans	-62.5	-31.9	178.3	-24	34.8	0	0	0	113.8	F394 K402	F394-P398 VanDerWaalsContact O-CD 3.23Å; F394-P398 WeakPolarHBondContact O-CD 3.24Å; P398-K402 WeakPolarHBondContact O-CB 3.32Å; P398-K402 PolarHBondContact O-N 2.91Å
399	V	82.8	Confident	85.5	Confident	59 Å²	59	49.8 Å²	49.8	36%	0.358	26%	0.263	S	S	.	.	H	α-helix	trans	-70.6	-44.9	177.6	178.9	0	0	0	0	110.2	T230 F396 L397 K402 L403	T230-V399 HydrophobicContact CG2-CG1 4.18Å; F396-V399 PolarHBondContact O-N 3.11Å; F396-V399 VanDerWaalsContact O-N 3.12Å; L397-V399 VanDerWaalsContact C-N 3.27Å; L397-V399 PolarHBondContact O-N 2.92Å; V399-K402 PolarHBondContact O-N 3.39Å; V399-L403 HydrophobicContact CG1-CD1 3.78Å; V399-L403 HydrophobicContact CG1-CG 4.47Å; V399-L403 WeakPolarHBondContact O-CB 3.3Å; V399-L403 VanDerWaalsContact O-CG 3.28Å; V399-L403 WeakPolarHBondContact O-CG 3.35Å; V399-L403 PolarHBondContact O-N 3.12Å; V399-L403 VanDerWaalsContact O-N 3.12Å
400	L	86.9	Confident	85.7	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.8	-45.7	177	-69.5	170.2	0	0	0	111.5	Y227 T230 V231 I301 F305 F396 L397 K402 L403 A404 L413	Y227-L400 HydrophobicContact CD2-CD2 4.27Å; Y227-L400 HydrophobicContact CE2-CB 4.36Å; Y227-L400 HydrophobicContact CE2-CD2 3.96Å; T230-L400 HydrophobicContact CG2-CD2 3.78Å; T230-L400 HydrophobicContact CG2-CG 4.31Å; V231-L400 HydrophobicContact CG2-CD2 4.43Å; I301-L400 HydrophobicContact CD1-CD1 4.01Å; I301-L400 HydrophobicContact CD1-CD2 4.35Å; F305-L400 HydrophobicContact CD2-CD1 4.4Å; F305-L400 HydrophobicContact CE2-CD1 3.66Å; F305-L400 HydrophobicContact CZ-CD1 4.28Å; F396-L400 WeakPolarHBondContact O-CG 3.44Å; F396-L400 PolarHBondContact O-N 3.23Å; L397-L400 PolarHBondContact O-N 3.47Å; L400-K402 VanDerWaalsContact C-N 3.26Å; L400-K402 PolarHBondContact O-N 3.15Å; L400-L403 PolarHBondContact O-N 2.88Å; L400-L403 VanDerWaalsContact O-N 3.11Å; L400-A404 PolarHBondContact O-N 2.79Å; L400-L413 HydrophobicContact CB-CD1 3.82Å; L400-L413 HydrophobicContact CB-CD2 4.21Å; L400-L413 HydrophobicContact CD1-CD2 4.3Å
401	I	88.4	Confident	85.8	Confident	26 Å²	26	61 Å²	61	13%	0.133	31%	0.308	C	S	.	.	H	α-helix	trans	-58.1	-39.4	177.5	-68	165.8	0	0	0	111.4	L397 L413 V414 E417	L397-I401 VanDerWaalsContact O-CG1 3.28Å; L397-I401 WeakPolarHBondContact O-CG1 3.35Å; L397-I401 PolarHBondContact O-N 3.41Å; I401-L413 HydrophobicContact CD1-CB 4.36Å; I401-L413 HydrophobicContact CG1-CB 3.58Å; I401-L413 HydrophobicContact CG1-CD1 4.39Å; I401-V414 HydrophobicContact CD1-CG2 4.22Å; I401-V414 HydrophobicContact CG1-CG2 4.34Å; I401-V414 HydrophobicContact CG2-CG2 4.02Å; I401-E417 HydrophobicContact CD1-CB 4.21Å; I401-E417 WeakPolarHBondContact CD1-OE2 3.39Å
402	K	86.6	Confident	86.1	Confident	182 Å²	182	61 Å²	61	79%	0.791	31%	0.309	S	S	*	.	H	α-helix	trans	-72.1	-30.2	179.4	-174.6	177.1	179	179.8	0	113.1	P398 V399 L400	P398-K402 WeakPolarHBondContact O-CB 3.32Å; P398-K402 PolarHBondContact O-N 2.91Å; V399-K402 PolarHBondContact O-N 3.39Å; L400-K402 VanDerWaalsContact C-N 3.26Å; L400-K402 PolarHBondContact O-N 3.15Å
403	L	85	Confident	86.5	Confident	53 Å²	53	59.9 Å²	59.9	28%	0.277	30%	0.304	S	S	.	.	H	α-helix	trans	-94.7	-14.6	-175.5	-66	176.6	0	0	0	113.7	I225 Y227 T230 V399 L400 S405	I225-L403 HydrophobicContact CG2-CD1 3.9Å; I225-L403 WeakPolarHBondContact O-CD2 3.42Å; Y227-L403 HydrophobicContact CD2-CB 3.96Å; Y227-L403 HydrophobicContact CG-CB 4.5Å; T230-L403 WeakPolarHBondContact OG1-CD1 3.38Å; V399-L403 HydrophobicContact CG1-CD1 3.78Å; V399-L403 HydrophobicContact CG1-CG 4.47Å; V399-L403 WeakPolarHBondContact O-CB 3.3Å; V399-L403 VanDerWaalsContact O-CG 3.28Å; V399-L403 WeakPolarHBondContact O-CG 3.35Å; V399-L403 PolarHBondContact O-N 3.12Å; V399-L403 VanDerWaalsContact O-N 3.12Å; L400-L403 PolarHBondContact O-N 2.88Å; L400-L403 VanDerWaalsContact O-N 3.11Å; L403-S405 PolarHBondContact O-N 2.88Å
404	A	85.2	Confident	86.8	Confident	17 Å²	17	62.6 Å²	62.6	14%	0.14	32%	0.321	C	S	.	.			trans	-63.6	123.4	-178.5	0	0	0	0	0	111.8	Y227 L400 K410 L413	Y227-A404 HydrophobicContact CD2-CB 4.29Å; Y227-A404 HydrophobicContact CE2-CB 3.95Å; L400-A404 PolarHBondContact O-N 2.79Å; A404-K410 HydrophobicContact CB-CB 4.03Å; A404-K410 HydrophobicContact CB-CG 4.5Å; A404-L413 HydrophobicContact CB-CD1 4.39Å
405	S	83.2	Confident	87.1	Confident	97 Å²	97	65 Å²	65	68%	0.678	33%	0.332	S	S	*	.			trans	-95.2	-16	176.2	62.1	0	0	0	0	113.8	L403	L403-S405 PolarHBondContact O-N 2.88Å
406	C	82.3	Confident	87.7	Confident	37 Å²	37	58.7 Å²	58.7	25%	0.25	30%	0.302	C	S	.	.	S	Bend	trans	-96.3	129	177.3	-179.2	0	0	0	0	109.9	F300 E408 D409 K410	F300-C406 HydrophobicContact CD1-CB 3.95Å; F300-C406 HydrophobicContact CD2-CB 3.9Å; F300-C406 HydrophobicContact CE1-CB 3.61Å; F300-C406 HydrophobicContact CE2-CB 3.55Å; F300-C406 HydrophobicContact CG-CB 4.11Å; F300-C406 HydrophobicContact CZ-CB 3.41Å; F300-C406 VanDerWaalsContact CZ-CB 3.41Å; C406-E408 VanDerWaalsContact C-N 3.34Å; C406-E408 PolarHBondContact O-N 3.45Å; C406-D409 HydrophobicContact CB-CB 4.04Å; C406-D409 PolarHBondContact O-N 3.04Å; C406-K410 WeakPolarHBondContact O-CB 3.45Å; C406-K410 PolarHBondContact O-N 2.77Å
407	D	84.4	Confident	88.1	Confident	137 Å²	137	60 Å²	60	73%	0.733	31%	0.309	S	S	*	.	H	α-helix	trans	-66.2	-35.1	-178.9	-68.3	-36.2	0	0	0	112.5	Y411	D407-Y411 WeakPolarHBondContact O-CB 3.32Å; D407-Y411 PolarHBondContact O-N 3.18Å
408	E	83.8	Confident	88.4	Confident	107 Å²	107	62.9 Å²	62.9	50%	0.5	33%	0.33	S	S	.	.	H	α-helix	trans	-63.1	-48.3	176.1	-66.1	-175.3	173.8	0	0	110.9	C406 K410 Y411 D412 R858	C406-E408 VanDerWaalsContact C-N 3.34Å; C406-E408 PolarHBondContact O-N 3.45Å; E408-K410 VanDerWaalsContact C-N 3.35Å; E408-K410 PolarHBondContact O-N 2.79Å; E408-Y411 WeakPolarHBondContact O-CB 3.49Å; E408-Y411 PolarHBondContact O-N 2.86Å; E408-D412 PolarHBondContact O-N 3.47Å; E408-D412 VanDerWaalsContact O-N 3.11Å; E408-R858 IonicContact OE1-NH2 2.83Å
409	D	87.7	Confident	88.8	Confident	5 Å²	5	64.1 Å²	64.1	3%	0.027	33%	0.332	C	S	.	.	H	α-helix	trans	-63.2	-41.6	179.1	-176.4	64.7	0	0	0	112.4	Y227 F300 I301 G302 C406 Y411 D412 L413	Y227-D409 WeakPolarHBondContact CE2-OD2 3.26Å; Y227-D409 VanDerWaalsContact OH-CG 3.29Å; Y227-D409 PolarHBondContact OH-OD1 3.37Å; Y227-D409 PolarHBondContact OH-OD2 3.23Å; F300-D409 HydrophobicContact CB-CB 3.78Å; F300-D409 WeakPolarHBondContact CB-OD1 3.39Å; F300-D409 HydrophobicContact CD1-CB 3.77Å; F300-D409 HydrophobicContact CG-CB 3.87Å; I301-D409 PolarHBondContact N-OD1 2.84Å; G302-D409 VanDerWaalsContact CA-OD1 3.3Å; G302-D409 WeakPolarHBondContact CA-OD1 3.45Å; G302-D409 PolarHBondContact N-OD1 3.18Å; C406-D409 HydrophobicContact CB-CB 4.04Å; C406-D409 PolarHBondContact O-N 3.04Å; D409-Y411 VanDerWaalsContact C-N 3.3Å; D409-Y411 PolarHBondContact O-N 2.82Å; D409-D412 PolarHBondContact O-N 3.02Å; D409-L413 WeakPolarHBondContact O-CG 3.24Å; D409-L413 PolarHBondContact O-N 3.29Å
410	K	90.3	Very high	89.3	Confident	96 Å²	96	61.8 Å²	61.8	42%	0.417	32%	0.318	S	S	.	.	H	α-helix	trans	-62.7	-39.7	176.9	-172.5	178.5	179.9	-178.1	0	111.5	A404 C406 E408 V414	A404-K410 HydrophobicContact CB-CB 4.03Å; A404-K410 HydrophobicContact CB-CG 4.5Å; C406-K410 WeakPolarHBondContact O-CB 3.45Å; C406-K410 PolarHBondContact O-N 2.77Å; E408-K410 VanDerWaalsContact C-N 3.35Å; E408-K410 PolarHBondContact O-N 2.79Å; K410-V414 VanDerWaalsContact O-CG2 3.28Å; K410-V414 WeakPolarHBondContact O-CG2 3.39Å; K410-V414 PolarHBondContact O-N 3.12Å; K410-V414 VanDerWaalsContact O-N 3.09Å
411	Y	91.8	Very high	89.5	Confident	145 Å²	145	67.1 Å²	67.1	57%	0.569	34%	0.344	S	S	*	.	H	α-helix	trans	-61.2	-47.7	175.2	176.2	-92	0	0	0	111.2	D407 E408 D409 L413 V414 Q415	D407-Y411 WeakPolarHBondContact O-CB 3.32Å; D407-Y411 PolarHBondContact O-N 3.18Å; E408-Y411 WeakPolarHBondContact O-CB 3.49Å; E408-Y411 PolarHBondContact O-N 2.86Å; D409-Y411 VanDerWaalsContact C-N 3.3Å; D409-Y411 PolarHBondContact O-N 2.82Å; Y411-L413 VanDerWaalsContact C-N 3.34Å; Y411-L413 PolarHBondContact O-N 2.87Å; Y411-V414 PolarHBondContact O-N 2.94Å; Y411-Q415 HydrophobicContact CD1-CG 4.22Å; Y411-Q415 HydrophobicContact CE1-CG 3.8Å; Y411-Q415 HydrophobicContact CE2-CG 4.31Å; Y411-Q415 WeakPolarHBondContact O-CG 3.39Å; Y411-Q415 PolarHBondContact O-N 2.88Å; Y411-Q415 PolarHBondContact OH-NE2 3.44Å
412	D	92	Very high	89.7	Confident	39 Å²	39	69.2 Å²	69.2	21%	0.209	36%	0.36	C	S	.	.	H	α-helix	trans	-60.8	-41.3	179.7	-68	-12.7	0	0	0	112.2	L306 E408 D409 Q415 T416	L306-D412 HydrophobicContact CB-CB 4.4Å; L306-D412 HydrophobicContact CD2-CB 4.12Å; E408-D412 PolarHBondContact O-N 3.47Å; E408-D412 VanDerWaalsContact O-N 3.11Å; D409-D412 PolarHBondContact O-N 3.02Å; D412-Q415 PolarHBondContact O-N 3.36Å; D412-T416 PolarHBondContact O-N 2.92Å; D412-T416 PolarHBondContact O-OG1 3.1Å
413	L	92.7	Very high	89.9	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-66.5	-40.4	177.4	-70.6	167.7	0	0	0	112.9	Y227 F305 L397 L400 I401 A404 D409 Y411 T416 E417	Y227-L413 HydrophobicContact CE2-CD1 4.34Å; F305-L413 HydrophobicContact CD2-CD2 4.16Å; L397-L413 HydrophobicContact CD2-CD2 4.08Å; L400-L413 HydrophobicContact CB-CD1 3.82Å; L400-L413 HydrophobicContact CB-CD2 4.21Å; L400-L413 HydrophobicContact CD1-CD2 4.3Å; I401-L413 HydrophobicContact CD1-CB 4.36Å; I401-L413 HydrophobicContact CG1-CB 3.58Å; I401-L413 HydrophobicContact CG1-CD1 4.39Å; A404-L413 HydrophobicContact CB-CD1 4.39Å; D409-L413 WeakPolarHBondContact O-CG 3.24Å; D409-L413 PolarHBondContact O-N 3.29Å; Y411-L413 VanDerWaalsContact C-N 3.34Å; Y411-L413 PolarHBondContact O-N 2.87Å; L413-T416 WeakPolarHBondContact O-CB 3.39Å; L413-T416 PolarHBondContact O-N 3.43Å; L413-E417 PolarHBondContact O-N 2.63Å
414	V	93.5	Very high	90.2	Very high	60 Å²	60	61.4 Å²	61.4	36%	0.364	32%	0.324	S	S	.	.	H	α-helix	trans	-67.5	-38.1	177.4	170.5	0	0	0	0	111.1	I401 K410 Y411 E417 S418	I401-V414 HydrophobicContact CD1-CG2 4.22Å; I401-V414 HydrophobicContact CG1-CG2 4.34Å; I401-V414 HydrophobicContact CG2-CG2 4.02Å; K410-V414 VanDerWaalsContact O-CG2 3.28Å; K410-V414 WeakPolarHBondContact O-CG2 3.39Å; K410-V414 PolarHBondContact O-N 3.12Å; K410-V414 VanDerWaalsContact O-N 3.09Å; Y411-V414 PolarHBondContact O-N 2.94Å; V414-E417 PolarHBondContact O-N 3.38Å; V414-S418 PolarHBondContact O-N 3.16Å; V414-S418 VanDerWaalsContact O-N 3.09Å; V414-S418 PolarHBondContact O-OG 3.09Å
415	Q	93.6	Very high	90.4	Very high	70 Å²	70	63.9 Å²	63.9	33%	0.327	34%	0.34	S	S	.	.	H	α-helix	trans	-63.6	-43.8	172.5	-70.9	-67.3	7.4	0	0	111.4	L306 Y411 D412 E417 S418 L419	L306-Q415 HydrophobicContact CD1-CB 3.83Å; Y411-Q415 HydrophobicContact CD1-CG 4.22Å; Y411-Q415 HydrophobicContact CE1-CG 3.8Å; Y411-Q415 HydrophobicContact CE2-CG 4.31Å; Y411-Q415 WeakPolarHBondContact O-CG 3.39Å; Y411-Q415 PolarHBondContact O-N 2.88Å; Y411-Q415 PolarHBondContact OH-NE2 3.44Å; D412-Q415 PolarHBondContact O-N 3.36Å; Q415-E417 PolarHBondContact O-N 3.43Å; Q415-S418 WeakPolarHBondContact O-CB 3.34Å; Q415-S418 PolarHBondContact O-N 2.8Å; Q415-L419 WeakPolarHBondContact O-CG 3.17Å; Q415-L419 PolarHBondContact O-N 2.86Å
416	T	93.8	Very high	90.7	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-57.4	-48.7	174.4	-53.6	0	0	0	0	111.7	F305 L306 A309 L397 D412 L413 S418 L419 L420	F305-T416 HydrophobicContact CB-CG2 3.71Å; F305-T416 HydrophobicContact CD1-CG2 4.29Å; F305-T416 HydrophobicContact CG-CG2 4.41Å; L306-T416 VanDerWaalsContact CA-OG1 3.29Å; L306-T416 WeakPolarHBondContact CA-OG1 3.37Å; L306-T416 PolarHBondContact N-OG1 2.74Å; A309-T416 HydrophobicContact CB-CG2 3.91Å; L397-T416 HydrophobicContact CD1-CG2 4.38Å; L397-T416 HydrophobicContact CD2-CG2 4.13Å; D412-T416 PolarHBondContact O-N 2.92Å; D412-T416 PolarHBondContact O-OG1 3.1Å; L413-T416 WeakPolarHBondContact O-CB 3.39Å; L413-T416 PolarHBondContact O-N 3.43Å; T416-S418 PolarHBondContact O-N 3.47Å; T416-L419 PolarHBondContact O-N 3.02Å; T416-L420 HydrophobicContact CG2-CD1 3.84Å; T416-L420 HydrophobicContact CG2-CG 4.27Å; T416-L420 WeakPolarHBondContact O-CG 3.42Å; T416-L420 PolarHBondContact O-N 2.98Å
417	E	93.1	Very high	90.9	Very high	68 Å²	68	61.6 Å²	61.6	32%	0.318	31%	0.311	S	S	.	.	H	α-helix	trans	-58	-39.4	178.4	-176.1	176.5	-139.8	0	0	111.5	I401 L413 V414 Q415 M421	I401-E417 HydrophobicContact CD1-CB 4.21Å; I401-E417 WeakPolarHBondContact CD1-OE2 3.39Å; L413-E417 PolarHBondContact O-N 2.63Å; V414-E417 PolarHBondContact O-N 3.38Å; Q415-E417 PolarHBondContact O-N 3.43Å; E417-M421 PolarHBondContact O-N 2.8Å; E417-M421 VanDerWaalsContact O-N 3.12Å
418	S	92.8	Very high	90.8	Very high	64 Å²	64	59.7 Å²	59.7	45%	0.448	30%	0.298	S	S	.	.	H	α-helix	trans	-66.2	-42.9	177.4	-56.6	0	0	0	0	112.3	V414 Q415 T416	V414-S418 PolarHBondContact O-N 3.16Å; V414-S418 VanDerWaalsContact O-N 3.09Å; V414-S418 PolarHBondContact O-OG 3.09Å; Q415-S418 WeakPolarHBondContact O-CB 3.34Å; Q415-S418 PolarHBondContact O-N 2.8Å; T416-S418 PolarHBondContact O-N 3.47Å
419	L	94.1	Very high	90.8	Very high	84 Å²	84	62.8 Å²	62.8	44%	0.44	31%	0.31	S	S	.	.	H	α-helix	trans	-67.7	-35.9	178.1	-71.1	173.2	0	0	0	112.8	L306 A309 E310 Q415 T416 P422	L306-L419 HydrophobicContact CD1-CD1 3.91Å; A309-L419 HydrophobicContact CB-CB 4.13Å; A309-L419 HydrophobicContact CB-CD1 4.06Å; E310-L419 HydrophobicContact CG-CD1 3.84Å; Q415-L419 WeakPolarHBondContact O-CG 3.17Å; Q415-L419 PolarHBondContact O-N 2.86Å; T416-L419 PolarHBondContact O-N 3.02Å; L419-P422 WeakPolarHBondContact O-CD 3.44Å
420	L	93.7	Very high	90.4	Very high	11 Å²	11	65.2 Å²	65.2	6%	0.058	32%	0.32	C	S	.	.	H	α-helix	trans	-87.3	-11.3	-177.5	-64.8	-177.3	0	0	0	114.2	A309 F314 F394 L397 T416 P422 L423 K424	A309-L420 HydrophobicContact CB-CD2 4.01Å; A309-L420 HydrophobicContact CB-CG 4.09Å; F314-L420 HydrophobicContact CB-CD2 4.14Å; F314-L420 HydrophobicContact CD2-CD1 4.13Å; F314-L420 HydrophobicContact CD2-CD2 3.76Å; F314-L420 HydrophobicContact CE2-CD1 4.2Å; F314-L420 HydrophobicContact CG-CD2 4.26Å; F394-L420 HydrophobicContact CE1-CB 4.11Å; F394-L420 HydrophobicContact CE1-CD1 4.47Å; L397-L420 HydrophobicContact CD1-CD1 4.08Å; T416-L420 HydrophobicContact CG2-CD1 3.84Å; T416-L420 HydrophobicContact CG2-CG 4.27Å; T416-L420 WeakPolarHBondContact O-CG 3.42Å; T416-L420 PolarHBondContact O-N 2.98Å; L420-P422 VanDerWaalsContact C-CD 3.49Å; L420-L423 HydrophobicContact CD2-CD2 4.37Å; L420-L423 WeakPolarHBondContact O-CB 3.27Å; L420-L423 PolarHBondContact O-N 3.46Å; L420-L423 VanDerWaalsContact O-N 3.13Å; L420-K424 PolarHBondContact O-N 3.06Å
421	M	92.2	Very high	89.6	Confident	112 Å²	112	61.3 Å²	61.3	55%	0.552	31%	0.305	S	S	*	.	H	α-helix	trans	-55.2	-41.4	-180	-172.4	-176.7	-70.9	0	0	114.2	E417 K424 S425	E417-M421 PolarHBondContact O-N 2.8Å; E417-M421 VanDerWaalsContact O-N 3.12Å; M421-K424 PolarHBondContact O-N 2.96Å; M421-S425 PolarHBondContact O-N 3.26Å; M421-S425 PolarHBondContact O-OG 3.49Å
422	P	92.4	Very high	88.6	Confident	70 Å²	70	56.8 Å²	56.8	46%	0.455	30%	0.298	S	S	.	.	H	α-helix	trans	-63.8	-41.7	175.3	-22.3	35	0	0	0	112.8	L419 L420 S425 R426	L419-P422 WeakPolarHBondContact O-CD 3.44Å; L420-P422 VanDerWaalsContact C-CD 3.49Å; P422-S425 PolarHBondContact O-N 3.35Å; P422-R426 WeakPolarHBondContact O-CG 3.46Å; P422-R426 PolarHBondContact O-N 3.19Å; P422-R426 PolarHBondContact O-NH1 2.76Å
423	L	91	Very high	87.1	Confident	8 Å²	8	59.2 Å²	59.2	4%	0.042	32%	0.317	C	S	.	.	H	α-helix	trans	-63	-51.1	177	179.3	64.6	0	0	0	109.9	F314 E318 L420 S425 R426 L427	F314-L423 HydrophobicContact CB-CD2 3.81Å; E318-L423 HydrophobicContact CB-CD1 4.07Å; L420-L423 HydrophobicContact CD2-CD2 4.37Å; L420-L423 WeakPolarHBondContact O-CB 3.27Å; L420-L423 PolarHBondContact O-N 3.46Å; L420-L423 VanDerWaalsContact O-N 3.13Å; L423-S425 VanDerWaalsContact C-N 3.29Å; L423-S425 PolarHBondContact O-N 3.32Å; L423-R426 PolarHBondContact O-N 2.93Å; L423-R426 VanDerWaalsContact O-N 3.09Å; L423-L427 HydrophobicContact CD1-CD1 3.97Å; L423-L427 HydrophobicContact CD1-CD2 4.15Å; L423-L427 HydrophobicContact CD1-CG 3.94Å; L423-L427 HydrophobicContact CD2-CD1 4.48Å; L423-L427 HydrophobicContact CG-CD1 3.9Å; L423-L427 HydrophobicContact CG-CG 4.17Å; L423-L427 VanDerWaalsContact O-CG 3.32Å; L423-L427 WeakPolarHBondContact O-CG 3.21Å; L423-L427 PolarHBondContact O-N 2.91Å
424	K	90.4	Very high	85.6	Confident	63 Å²	63	61.6 Å²	61.6	27%	0.274	33%	0.33	S	S	.	.	H	α-helix	trans	-49.3	-49.7	176.1	179.9	178.3	178.6	176.3	0	112.1	F394 L420 M421 R426 L427 E428	F394-K424 HydrophobicContact CB-CD 4.04Å; F394-K424 HydrophobicContact CD1-CB 4.07Å; F394-K424 HydrophobicContact CD1-CD 4.13Å; F394-K424 HydrophobicContact CD1-CG 4.23Å; F394-K424 HydrophobicContact CD2-CB 4.14Å; F394-K424 HydrophobicContact CD2-CD 4.26Å; F394-K424 HydrophobicContact CD2-CG 3.81Å; F394-K424 HydrophobicContact CE1-CB 3.85Å; F394-K424 HydrophobicContact CE1-CG 4.45Å; F394-K424 HydrophobicContact CE2-CB 3.92Å; F394-K424 HydrophobicContact CE2-CG 4.04Å; F394-K424 HydrophobicContact CG-CB 4.23Å; F394-K424 HydrophobicContact CG-CD 3.88Å; F394-K424 HydrophobicContact CG-CG 3.92Å; F394-K424 HydrophobicContact CZ-CB 3.77Å; F394-K424 HydrophobicContact CZ-CG 4.36Å; L420-K424 PolarHBondContact O-N 3.06Å; M421-K424 PolarHBondContact O-N 2.96Å; K424-R426 PolarHBondContact O-N 3.27Å; K424-L427 PolarHBondContact O-N 2.84Å; K424-E428 WeakPolarHBondContact CE-OE1 3.27Å; K424-E428 HydrophobicContact CG-CG 4.26Å; K424-E428 WeakPolarHBondContact O-CB 3Å; K424-E428 WeakPolarHBondContact O-CG 3.45Å; K424-E428 PolarHBondContact O-N 3.38Å
425	S	89.3	Confident	83.4	Confident	68 Å²	68	61.5 Å²	61.5	48%	0.476	33%	0.332	S	S	.	.	H	α-helix	trans	-60.8	-42	-178.8	-56.8	0	0	0	0	112.5	M421 P422 L423 F429	M421-S425 PolarHBondContact O-N 3.26Å; M421-S425 PolarHBondContact O-OG 3.49Å; P422-S425 PolarHBondContact O-N 3.35Å; L423-S425 VanDerWaalsContact C-N 3.29Å; L423-S425 PolarHBondContact O-N 3.32Å; S425-F429 WeakPolarHBondContact O-CB 3.41Å; S425-F429 PolarHBondContact O-N 2.88Å
426	R	89.3	Confident	80.9	Confident	87 Å²	87	67.2 Å²	67.2	33%	0.328	36%	0.356	S	S	.	.	H	α-helix	trans	-68.7	-40.5	177.3	-67.3	-170.2	-55.6	-90.6	9.1	112.2	E318 P422 L423 K424 K430	E318-R426 IonicContact OE1-NE 3.15Å; E318-R426 PolarHBondContact OE1-NE 3.29Å; E318-R426 IonicContact OE2-CZ 3.36Å; E318-R426 VanDerWaalsContact OE2-CZ 3.29Å; E318-R426 IonicContact OE2-NE 2.89Å; E318-R426 PolarHBondContact OE2-NE 2.9Å; E318-R426 IonicContact OE2-NH2 3.81Å; E318-R426 PolarHBondContact OE2-NH2 3.37Å; P422-R426 WeakPolarHBondContact O-CG 3.46Å; P422-R426 PolarHBondContact O-N 3.19Å; P422-R426 PolarHBondContact O-NH1 2.76Å; L423-R426 PolarHBondContact O-N 2.93Å; L423-R426 VanDerWaalsContact O-N 3.09Å; K424-R426 PolarHBondContact O-N 3.27Å; R426-K430 WeakPolarHBondContact O-CG 3.35Å; R426-K430 PolarHBondContact O-N 3.45Å
427	L	86.3	Confident	78.4	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-71.4	-43.4	-179.3	-62.3	-170.9	0	0	0	112.1	E318 M321 C390 F394 L423 K424 F429 K430 C431	E318-L427 HydrophobicContact CB-CD2 4.06Å; E318-L427 HydrophobicContact CG-CD2 4.28Å; M321-L427 HydrophobicContact CE-CB 3.87Å; M321-L427 HydrophobicContact CE-CD2 3.92Å; M321-L427 HydrophobicContact CE-CG 4.31Å; M321-L427 HydrophobicContact SD-CB 4.17Å; M321-L427 HydrophobicContact SD-CD1 3.86Å; M321-L427 HydrophobicContact SD-CD2 3.6Å; M321-L427 HydrophobicContact SD-CG 4.05Å; C390-L427 WeakPolarHBondContact SG-CD1 3.31Å; F394-L427 HydrophobicContact CE2-CD1 4.33Å; F394-L427 HydrophobicContact CZ-CD1 4.45Å; L423-L427 HydrophobicContact CD1-CD1 3.97Å; L423-L427 HydrophobicContact CD1-CD2 4.15Å; L423-L427 HydrophobicContact CD1-CG 3.94Å; L423-L427 HydrophobicContact CD2-CD1 4.48Å; L423-L427 HydrophobicContact CG-CD1 3.9Å; L423-L427 HydrophobicContact CG-CG 4.17Å; L423-L427 VanDerWaalsContact O-CG 3.32Å; L423-L427 WeakPolarHBondContact O-CG 3.21Å; L423-L427 PolarHBondContact O-N 2.91Å; K424-L427 PolarHBondContact O-N 2.84Å; L427-F429 VanDerWaalsContact C-N 3.33Å; L427-F429 PolarHBondContact O-N 3.36Å; L427-K430 PolarHBondContact O-N 3.28Å; L427-C431 WeakPolarHBondContact O-CB 3.38Å; L427-C431 PolarHBondContact O-N 3.29Å
428	E	82.7	Confident	75.8	Confident	97 Å²	97	74.8 Å²	74.8	45%	0.453	40%	0.397	S	S	.	.	H	α-helix	trans	-62.1	-39.5	176.5	-75.2	-179.4	166.9	0	0	111.9	K424 K430 C431 A432	K424-E428 WeakPolarHBondContact CE-OE1 3.27Å; K424-E428 HydrophobicContact CG-CG 4.26Å; K424-E428 WeakPolarHBondContact O-CB 3Å; K424-E428 WeakPolarHBondContact O-CG 3.45Å; K424-E428 PolarHBondContact O-N 3.38Å; E428-K430 PolarHBondContact O-N 2.91Å; E428-C431 PolarHBondContact O-N 3.47Å; E428-A432 PolarHBondContact O-N 2.91Å
429	F	83.7	Confident	72.8	Confident	172 Å²	172	76.5 Å²	76.5	75%	0.754	41%	0.409	S	S	*	.	H	α-helix	trans	-59.9	-43.6	175.2	-178.9	-98.2	0	0	0	112.1	S425 L427 A432	S425-F429 WeakPolarHBondContact O-CB 3.41Å; S425-F429 PolarHBondContact O-N 2.88Å; L427-F429 VanDerWaalsContact C-N 3.33Å; L427-F429 PolarHBondContact O-N 3.36Å; F429-A432 VanDerWaalsContact O-CB 3.31Å; F429-A432 WeakPolarHBondContact O-CB 3.45Å; F429-A432 PolarHBondContact O-N 3Å
430	K	79.5	Confident	70.1	Confident	55 Å²	55	75.4 Å²	75.4	24%	0.239	42%	0.418	C	S	.	.	H	α-helix	trans	-68.6	-39.4	177.6	-68.2	173.9	-169.4	173.3	0	112	E318 N322 R426 L427 E428 A432 S433	E318-K430 IonicContact OE1-NZ 3.7Å; E318-K430 PolarHBondContact OE1-NZ 3.47Å; N322-K430 PolarHBondContact ND2-NZ 3.3Å; N322-K430 VanDerWaalsContact OD1-CD 3.31Å; N322-K430 WeakPolarHBondContact OD1-CD 3.4Å; N322-K430 WeakPolarHBondContact OD1-CE 3.44Å; N322-K430 PolarHBondContact OD1-NZ 3.04Å; R426-K430 WeakPolarHBondContact O-CG 3.35Å; R426-K430 PolarHBondContact O-N 3.45Å; L427-K430 PolarHBondContact O-N 3.28Å; E428-K430 PolarHBondContact O-N 2.91Å; K430-A432 PolarHBondContact O-N 2.83Å; K430-S433 PolarHBondContact O-OG 2.87Å
431	C	74.6	Confident	67.5	Low	14 Å²	14	78.3 Å²	78.3	10%	0.095	43%	0.434	C	S	.	.	H	α-helix	trans	-72.8	-10.8	176.9	-76.6	0	0	0	0	114.4	M321 L427 E428 S433 L434 S435	M321-C431 WeakPolarHBondContact CE-SG 2.95Å; L427-C431 WeakPolarHBondContact O-CB 3.38Å; L427-C431 PolarHBondContact O-N 3.29Å; E428-C431 PolarHBondContact O-N 3.47Å; C431-S433 PolarHBondContact O-N 2.87Å; C431-S433 VanDerWaalsContact O-N 3.13Å; C431-L434 HydrophobicContact CB-CD1 4.36Å; C431-L434 WeakPolarHBondContact O-CB 3.36Å; C431-L434 PolarHBondContact O-N 3.31Å; C431-S435 PolarHBondContact O-N 3.03Å; C431-S435 VanDerWaalsContact O-N 3.1Å
432	A	69.3	Low	65.2	Low	51 Å²	51	76 Å²	76	42%	0.421	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-28.8	177.2	0	0	0	0	0	112	E428 F429 K430 S435	E428-A432 PolarHBondContact O-N 2.91Å; F429-A432 VanDerWaalsContact O-CB 3.31Å; F429-A432 WeakPolarHBondContact O-CB 3.45Å; F429-A432 PolarHBondContact O-N 3Å; K430-A432 PolarHBondContact O-N 2.83Å; A432-S435 PolarHBondContact O-N 3.27Å; A432-S435 PolarHBondContact O-OG 2.84Å
433	S	60.9	Low	63	Low	89 Å²	89	73.1 Å²	73.1	62%	0.622	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-41.1	173.1	62	0	0	0	0	112.8	K430 C431 S435	K430-S433 PolarHBondContact O-OG 2.87Å; C431-S433 PolarHBondContact O-N 2.87Å; C431-S433 VanDerWaalsContact O-N 3.13Å; S433-S435 VanDerWaalsContact C-N 3.3Å; S433-S435 PolarHBondContact O-N 3.07Å
434	L	61.6	Low	61	Low	51 Å²	51	76.2 Å²	76.2	27%	0.267	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-68.5	-29.2	176.2	-66.2	163	0	0	0	112.2	L325 V387 C431 K436 A437	L325-L434 HydrophobicContact CD1-CD1 3.91Å; L325-L434 HydrophobicContact CD2-CD1 3.71Å; L325-L434 HydrophobicContact CD2-CD2 4.11Å; L325-L434 HydrophobicContact CD2-CG 4.26Å; L325-L434 HydrophobicContact CG-CD1 4.48Å; V387-L434 HydrophobicContact CG1-CD1 4.44Å; C431-L434 HydrophobicContact CB-CD1 4.36Å; C431-L434 WeakPolarHBondContact O-CB 3.36Å; C431-L434 PolarHBondContact O-N 3.31Å; L434-K436 PolarHBondContact O-N 3.46Å; L434-K436 VanDerWaalsContact O-N 3.14Å; L434-A437 WeakPolarHBondContact O-CB 3.18Å; L434-A437 PolarHBondContact O-N 3.01Å
435	S	48	Very low	58.8	Low	57 Å²	57	73.9 Å²	73.9	40%	0.399	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-63	-21.3	-174.8	76.5	0	0	0	0	114.4	C431 A432 S433 A437 K438	C431-S435 PolarHBondContact O-N 3.03Å; C431-S435 VanDerWaalsContact O-N 3.1Å; A432-S435 PolarHBondContact O-N 3.27Å; A432-S435 PolarHBondContact O-OG 2.84Å; S433-S435 VanDerWaalsContact C-N 3.3Å; S433-S435 PolarHBondContact O-N 3.07Å; S435-A437 PolarHBondContact O-N 3.43Å; S435-K438 WeakPolarHBondContact O-CB 3.25Å; S435-K438 PolarHBondContact O-N 3.35Å
436	K	40.8	Very low	56.7	Low	191 Å²	191	77.7 Å²	77.7	83%	0.83	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-69.3	-18.1	173.6	-77.4	-177.8	178.8	175.4	0	113.7	L434 K438	L434-K436 PolarHBondContact O-N 3.46Å; L434-K436 VanDerWaalsContact O-N 3.14Å; K436-K438 VanDerWaalsContact C-N 3.28Å; K436-K438 PolarHBondContact O-N 3.16Å
437	A	40.6	Very low	54.4	Low	52 Å²	52	75.1 Å²	75.1	43%	0.43	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-80.7	-2.4	174.3	0	0	0	0	0	113.7	L434 S435 S439	L434-A437 WeakPolarHBondContact O-CB 3.18Å; L434-A437 PolarHBondContact O-N 3.01Å; S435-A437 PolarHBondContact O-N 3.43Å; A437-S439 PolarHBondContact O-N 3.11Å
438	K	38.3	Very low	52	Low	174 Å²	174	77.2 Å²	77.2	76%	0.757	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-69.3	8	177	-71.3	-175.8	172.4	-178.2	0	114.7	S435 K436 G440	S435-K438 WeakPolarHBondContact O-CB 3.25Å; S435-K438 PolarHBondContact O-N 3.35Å; K436-K438 VanDerWaalsContact C-N 3.28Å; K436-K438 PolarHBondContact O-N 3.16Å; K438-G440 PolarHBondContact O-N 3.46Å
439	S	30.9	Very low	49.8	Very low	101 Å²	101	73.3 Å²	73.3	71%	0.706	40%	0.404	S	S	*	.	S	Bend	trans	-83.2	90.4	174.2	174.2	0	0	0	0	111.6	A437 N441	A437-S439 PolarHBondContact O-N 3.11Å; S439-N441 PolarHBondContact O-N 2.94Å
440	G	36	Very low	47.4	Very low	61 Å²	61	67.2 Å²	67.2	63%	0.629	39%	0.39	S	S	*	.	S	Bend	trans	68.2	-25	153.4	0	0	0	0	0	120	K438	K438-G440 PolarHBondContact O-N 3.46Å
441	N	40.2	Very low	45.6	Very low	71 Å²	71	70.5 Å²	70.5	38%	0.38	41%	0.406	S	S	.	.			trans	-120.3	15.3	-172.3	-77	6.8	0	0	0	113.3	S439 F443 E627	S439-N441 PolarHBondContact O-N 2.94Å; N441-F443 PolarHBondContact O-N 3.18Å; N441-E627 PolarHBondContact ND2-OE1 3.08Å
442	C	43.2	Very low	44.3	Very low	64 Å²	64	71 Å²	71	43%	0.432	41%	0.41	S	S	.	.			trans	-73	120	-179.6	-167.7	0	0	0	0	109.1	D444	C442-D444 PolarHBondContact O-N 3.13Å
443	F	46.4	Very low	43.5	Very low	10 Å²	10	69.8 Å²	69.8	4%	0.044	40%	0.396	C	S	.	.			trans	-49.2	110	160.7	178.8	-110.7	0	0	0	107	N441 L445 I483 T630 A634 M637	N441-F443 PolarHBondContact O-N 3.18Å; F443-L445 VanDerWaalsContact C-N 3.29Å; F443-L445 HydrophobicContact CD1-CD2 3.54Å; F443-L445 HydrophobicContact CD1-CG 3.81Å; F443-L445 HydrophobicContact CE1-CD2 3.49Å; F443-L445 VanDerWaalsContact CE1-CD2 3.49Å; F443-L445 HydrophobicContact CE1-CG 4.24Å; F443-L445 PolarHBondContact O-N 2.84Å; F443-I483 HydrophobicContact CD2-CG2 4.09Å; F443-I483 HydrophobicContact CE2-CG2 3.74Å; F443-T630 HydrophobicContact CB-CG2 3.64Å; F443-A634 HydrophobicContact CD2-CB 3.64Å; F443-A634 HydrophobicContact CE2-CB 3.51Å; F443-M637 HydrophobicContact CE2-CE 3.78Å; F443-M637 HydrophobicContact CZ-CE 3.59Å; F443-M637 HydrophobicContact CZ-SD 3.73Å
444	D	49.1	Very low	43.2	Very low	72 Å²	72	73.1 Å²	73.1	39%	0.385	40%	0.395	S	S	.	.			trans	-73.6	93.6	-172.4	-163.2	-2.5	0	0	0	107.8	C442 R446	C442-D444 PolarHBondContact O-N 3.13Å; D444-R446 PolarHBondContact O-N 3.4Å; D444-R446 WeakPolarHBondContact OD1-CB 3.39Å; D444-R446 WeakPolarHBondContact OD1-CD 3.3Å; D444-R446 WeakPolarHBondContact OD1-CG 3.1Å; D444-R446 IonicContact OD1-CZ 2.8Å; D444-R446 PolarHBondContact OD1-N 2.78Å; D444-R446 IonicContact OD1-NE 2.67Å; D444-R446 PolarHBondContact OD1-NE 2.99Å; D444-R446 IonicContact OD1-NH2 3.3Å; D444-R446 IonicContact OD2-CZ 2.66Å; D444-R446 IonicContact OD2-NE 3.33Å; D444-R446 PolarHBondContact OD2-NE 3.43Å; D444-R446 IonicContact OD2-NH2 3.16Å; D444-R446 PolarHBondContact OD2-NH2 3.34Å
445	L	44.6	Very low	43.2	Very low	14 Å²	14	76.2 Å²	76.2	7%	0.073	41%	0.407	C	S	.	.			trans	-66	7.9	172.3	-67.3	162.8	0	0	0	110.6	K381 L384 R385 Y388 F443 F447	K381-L445 HydrophobicContact CB-CD2 4.41Å; L384-L445 HydrophobicContact CB-CD1 4.32Å; R385-L445 VanDerWaalsContact CZ-CD2 3.49Å; R385-L445 PolarHBondContact NH1-O 3.22Å; Y388-L445 HydrophobicContact CD2-CB 3.98Å; Y388-L445 HydrophobicContact CD2-CD1 3.84Å; Y388-L445 HydrophobicContact CE2-CB 4.1Å; Y388-L445 HydrophobicContact CE2-CD1 3.25Å; Y388-L445 HydrophobicContact CE2-CG 4.28Å; F443-L445 VanDerWaalsContact C-N 3.29Å; F443-L445 HydrophobicContact CD1-CD2 3.54Å; F443-L445 HydrophobicContact CD1-CG 3.81Å; F443-L445 HydrophobicContact CE1-CD2 3.49Å; F443-L445 VanDerWaalsContact CE1-CD2 3.49Å; F443-L445 HydrophobicContact CE1-CG 4.24Å; F443-L445 PolarHBondContact O-N 2.84Å; L445-F447 VanDerWaalsContact C-N 3.31Å; L445-F447 PolarHBondContact O-N 2.94Å
446	R	45.6	Very low	44	Very low	148 Å²	148	73.6 Å²	73.6	56%	0.558	39%	0.388	S	S	*	.			trans	-75.7	82.6	167.1	-64	179.3	-66.4	172.8	3.4	110.2	D444 I448	D444-R446 PolarHBondContact O-N 3.4Å; D444-R446 WeakPolarHBondContact OD1-CB 3.39Å; D444-R446 WeakPolarHBondContact OD1-CD 3.3Å; D444-R446 WeakPolarHBondContact OD1-CG 3.1Å; D444-R446 IonicContact OD1-CZ 2.8Å; D444-R446 PolarHBondContact OD1-N 2.78Å; D444-R446 IonicContact OD1-NE 2.67Å; D444-R446 PolarHBondContact OD1-NE 2.99Å; D444-R446 IonicContact OD1-NH2 3.3Å; D444-R446 IonicContact OD2-CZ 2.66Å; D444-R446 IonicContact OD2-NE 3.33Å; D444-R446 PolarHBondContact OD2-NE 3.43Å; D444-R446 IonicContact OD2-NH2 3.16Å; D444-R446 PolarHBondContact OD2-NH2 3.34Å; R446-I448 HydrophobicContact CB-CD1 4.04Å; R446-I448 HydrophobicContact CB-CG1 4.07Å; R446-I448 HydrophobicContact CG-CD1 4.36Å; R446-I448 PolarHBondContact O-N 2.94Å
447	F	40.1	Very low	45.2	Very low	33 Å²	33	65.9 Å²	65.9	15%	0.145	36%	0.359	C	S	.	.			trans	-64.4	91.4	148.2	-84.3	-66	0	0	0	106.2	E244 K392 L445 M637	E244-F447 WeakPolarHBondContact OE1-CD2 3.48Å; K392-F447 PolarHBondContact NZ-O 3.26Å; L445-F447 VanDerWaalsContact C-N 3.31Å; L445-F447 PolarHBondContact O-N 2.94Å; F447-M637 HydrophobicContact CZ-SD 4.27Å
448	I	35.8	Very low	46.7	Very low	45 Å²	45	68.5 Å²	68.5	23%	0.231	36%	0.363	C	S	.	.			trans	-115.4	99.2	164.1	-61.3	170.9	0	0	0	105.6	R446 G450 E451 S452	R446-I448 HydrophobicContact CB-CD1 4.04Å; R446-I448 HydrophobicContact CB-CG1 4.07Å; R446-I448 HydrophobicContact CG-CD1 4.36Å; R446-I448 PolarHBondContact O-N 2.94Å; I448-G450 PolarHBondContact O-N 3.37Å; I448-E451 HydrophobicContact CG2-CB 4.08Å; I448-E451 HydrophobicContact CG2-CG 4.11Å; I448-S452 PolarHBondContact O-N 3.14Å
449	P	36.6	Very low	48.5	Very low	14 Å²	14	61.1 Å²	61.1	9%	0.091	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-7.5	-176.7	-25.6	38.6	0	0	0	114.5	G171 H236	G171-P449 WeakPolarHBondContact CA-O 3.38Å; H236-P449 VanDerWaalsContact NE2-CB 3.3Å; H236-P449 WeakPolarHBondContact NE2-CB 3.39Å; H236-P449 VanDerWaalsContact NE2-CG 3.27Å; H236-P449 WeakPolarHBondContact NE2-CG 3.5Å
450	G	34.3	Very low	50.8	Low	44 Å²	44	57.5 Å²	57.5	45%	0.454	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-32.4	-179.8	0	0	0	0	0	116.8	I448	I448-G450 PolarHBondContact O-N 3.37Å
451	E	40.3	Very low	52.8	Low	124 Å²	124	58.2 Å²	58.2	58%	0.579	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-29	-179.1	-71.4	-168.6	150.2	0	0	112.5	I448 N453 R454 F455	I448-E451 HydrophobicContact CG2-CB 4.08Å; I448-E451 HydrophobicContact CG2-CG 4.11Å; E451-N453 PolarHBondContact O-N 2.9Å; E451-R454 PolarHBondContact O-N 3.34Å; E451-R454 VanDerWaalsContact O-N 3.14Å; E451-F455 WeakPolarHBondContact O-CB 3.34Å; E451-F455 PolarHBondContact O-N 3.35Å
452	S	48.8	Very low	54.8	Low	24 Å²	24	59.5 Å²	59.5	17%	0.168	30%	0.296	C	S	.	.	H	α-helix	trans	-60.2	-41.4	-169.8	-176.8	0	0	0	0	113.3	I448 R454 F455 T456 M481	I448-S452 PolarHBondContact O-N 3.14Å; S452-R454 PolarHBondContact O-N 3.23Å; S452-F455 PolarHBondContact O-N 2.81Å; S452-T456 WeakPolarHBondContact O-CB 3.42Å; S452-T456 PolarHBondContact O-N 3.05Å; S452-T456 PolarHBondContact O-OG1 3.41Å; S452-M481 WeakPolarHBondContact OG-CG 3.35Å
453	N	51.1	Low	56.7	Low	26 Å²	26	56.5 Å²	56.5	14%	0.139	28%	0.276	C	S	.	.	H	α-helix	trans	-68.5	-36.3	179.3	-72.9	-28	0	0	0	112.4	T170 N172 E451 S457 V480	T170-N453 PolarHBondContact O-ND2 2.92Å; N172-N453 PolarHBondContact ND2-ND2 3.3Å; E451-N453 PolarHBondContact O-N 2.9Å; N453-S457 VanDerWaalsContact O-CB 3.22Å; N453-S457 WeakPolarHBondContact O-CB 3.36Å; N453-S457 PolarHBondContact O-N 2.9Å; N453-S457 PolarHBondContact O-OG 3.4Å; N453-V480 WeakPolarHBondContact OD1-CG1 3.44Å; N453-V480 PolarHBondContact OD1-O 3.09Å
454	R	54.5	Low	58.4	Low	160 Å²	160	62.3 Å²	62.3	60%	0.604	30%	0.298	S	S	*	.	H	α-helix	trans	-71	-46.6	177.7	-175.3	-179.2	179.7	-175.4	0.2	110.3	E451 S452 T456 S457 M458	E451-R454 PolarHBondContact O-N 3.34Å; E451-R454 VanDerWaalsContact O-N 3.14Å; S452-R454 PolarHBondContact O-N 3.23Å; R454-T456 VanDerWaalsContact C-N 3.33Å; R454-S457 PolarHBondContact O-N 3Å; R454-M458 HydrophobicContact CG-CG 4.45Å; R454-M458 WeakPolarHBondContact O-CB 3.48Å; R454-M458 WeakPolarHBondContact O-CG 3.49Å; R454-M458 PolarHBondContact O-N 3.18Å
455	F	62.7	Low	59.9	Low	115 Å²	115	66.5 Å²	66.5	50%	0.504	31%	0.312	S	S	.	.	H	α-helix	trans	-59.6	-46.6	175.3	-178.4	-96.4	0	0	0	110.8	E451 S452 S457 M458 K459 F482	E451-F455 WeakPolarHBondContact O-CB 3.34Å; E451-F455 PolarHBondContact O-N 3.35Å; S452-F455 PolarHBondContact O-N 2.81Å; F455-S457 PolarHBondContact O-N 3.47Å; F455-M458 WeakPolarHBondContact O-CB 3.38Å; F455-M458 PolarHBondContact O-N 3.44Å; F455-K459 VanDerWaalsContact O-CB 3.25Å; F455-K459 WeakPolarHBondContact O-CB 3.34Å; F455-K459 PolarHBondContact O-N 3.24Å; F455-F482 HydrophobicContact CD1-CD1 4.38Å; F455-F482 AromaticContact CE1-CD1 3.66Å; F455-F482 HydrophobicContact CE1-CD1 3.66Å; F455-F482 HydrophobicContact CE1-CE1 4.16Å; F455-F482 HydrophobicContact CE1-CG 4.33Å
456	T	63.9	Low	61.7	Low	2 Å²	2	66.6 Å²	66.6	1%	0.012	31%	0.314	C	S	.	.	H	α-helix	trans	-62.8	-43.3	177.4	-58	0	0	0	0	111.6	S452 R454 M458 K459 L460 V480 M481 F482 F539	S452-T456 WeakPolarHBondContact O-CB 3.42Å; S452-T456 PolarHBondContact O-N 3.05Å; S452-T456 PolarHBondContact O-OG1 3.41Å; R454-T456 VanDerWaalsContact C-N 3.33Å; T456-M458 PolarHBondContact O-N 3.07Å; T456-K459 PolarHBondContact O-N 2.89Å; T456-L460 HydrophobicContact CG2-CD1 3.94Å; T456-L460 HydrophobicContact CG2-CG 4.22Å; T456-L460 WeakPolarHBondContact O-CB 3.44Å; T456-L460 VanDerWaalsContact O-CG 3.27Å; T456-L460 WeakPolarHBondContact O-CG 3.48Å; T456-L460 PolarHBondContact O-N 3.09Å; T456-V480 WeakPolarHBondContact CG2-O 3.44Å; T456-M481 WeakPolarHBondContact OG1-CA 3.37Å; T456-F482 HydrophobicContact CG2-CB 4.16Å; T456-F482 PolarHBondContact OG1-N 3.28Å; T456-F539 HydrophobicContact CG2-CD1 4.17Å; T456-F539 HydrophobicContact CG2-CE1 4.16Å
457	S	67.3	Low	63.5	Low	30 Å²	30	59.8 Å²	59.8	21%	0.21	29%	0.289	C	S	.	.	H	α-helix	trans	-64	-41.9	176.5	-61.2	0	0	0	0	111.8	N453 R454 F455 L461	N453-S457 VanDerWaalsContact O-CB 3.22Å; N453-S457 WeakPolarHBondContact O-CB 3.36Å; N453-S457 PolarHBondContact O-N 2.9Å; N453-S457 PolarHBondContact O-OG 3.4Å; R454-S457 PolarHBondContact O-N 3Å; F455-S457 PolarHBondContact O-N 3.47Å; S457-L461 WeakPolarHBondContact O-CB 3.33Å; S457-L461 PolarHBondContact O-N 2.94Å
458	M	70.2	Confident	65.6	Low	106 Å²	106	62.1 Å²	62.1	52%	0.522	30%	0.303	S	S	.	.	H	α-helix	trans	-62.9	-44.2	174.4	-72.9	-81.9	-66.5	0	0	111	R454 F455 T456 L461 E462	R454-M458 HydrophobicContact CG-CG 4.45Å; R454-M458 WeakPolarHBondContact O-CB 3.48Å; R454-M458 WeakPolarHBondContact O-CG 3.49Å; R454-M458 PolarHBondContact O-N 3.18Å; F455-M458 WeakPolarHBondContact O-CB 3.38Å; F455-M458 PolarHBondContact O-N 3.44Å; T456-M458 PolarHBondContact O-N 3.07Å; M458-L461 WeakPolarHBondContact O-CB 3.34Å; M458-L461 PolarHBondContact O-N 2.71Å; M458-E462 WeakPolarHBondContact O-CB 3.49Å; M458-E462 PolarHBondContact O-N 3.21Å
459	K	77.4	Confident	67.8	Low	20 Å²	20	62.6 Å²	62.6	9%	0.087	32%	0.319	C	S	.	.	H	α-helix	trans	-67.4	-41.7	178.8	-167.3	66.6	174.2	178.9	0	111.4	F455 T456 L461 E462 L463 F482 E485	F455-K459 VanDerWaalsContact O-CB 3.25Å; F455-K459 WeakPolarHBondContact O-CB 3.34Å; F455-K459 PolarHBondContact O-N 3.24Å; T456-K459 PolarHBondContact O-N 2.89Å; K459-L461 VanDerWaalsContact C-N 3.31Å; K459-L461 PolarHBondContact O-N 3.13Å; K459-E462 IonicContact NZ-OE1 3.05Å; K459-E462 PolarHBondContact NZ-OE1 2.96Å; K459-E462 VanDerWaalsContact NZ-OE1 3.1Å; K459-E462 WeakPolarHBondContact O-CB 3.38Å; K459-E462 PolarHBondContact O-N 3.29Å; K459-L463 WeakPolarHBondContact O-CB 3.33Å; K459-L463 VanDerWaalsContact O-CG 3.31Å; K459-L463 WeakPolarHBondContact O-CG 3.28Å; K459-L463 PolarHBondContact O-N 3.23Å; K459-F482 HydrophobicContact CG-CD2 4.03Å; K459-F482 HydrophobicContact CG-CE2 4.25Å; K459-F482 HydrophobicContact CG-CG 4.3Å; K459-E485 WeakPolarHBondContact CE-OE2 3.4Å; K459-E485 IonicContact NZ-OE1 2.8Å; K459-E485 IonicContact NZ-OE2 2.71Å; K459-E485 PolarHBondContact NZ-OE2 3.12Å
460	L	78.3	Confident	69.9	Low	25 Å²	25	63.6 Å²	63.6	13%	0.131	32%	0.321	C	S	.	.	H	α-helix	trans	-60.8	-40.9	172.5	-76.2	169.9	0	0	0	111	T456 L463 R464 W470 C479 F539	T456-L460 HydrophobicContact CG2-CD1 3.94Å; T456-L460 HydrophobicContact CG2-CG 4.22Å; T456-L460 WeakPolarHBondContact O-CB 3.44Å; T456-L460 VanDerWaalsContact O-CG 3.27Å; T456-L460 WeakPolarHBondContact O-CG 3.48Å; T456-L460 PolarHBondContact O-N 3.09Å; L460-L463 PolarHBondContact O-N 3.33Å; L460-R464 VanDerWaalsContact O-CB 3.23Å; L460-R464 WeakPolarHBondContact O-CB 3.32Å; L460-R464 PolarHBondContact O-N 2.93Å; L460-W470 HydrophobicContact CD2-CH2 4.38Å; L460-W470 HydrophobicContact CD2-CZ2 3.94Å; L460-C479 HydrophobicContact CD1-CB 4.05Å; L460-C479 HydrophobicContact CD2-CB 4.12Å; L460-F539 HydrophobicContact CD2-CD1 4.24Å; L460-F539 HydrophobicContact CD2-CE1 3.59Å; L460-F539 HydrophobicContact CD2-CE2 4.38Å; L460-F539 HydrophobicContact CD2-CZ 3.69Å; L460-F539 HydrophobicContact CG-CE1 3.91Å; L460-F539 HydrophobicContact CG-CZ 4.35Å
461	L	78.8	Confident	72	Confident	76 Å²	76	63.9 Å²	63.9	40%	0.398	31%	0.312	S	S	.	.	H	α-helix	trans	-67	-37.8	175.7	-172	69.4	0	0	0	112.3	S457 M458 K459 K465	S457-L461 WeakPolarHBondContact O-CB 3.33Å; S457-L461 PolarHBondContact O-N 2.94Å; M458-L461 WeakPolarHBondContact O-CB 3.34Å; M458-L461 PolarHBondContact O-N 2.71Å; K459-L461 VanDerWaalsContact C-N 3.31Å; K459-L461 PolarHBondContact O-N 3.13Å; L461-K465 WeakPolarHBondContact O-CG 3.36Å; L461-K465 PolarHBondContact O-N 3.07Å
462	E	83	Confident	73.4	Confident	97 Å²	97	61.2 Å²	61.2	45%	0.453	30%	0.302	S	S	.	.	H	α-helix	trans	-64.2	-48	173.1	-179.2	-166.5	133.9	0	0	111.2	M458 K459 K465 S466	M458-E462 WeakPolarHBondContact O-CB 3.49Å; M458-E462 PolarHBondContact O-N 3.21Å; K459-E462 IonicContact NZ-OE1 3.05Å; K459-E462 PolarHBondContact NZ-OE1 2.96Å; K459-E462 VanDerWaalsContact NZ-OE1 3.1Å; K459-E462 WeakPolarHBondContact O-CB 3.38Å; K459-E462 PolarHBondContact O-N 3.29Å; E462-K465 PolarHBondContact O-N 3.33Å; E462-S466 WeakPolarHBondContact O-CB 3.28Å; E462-S466 PolarHBondContact O-N 3.11Å; E462-S466 PolarHBondContact O-OG 2.95Å
463	L	82.6	Confident	74.4	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-66.2	-39.3	178.7	-67.8	-171.7	0	0	0	112.4	K459 L460 K465 S466 V467 W470 F537 F539	K459-L463 WeakPolarHBondContact O-CB 3.33Å; K459-L463 VanDerWaalsContact O-CG 3.31Å; K459-L463 WeakPolarHBondContact O-CG 3.28Å; K459-L463 PolarHBondContact O-N 3.23Å; L460-L463 PolarHBondContact O-N 3.33Å; L463-K465 PolarHBondContact O-N 3.23Å; L463-S466 WeakPolarHBondContact CA-OG 3.44Å; L463-S466 PolarHBondContact O-N 3.12Å; L463-S466 PolarHBondContact O-OG 2.96Å; L463-V467 HydrophobicContact CB-CG2 4.27Å; L463-V467 HydrophobicContact CD2-CG2 4.33Å; L463-V467 VanDerWaalsContact O-CB 3.27Å; L463-V467 WeakPolarHBondContact O-CB 3.14Å; L463-V467 VanDerWaalsContact O-CG2 3.28Å; L463-V467 WeakPolarHBondContact O-CG2 3.02Å; L463-V467 PolarHBondContact O-N 3.36Å; L463-W470 HydrophobicContact CB-CE3 4.44Å; L463-W470 HydrophobicContact CB-CH2 3.72Å; L463-W470 HydrophobicContact CB-CZ2 4.39Å; L463-W470 HydrophobicContact CB-CZ3 3.75Å; L463-W470 HydrophobicContact CD1-CH2 4.01Å; L463-W470 HydrophobicContact CD1-CZ3 4.28Å; L463-F537 HydrophobicContact CD1-CB 4.13Å; L463-F537 HydrophobicContact CD1-CD1 3.83Å; L463-F537 HydrophobicContact CD1-CD2 4.16Å; L463-F537 HydrophobicContact CD1-CE1 4.23Å; L463-F537 HydrophobicContact CD1-CG 3.78Å; L463-F537 HydrophobicContact CD2-CD1 3.96Å; L463-F537 HydrophobicContact CD2-CD2 4.34Å; L463-F537 HydrophobicContact CD2-CE1 3.48Å; L463-F537 VanDerWaalsContact CD2-CE1 3.48Å; L463-F537 HydrophobicContact CD2-CE2 3.91Å; L463-F537 HydrophobicContact CD2-CG 4.36Å; L463-F537 HydrophobicContact CD2-CZ 3.44Å; L463-F537 VanDerWaalsContact CD2-CZ 3.44Å; L463-F537 HydrophobicContact CG-CE1 4.49Å; L463-F539 HydrophobicContact CD1-CE2 3.87Å; L463-F539 HydrophobicContact CD1-CZ 3.57Å
464	R	81.3	Confident	75.2	Confident	133 Å²	133	69.6 Å²	69.6	50%	0.502	34%	0.337	S	S	.	.	H	α-helix	trans	-57	-32.5	173.6	-173.5	179.1	-170.5	-148.9	-1	112.5	L460 W470 D472	L460-R464 VanDerWaalsContact O-CB 3.23Å; L460-R464 WeakPolarHBondContact O-CB 3.32Å; L460-R464 PolarHBondContact O-N 2.93Å; R464-W470 HydrophobicContact CB-CG 4.45Å; R464-W470 HydrophobicContact CG-CG 4.39Å; R464-D472 WeakPolarHBondContact CD-OD1 3.41Å; R464-D472 IonicContact CZ-OD1 3.02Å; R464-D472 IonicContact CZ-OD2 3.6Å; R464-D472 VanDerWaalsContact CZ-OD2 3.29Å; R464-D472 IonicContact NE-OD1 3.98Å; R464-D472 PolarHBondContact NE-OD1 2.9Å; R464-D472 IonicContact NE-OD2 3.1Å; R464-D472 PolarHBondContact NE-OD2 3.43Å; R464-D472 VanDerWaalsContact NE-OD2 3.14Å; R464-D472 IonicContact NH2-OD1 3.87Å; R464-D472 IonicContact NH2-OD2 3.8Å; R464-D472 PolarHBondContact NH2-OD2 3.05Å
465	K	81.4	Confident	76	Confident	159 Å²	159	62 Å²	62	69%	0.691	31%	0.308	S	S	*	.	H	α-helix	trans	-85.8	-34.4	177.3	-69.4	176.5	-177	177.9	0	113.1	L461 E462 L463	L461-K465 WeakPolarHBondContact O-CG 3.36Å; L461-K465 PolarHBondContact O-N 3.07Å; E462-K465 PolarHBondContact O-N 3.33Å; L463-K465 PolarHBondContact O-N 3.23Å
466	S	82.8	Confident	76.1	Confident	16 Å²	16	57.7 Å²	57.7	11%	0.112	30%	0.297	C	S	.	.	H	α-helix	trans	-91.4	-19	-173.1	58.8	0	0	0	0	114.2	E462 L463 S559 E560 Y561	E462-S466 WeakPolarHBondContact O-CB 3.28Å; E462-S466 PolarHBondContact O-N 3.11Å; E462-S466 PolarHBondContact O-OG 2.95Å; L463-S466 WeakPolarHBondContact CA-OG 3.44Å; L463-S466 PolarHBondContact O-N 3.12Å; L463-S466 PolarHBondContact O-OG 2.96Å; S466-S559 CarbonylContact O-C 3.35Å; S466-S559 WeakPolarHBondContact O-CA 3.5Å; S466-S559 WeakPolarHBondContact O-CB 3.14Å; S466-E560 PolarHBondContact O-N 2.92Å; S466-Y561 PolarHBondContact O-N 3.02Å
467	V	83.2	Confident	76.2	Confident	6 Å²	6	59 Å²	59	4%	0.036	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	113.6	-178.1	-175.1	0	0	0	0	111	L463 W470 Y561 L563	L463-V467 HydrophobicContact CB-CG2 4.27Å; L463-V467 HydrophobicContact CD2-CG2 4.33Å; L463-V467 VanDerWaalsContact O-CB 3.27Å; L463-V467 WeakPolarHBondContact O-CB 3.14Å; L463-V467 VanDerWaalsContact O-CG2 3.28Å; L463-V467 WeakPolarHBondContact O-CG2 3.02Å; L463-V467 PolarHBondContact O-N 3.36Å; V467-W470 HydrophobicContact CB-CE3 3.83Å; V467-W470 HydrophobicContact CB-CZ3 4.38Å; V467-W470 HydrophobicContact CG1-CE3 4.05Å; V467-W470 HydrophobicContact CG2-CE3 4.11Å; V467-W470 HydrophobicContact CG2-CZ3 4.15Å; V467-Y561 CarbonylContact C-O 3.57Å; V467-Y561 WeakPolarHBondContact CA-O 3.32Å; V467-L563 HydrophobicContact CG1-CB 3.76Å
468	D	83.1	Confident	76.2	Confident	82 Å²	82	59 Å²	59	44%	0.439	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	131.3	171	-179.7	31	0	0	0	111.1	Y561 R562 L563	D468-Y561 PolarHBondContact N-O 2.84Å; D468-R562 HydrophobicContact CB-CB 4.38Å; D468-R562 HydrophobicContact CB-CG 4.34Å; D468-L563 WeakPolarHBondContact O-CB 3.44Å; D468-L563 PolarHBondContact O-N 2.99Å
469	G	81.5	Confident	76	Confident	54 Å²	54	54.4 Å²	54.4	56%	0.557	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.5	22.3	-179.1	0	0	0	0	0	116.1	L563	G469-L563 VanDerWaalsContact O-CD2 3.24Å; G469-L563 WeakPolarHBondContact O-CD2 3.34Å
470	W	80.7	Confident	75.4	Confident	35 Å²	35	55.1 Å²	55.1	13%	0.133	29%	0.288	C	S	.	.			trans	-59.2	134.9	179.9	-169.1	-96.1	0	0	0	113.8	L460 L463 R464 V467 D472 I475 V544	L460-W470 HydrophobicContact CD2-CH2 4.38Å; L460-W470 HydrophobicContact CD2-CZ2 3.94Å; L463-W470 HydrophobicContact CB-CE3 4.44Å; L463-W470 HydrophobicContact CB-CH2 3.72Å; L463-W470 HydrophobicContact CB-CZ2 4.39Å; L463-W470 HydrophobicContact CB-CZ3 3.75Å; L463-W470 HydrophobicContact CD1-CH2 4.01Å; L463-W470 HydrophobicContact CD1-CZ3 4.28Å; R464-W470 HydrophobicContact CB-CG 4.45Å; R464-W470 HydrophobicContact CG-CG 4.39Å; V467-W470 HydrophobicContact CB-CE3 3.83Å; V467-W470 HydrophobicContact CB-CZ3 4.38Å; V467-W470 HydrophobicContact CG1-CE3 4.05Å; V467-W470 HydrophobicContact CG2-CE3 4.11Å; V467-W470 HydrophobicContact CG2-CZ3 4.15Å; W470-D472 VanDerWaalsContact CD1-OD1 3.25Å; W470-I475 HydrophobicContact CD2-CD1 4.3Å; W470-I475 HydrophobicContact CE3-CD1 4.26Å; W470-I475 HydrophobicContact CH2-CD1 4.49Å; W470-I475 HydrophobicContact CH2-CG2 3.64Å; W470-I475 HydrophobicContact CZ2-CB 4.05Å; W470-I475 HydrophobicContact CZ2-CG2 3.43Å; W470-I475 VanDerWaalsContact CZ2-CG2 3.43Å; W470-I475 HydrophobicContact CZ3-CD1 4.35Å; W470-I475 HydrophobicContact CZ3-CG2 4.48Å; W470-V544 HydrophobicContact CZ3-CG1 4.32Å
471	D	78.5	Confident	75	Confident	50 Å²	50	55.7 Å²	55.7	27%	0.267	29%	0.29	S	S	.	.			trans	-104.6	99.3	178.5	-175.1	-11.3	0	0	0	111.1	K473 N474 I475	D471-K473 VanDerWaalsContact C-N 3.3Å; D471-K473 PolarHBondContact O-N 3.35Å; D471-K473 PolarHBondContact OD1-N 3.49Å; D471-K473 VanDerWaalsContact OD1-N 3.09Å; D471-N474 PolarHBondContact OD1-N 3.35Å; D471-N474 PolarHBondContact OD2-ND2 3.31Å; D471-I475 HydrophobicContact CB-CD1 4.31Å; D471-I475 HydrophobicContact CB-CG1 4.38Å; D471-I475 WeakPolarHBondContact O-CB 3.49Å; D471-I475 WeakPolarHBondContact O-CG1 3.35Å; D471-I475 PolarHBondContact O-N 2.6Å
472	D	70.5	Confident	74.8	Confident	68 Å²	68	53.5 Å²	53.5	36%	0.364	28%	0.277	S	S	.	.	I	π-helix	trans	-63.2	-32.7	-178.3	-76.4	-33.5	0	0	0	113.1	R464 W470 G476	R464-D472 WeakPolarHBondContact CD-OD1 3.41Å; R464-D472 IonicContact CZ-OD1 3.02Å; R464-D472 IonicContact CZ-OD2 3.6Å; R464-D472 VanDerWaalsContact CZ-OD2 3.29Å; R464-D472 IonicContact NE-OD1 3.98Å; R464-D472 PolarHBondContact NE-OD1 2.9Å; R464-D472 IonicContact NE-OD2 3.1Å; R464-D472 PolarHBondContact NE-OD2 3.43Å; R464-D472 VanDerWaalsContact NE-OD2 3.14Å; R464-D472 IonicContact NH2-OD1 3.87Å; R464-D472 IonicContact NH2-OD2 3.8Å; R464-D472 PolarHBondContact NH2-OD2 3.05Å; W470-D472 VanDerWaalsContact CD1-OD1 3.25Å; D472-G476 PolarHBondContact O-N 3.23Å
473	K	69.3	Low	74.4	Confident	158 Å²	158	49.6 Å²	49.6	69%	0.687	26%	0.259	S	S	*	.	I	π-helix	trans	-73.6	-43.6	-175	-69.3	-175.6	179.5	-177.8	0	111.5	D471 C477	D471-K473 VanDerWaalsContact C-N 3.3Å; D471-K473 PolarHBondContact O-N 3.35Å; D471-K473 PolarHBondContact OD1-N 3.49Å; D471-K473 VanDerWaalsContact OD1-N 3.09Å; K473-C477 WeakPolarHBondContact O-CB 3.47Å
474	N	68.3	Low	74.5	Confident	68 Å²	68	49.8 Å²	49.8	36%	0.364	26%	0.26	S	S	.	.	I	π-helix	trans	-94.7	-27.8	-172.6	-66.8	-44.8	0	0	0	113.5	D471 N478 F566	D471-N474 PolarHBondContact OD1-N 3.35Å; D471-N474 PolarHBondContact OD2-ND2 3.31Å; N474-N478 PolarHBondContact O-ND2 3.04Å; N474-F566 HydrophobicContact CB-CE2 3.9Å; N474-F566 HydrophobicContact CB-CZ 3.64Å
475	I	72.3	Confident	74.8	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.248	C	C	.	.	I	π-helix	trans	-94.4	-55.7	179.9	-52.2	174.2	0	0	0	109.8	W470 D471 C477 N478 C479 V542 V544 L563 F566	W470-I475 HydrophobicContact CD2-CD1 4.3Å; W470-I475 HydrophobicContact CE3-CD1 4.26Å; W470-I475 HydrophobicContact CH2-CD1 4.49Å; W470-I475 HydrophobicContact CH2-CG2 3.64Å; W470-I475 HydrophobicContact CZ2-CB 4.05Å; W470-I475 HydrophobicContact CZ2-CG2 3.43Å; W470-I475 VanDerWaalsContact CZ2-CG2 3.43Å; W470-I475 HydrophobicContact CZ3-CD1 4.35Å; W470-I475 HydrophobicContact CZ3-CG2 4.48Å; D471-I475 HydrophobicContact CB-CD1 4.31Å; D471-I475 HydrophobicContact CB-CG1 4.38Å; D471-I475 WeakPolarHBondContact O-CB 3.49Å; D471-I475 WeakPolarHBondContact O-CG1 3.35Å; D471-I475 PolarHBondContact O-N 2.6Å; I475-C477 PolarHBondContact O-N 3.18Å; I475-N478 PolarHBondContact O-N 2.83Å; I475-C479 PolarHBondContact O-N 2.92Å; I475-C479 PolarHBondContact O-SG 3.02Å; I475-V542 HydrophobicContact CG2-CG1 4.44Å; I475-V544 HydrophobicContact CD1-CG2 4.38Å; I475-V544 HydrophobicContact CG2-CG2 4.07Å; I475-L563 HydrophobicContact CD1-CD2 4.04Å; I475-F566 HydrophobicContact CD1-CD1 4.38Å; I475-F566 HydrophobicContact CG1-CD1 4.49Å; I475-F566 HydrophobicContact CG1-CG 4.39Å
476	G	64.7	Low	75	Confident	25 Å²	25	38.3 Å²	38.3	26%	0.258	22%	0.215	S	C	.	.	I	π-helix	trans	-62	-39.8	-172.8	0	0	0	0	0	114.5	D472 N478	D472-G476 PolarHBondContact O-N 3.23Å; G476-N478 VanDerWaalsContact C-N 3.33Å; G476-N478 PolarHBondContact O-N 2.94Å
477	C	65.4	Low	75.3	Confident	30 Å²	30	42.1 Å²	42.1	20%	0.203	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-12.8	-177.4	-66.7	0	0	0	0	114.9	R192 K473 I475	R192-C477 PolarHBondContact NH1-O 3.28Å; K473-C477 WeakPolarHBondContact O-CB 3.47Å; I475-C477 PolarHBondContact O-N 3.18Å
478	N	66.1	Low	75.6	Confident	30 Å²	30	41.9 Å²	41.9	16%	0.16	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-7.7	-175.9	-70.4	-37	0	0	0	113.3	N474 I475 G476 V542	N474-N478 PolarHBondContact O-ND2 3.04Å; I475-N478 PolarHBondContact O-N 2.83Å; G476-N478 VanDerWaalsContact C-N 3.33Å; G476-N478 PolarHBondContact O-N 2.94Å; N478-V542 HydrophobicContact CB-CG2 3.82Å
479	C	67.8	Low	75.8	Confident	10 Å²	10	43 Å²	43	7%	0.068	23%	0.229	C	C	.	.			trans	-102.3	118.9	-178.7	-59.8	0	0	0	0	110.5	L460 I475 F539 D540	L460-C479 HydrophobicContact CD1-CB 4.05Å; L460-C479 HydrophobicContact CD2-CB 4.12Å; I475-C479 PolarHBondContact O-N 2.92Å; I475-C479 PolarHBondContact O-SG 3.02Å; C479-F539 HydrophobicContact CB-CB 3.93Å; C479-F539 HydrophobicContact CB-CD1 3.82Å; C479-F539 HydrophobicContact CB-CG 3.96Å; C479-F539 WeakPolarHBondContact SG-CB 3.49Å; C479-F539 WeakPolarHBondContact SG-CG 3.47Å; C479-D540 WeakPolarHBondContact CA-OD1 3.42Å
480	V	64.2	Low	76.1	Confident	35 Å²	35	41.5 Å²	41.5	21%	0.212	21%	0.207	C	C	.	.	S	Bend	trans	-100.1	-35.2	169	-173	0	0	0	0	110	N453 T456 D540	N453-V480 WeakPolarHBondContact OD1-CG1 3.44Å; N453-V480 PolarHBondContact OD1-O 3.09Å; T456-V480 WeakPolarHBondContact CG2-O 3.44Å; V480-D540 VanDerWaalsContact CB-OD2 3.25Å; V480-D540 WeakPolarHBondContact CB-OD2 3.28Å; V480-D540 PolarHBondContact N-OD1 3.44Å; V480-D540 PolarHBondContact N-OD2 3.24Å
481	M	69.3	Low	76	Confident	36 Å²	36	40.4 Å²	40.4	18%	0.177	20%	0.204	C	C	.	.			trans	-136.9	133.9	-171.6	174.6	164.5	40	0	0	112.6	S452 T456 I483 F539 D540	S452-M481 WeakPolarHBondContact OG-CG 3.35Å; T456-M481 WeakPolarHBondContact OG1-CA 3.37Å; M481-I483 HydrophobicContact CG-CG1 4.32Å; M481-F539 CarbonylContact O-C 3.59Å; M481-F539 VanDerWaalsContact O-CA 3.24Å; M481-F539 WeakPolarHBondContact O-CA 3.39Å; M481-D540 HydrophobicContact CB-CB 4.31Å; M481-D540 PolarHBondContact N-OD1 3.18Å; M481-D540 PolarHBondContact O-N 2.86Å
482	F	75	Confident	75.5	Confident	31 Å²	31	40.9 Å²	40.9	14%	0.136	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	137	167.3	176.2	-94.9	0	0	0	110.3	F455 T456 K459 E485 F537 F539	F455-F482 HydrophobicContact CD1-CD1 4.38Å; F455-F482 AromaticContact CE1-CD1 3.66Å; F455-F482 HydrophobicContact CE1-CD1 3.66Å; F455-F482 HydrophobicContact CE1-CE1 4.16Å; F455-F482 HydrophobicContact CE1-CG 4.33Å; T456-F482 HydrophobicContact CG2-CB 4.16Å; T456-F482 PolarHBondContact OG1-N 3.28Å; K459-F482 HydrophobicContact CG-CD2 4.03Å; K459-F482 HydrophobicContact CG-CE2 4.25Å; K459-F482 HydrophobicContact CG-CG 4.3Å; F482-E485 HydrophobicContact CE2-CB 4.21Å; F482-E485 HydrophobicContact CZ-CB 3.74Å; F482-E485 HydrophobicContact CZ-CG 3.84Å; F482-F537 HydrophobicContact CE2-CD1 4.29Å; F482-F539 HydrophobicContact CB-CD1 4.05Å; F482-F539 HydrophobicContact CB-CE1 3.9Å; F482-F539 HydrophobicContact CD2-CD1 4.22Å; F482-F539 AromaticContact CD2-CE1 3.72Å; F482-F539 HydrophobicContact CD2-CE1 3.72Å; F482-F539 HydrophobicContact CD2-CE2 4.5Å; F482-F539 AromaticContact CD2-CZ 3.87Å; F482-F539 HydrophobicContact CD2-CZ 3.87Å; F482-F539 HydrophobicContact CG-CE1 4.31Å
483	I	75.3	Confident	74.9	Confident	14 Å²	14	40.5 Å²	40.5	7%	0.072	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	-53	-170.6	-62.2	171.3	0	0	0	111.9	F443 M481 L538 D540 A634 M637 L638	F443-I483 HydrophobicContact CD2-CG2 4.09Å; F443-I483 HydrophobicContact CE2-CG2 3.74Å; M481-I483 HydrophobicContact CG-CG1 4.32Å; I483-L538 HydrophobicContact CB-CD2 4.36Å; I483-L538 HydrophobicContact CB-CG 4.24Å; I483-L538 HydrophobicContact CG2-CD2 4.07Å; I483-L538 HydrophobicContact CG2-CG 4.5Å; I483-L538 PolarHBondContact N-O 3.45Å; I483-D540 HydrophobicContact CD1-CB 4.12Å; I483-A634 HydrophobicContact CG2-CB 4.17Å; I483-M637 HydrophobicContact CG2-CE 4.39Å; I483-L638 HydrophobicContact CD1-CD1 3.53Å; I483-L638 HydrophobicContact CD1-CD2 3.54Å; I483-L638 HydrophobicContact CD1-CG 3.89Å
484	L	83.3	Confident	74	Confident	5 Å²	5	38.9 Å²	38.9	3%	0.026	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	145.5	-172.8	-172.1	63.5	0	0	0	110.9	L538 T630 W631 A634	L484-L538 HydrophobicContact CB-CB 4.24Å; L484-L538 HydrophobicContact CB-CD2 4.39Å; L484-L538 PolarHBondContact N-O 2.93Å; L484-L538 PolarHBondContact O-N 2.99Å; L484-T630 HydrophobicContact CD2-CG2 4.31Å; L484-W631 HydrophobicContact CD2-CD2 3.61Å; L484-W631 HydrophobicContact CD2-CE3 3.76Å; L484-W631 HydrophobicContact CD2-CG 4.11Å; L484-W631 HydrophobicContact CD2-CH2 4.18Å; L484-W631 HydrophobicContact CD2-CZ2 4.06Å; L484-W631 HydrophobicContact CD2-CZ3 4.05Å; L484-W631 HydrophobicContact CG-CH2 4.2Å; L484-W631 HydrophobicContact CG-CZ2 4.19Å; L484-W631 HydrophobicContact CG-CZ3 4.42Å; L484-A634 HydrophobicContact CD2-CB 4.23Å
485	E	87.4	Confident	72.8	Confident	52 Å²	52	45 Å²	45	24%	0.243	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	152.9	164.7	63.6	-174.5	-163.7	0	0	110.5	K459 F482 F535 V536 F537	K459-E485 WeakPolarHBondContact CE-OE2 3.4Å; K459-E485 IonicContact NZ-OE1 2.8Å; K459-E485 IonicContact NZ-OE2 2.71Å; K459-E485 PolarHBondContact NZ-OE2 3.12Å; F482-E485 HydrophobicContact CE2-CB 4.21Å; F482-E485 HydrophobicContact CZ-CB 3.74Å; F482-E485 HydrophobicContact CZ-CG 3.84Å; E485-F535 HydrophobicContact CB-CE1 3.91Å; E485-F535 HydrophobicContact CB-CZ 4.36Å; E485-F535 HydrophobicContact CG-CE1 4.37Å; E485-F535 HydrophobicContact CG-CZ 4.42Å; E485-V536 VanDerWaalsContact CA-O 3.31Å; E485-V536 WeakPolarHBondContact CA-O 3.36Å; E485-F537 HydrophobicContact CB-CD1 3.82Å; E485-F537 HydrophobicContact CB-CE1 4.21Å; E485-F537 WeakPolarHBondContact OE2-CE1 3.47Å
486	G	86.8	Confident	71.2	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.3	-177.6	177.4	0	0	0	0	0	113.7	V536	G486-V536 PolarHBondContact N-O 3.24Å; G486-V536 VanDerWaalsContact N-O 3.11Å; G486-V536 PolarHBondContact O-N 2.92Å
487	K	88.9	Confident	69.7	Low	95 Å²	95	54.9 Å²	54.9	41%	0.413	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	122.3	-174.9	-70.6	172.4	170.6	-167.5	0	110.7	E533 F535	K487-E533 WeakPolarHBondContact CD-OE1 3.29Å; K487-E533 IonicContact NZ-OE1 3.84Å; K487-F535 HydrophobicContact CG-CD2 3.71Å; K487-F535 HydrophobicContact CG-CE2 4.01Å
488	L	89.6	Confident	68.1	Low	1 Å²	1	60.9 Å²	60.9	1%	0.005	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	145.6	174.7	-66.2	176	0	0	0	110.5	R534 V536 F607 L620 A622 W631	L488-R534 PolarHBondContact N-O 3.07Å; L488-R534 PolarHBondContact O-N 2.97Å; L488-R534 VanDerWaalsContact O-O 3.07Å; L488-V536 HydrophobicContact CB-CG2 4.07Å; L488-V536 HydrophobicContact CD1-CB 4.34Å; L488-V536 HydrophobicContact CD1-CG2 4.02Å; L488-V536 HydrophobicContact CG-CG2 4.31Å; L488-F607 HydrophobicContact CD1-CZ 3.82Å; L488-F607 HydrophobicContact CD2-CE1 4.17Å; L488-F607 HydrophobicContact CD2-CZ 4.18Å; L488-L620 HydrophobicContact CD1-CD1 4.09Å; L488-A622 HydrophobicContact CD2-CB 4.25Å; L488-W631 HydrophobicContact CD1-CD2 3.86Å; L488-W631 HydrophobicContact CD1-CE3 4.05Å; L488-W631 HydrophobicContact CD1-CG 4.36Å; L488-W631 HydrophobicContact CD1-CH2 4.35Å; L488-W631 HydrophobicContact CD1-CZ2 4.14Å; L488-W631 HydrophobicContact CD1-CZ3 4.29Å; L488-W631 HydrophobicContact CD2-CD2 4.43Å; L488-W631 HydrophobicContact CD2-CG 4.28Å; L488-W631 HydrophobicContact CG-CD2 4.41Å; L488-W631 HydrophobicContact CG-CZ2 4.24Å
489	K	87.5	Confident	66.6	Low	106 Å²	106	64.4 Å²	64.4	46%	0.461	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	126.6	171.9	-64.6	175	-174.7	168.8	0	108.8	L620 L621	K489-L620 CarbonylContact O-C 3.52Å; K489-L620 WeakPolarHBondContact O-CA 3.28Å; K489-L621 HydrophobicContact CB-CB 4.25Å; K489-L621 HydrophobicContact CB-CD1 4.16Å; K489-L621 PolarHBondContact N-O 3.25Å; K489-L621 WeakPolarHBondContact O-CD1 3.29Å; K489-L621 PolarHBondContact O-N 3.27Å
490	K	86.3	Confident	65.4	Low	23 Å²	23	70.1 Å²	70.1	10%	0.1	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	125.1	171.4	175.5	165.9	175.7	157.7	0	110.1	V492 T531 T532 R534 E565 T618 L620	K490-V492 HydrophobicContact CG-CG2 4.4Å; K490-T531 WeakPolarHBondContact O-CA 3.44Å; K490-T532 PolarHBondContact N-O 3.16Å; K490-T532 PolarHBondContact O-N 3.14Å; K490-R534 HydrophobicContact CB-CG 4.36Å; K490-E565 VanDerWaalsContact CD-OE1 3.27Å; K490-E565 WeakPolarHBondContact CD-OE1 3.44Å; K490-E565 WeakPolarHBondContact CE-OE1 3.41Å; K490-E565 IonicContact NZ-OE1 2.7Å; K490-E565 PolarHBondContact NZ-OE1 3.38Å; K490-E565 IonicContact NZ-OE2 3.3Å; K490-E565 PolarHBondContact NZ-OE2 3.45Å; K490-T618 HydrophobicContact CD-CG2 3.61Å; K490-T618 HydrophobicContact CG-CG2 3.91Å; K490-T618 PolarHBondContact NZ-OG1 2.68Å; K490-T618 VanDerWaalsContact NZ-OG1 3.11Å; K490-L620 HydrophobicContact CB-CD2 4.03Å; K490-L620 HydrophobicContact CG-CD2 4.49Å
491	C	79.3	Confident	64.2	Low	11 Å²	11	76.1 Å²	76.1	7%	0.074	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	128.9	171.2	-91.4	0	0	0	0	110.9	V619 L621	C491-V619 HydrophobicContact CB-CB 4.29Å; C491-V619 PolarHBondContact N-O 3.5Å; C491-L621 HydrophobicContact CB-CD1 4.45Å; C491-L621 WeakPolarHBondContact SG-CD1 3.5Å
492	V	67.8	Low	62.7	Low	61 Å²	61	79.7 Å²	79.7	37%	0.37	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	120	174.1	-174.8	0	0	0	0	108.6	K490 K530	K490-V492 HydrophobicContact CG-CG2 4.4Å; V492-K530 WeakPolarHBondContact CA-O 3.47Å; V492-K530 WeakPolarHBondContact CB-O 3Å; V492-K530 PolarHBondContact N-O 3.3Å; V492-K530 PolarHBondContact O-N 3.5Å
493	F	58.3	Low	60.9	Low	59 Å²	59	82.3 Å²	82.3	26%	0.259	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	131.6	175.4	-64.8	-77.1	0	0	0	110.6	H529 L586 I589	F493-H529 HydrophobicContact CD1-CB 4.15Å; F493-H529 HydrophobicContact CE1-CB 4.3Å; F493-L586 HydrophobicContact CE1-CB 4.41Å; F493-L586 HydrophobicContact CE1-CD2 4.04Å; F493-L586 HydrophobicContact CE2-CD2 3.85Å; F493-L586 HydrophobicContact CZ-CB 3.88Å; F493-L586 HydrophobicContact CZ-CD2 3.16Å; F493-L586 HydrophobicContact CZ-CG 4.04Å; F493-I589 HydrophobicContact CD2-CG2 4.11Å; F493-I589 HydrophobicContact CE2-CB 4.32Å; F493-I589 HydrophobicContact CE2-CG2 3.89Å
494	Q	49.6	Very low	59.1	Low	124 Å²	124	87.2 Å²	87.2	58%	0.579	48%	0.475	S	S	*	.			trans	-81.6	125.1	172.1	-87.6	179	-32.4	0	0	109.3	L496	Q494-L496 PolarHBondContact O-N 3.5Å; Q494-L496 VanDerWaalsContact O-N 3.09Å
495	K	44.1	Very low	56.7	Low	198 Å²	198	90.3 Å²	90.3	86%	0.861	51%	0.508	S	S	*	.			trans	-62.7	107.5	160.7	-79	-178.5	175.1	179.8	0	107.4	T497	K495-T497 PolarHBondContact O-N 2.89Å; K495-T497 VanDerWaalsContact O-N 3.12Å
496	L	37.6	Very low	54.3	Low	113 Å²	113	96.6 Å²	96.6	59%	0.592	54%	0.538	S	S	*	.			trans	-62.7	111.3	164.1	-93	124.5	0	0	0	107.8	Q494	Q494-L496 PolarHBondContact O-N 3.5Å; Q494-L496 VanDerWaalsContact O-N 3.09Å
497	T	33.8	Very low	51.9	Low	118 Å²	118	106.3 Å²	106.3	72%	0.724	58%	0.58	S	S	*	*			trans	-63.3	133.9	172.8	44.9	0	0	0	0	109.7	K495 S499	K495-T497 PolarHBondContact O-N 2.89Å; K495-T497 VanDerWaalsContact O-N 3.12Å; T497-S499 PolarHBondContact O-N 2.85Å
498	N	31.6	Very low	49.4	Very low	156 Å²	156	108.3 Å²	108.3	83%	0.834	61%	0.605	S	S	*	*	S	Bend	trans	-58	23.8	-175	-77.1	-20.5	0	0	0	117.3
499	S	36	Very low	46.9	Very low	104 Å²	104	113 Å²	113	73%	0.727	64%	0.643	S	S	*	*	S	Bend	trans	-88.3	-1.8	-176.4	-109.7	0	0	0	0	115.6	T497	T497-S499 PolarHBondContact O-N 2.85Å
500	I	41	Very low	44.5	Very low	130 Å²	130	116.7 Å²	116.7	67%	0.667	66%	0.66	S	S	*	*	S	Bend	trans	-115.3	-9	-172.8	-58.4	175.1	0	0	0	113.2
501	L	40	Very low	42.1	Very low	161 Å²	161	125.2 Å²	125.2	84%	0.843	70%	0.697	S	S	*	*	S	Bend	trans	-101.5	10.2	-176.2	-87.7	102.1	0	0	0	115.9
502	S	37.1	Very low	40	Very low	112 Å²	112	135 Å²	135	78%	0.783	74%	0.739	S	S	*	*	S	Bend	trans	-94.8	10.9	-179.3	68	0	0	0	0	115
503	S	37.8	Very low	38.4	Very low	86 Å²	86	137.4 Å²	137.4	60%	0.601	76%	0.758	S	S	*	*	S	Bend	trans	-137.4	131.7	178.6	51.1	0	0	0	0	109.6
504	S	37.4	Very low	37.3	Very low	116 Å²	116	141.3 Å²	141.3	81%	0.811	79%	0.79	S	S	*	*			trans	70.9	84.5	-176.6	69.7	0	0	0	0	116.5
505	G	32	Very low	36.6	Very low	70 Å²	70	139.2 Å²	139.2	72%	0.722	80%	0.801	S	S	*	*			trans	-69	158.2	141.5	0	0	0	0	0	109.5
506	E	37.7	Very low	36.3	Very low	185 Å²	185	134.2 Å²	134.2	86%	0.864	80%	0.797	S	S	*	*			trans	89	68.4	-172.6	-53.8	179.4	174.6	0	0	115.4
507	F	37.8	Very low	36.1	Very low	203 Å²	203	136.7 Å²	136.7	89%	0.89	81%	0.811	S	S	*	*			trans	-154.3	-6.9	157.7	-118.9	-79.7	0	0	0	118.1
508	C	34.7	Very low	36.2	Very low	138 Å²	138	139 Å²	139	93%	0.932	82%	0.818	S	S	*	*			trans	-111.3	76.2	-177.7	-91.1	0	0	0	0	113.3
509	A	37	Very low	36.4	Very low	98 Å²	98	139.1 Å²	139.1	81%	0.81	82%	0.817	S	S	*	*	S	Bend	trans	-138.7	7.1	166.1	0	0	0	0	0	114.6
510	F	37.2	Very low	36.1	Very low	184 Å²	184	145.4 Å²	145.4	81%	0.807	83%	0.825	S	S	*	*			trans	-113.8	4.4	-163.5	-108.4	-81.1	0	0	0	118.4
511	F	37.5	Very low	35.8	Very low	202 Å²	202	146.6 Å²	146.6	89%	0.886	83%	0.832	S	S	*	*			trans	-128.7	71.7	-174.8	-73.2	-83	0	0	0	113.3
512	F	34.7	Very low	35.5	Very low	216 Å²	216	147.5 Å²	147.5	95%	0.947	84%	0.838	S	S	*	*			trans	-127.3	80.9	157	-90.7	-81.9	0	0	0	108.9
513	S	33	Very low	35.5	Very low	112 Å²	112	147 Å²	147	78%	0.783	83%	0.831	S	S	*	*			trans	-163.1	119.3	154.5	-88.8	0	0	0	0	108.8	G515	S513-G515 PolarHBondContact O-N 3.19Å
514	P	35.9	Very low	35.5	Very low	142 Å²	142	148.7 Å²	148.7	92%	0.922	84%	0.839	S	S	*	*			trans	-81.6	114.3	179.3	30	-28.1	0	0	0	109.9
515	G	35.9	Very low	35.5	Very low	79 Å²	79	154.2 Å²	154.2	81%	0.814	84%	0.842	S	S	*	*			trans	152.6	54.5	170.6	0	0	0	0	0	117.1	S513	S513-G515 PolarHBondContact O-N 3.19Å
516	A	36.9	Very low	35.9	Very low	94 Å²	94	156.7 Å²	156.7	78%	0.777	84%	0.844	S	S	*	*			trans	-153.9	120.1	164	0	0	0	0	0	112.1
517	D	32.7	Very low	36.3	Very low	165 Å²	165	157.8 Å²	157.8	88%	0.882	84%	0.84	S	S	*	*			trans	-61.2	125.6	167.8	-73.6	-52.2	0	0	0	111.2
518	L	36.8	Very low	36.9	Very low	165 Å²	165	149.5 Å²	149.5	86%	0.864	81%	0.809	S	S	*	*			trans	-147.6	87	164.6	-107.6	148	0	0	0	110.3
519	L	34.8	Very low	38.2	Very low	159 Å²	159	144.7 Å²	144.7	83%	0.832	77%	0.772	S	S	*	*			trans	-62.1	143.5	157.8	-77.3	160	0	0	0	109.9
520	R	30.8	Very low	39.7	Very low	237 Å²	237	146 Å²	146	89%	0.894	76%	0.76	S	S	*	*			trans	86.2	87	165.5	-56.4	178.1	175.1	169.8	-1.2	116.9
521	L	35.1	Very low	41.5	Very low	155 Å²	155	140.1 Å²	140.1	81%	0.812	74%	0.739	S	S	*	*			trans	-143.9	109	141.3	-132.1	93.7	0	0	0	108.8	T523	L521-T523 PolarHBondContact O-N 3Å
522	D	32.2	Very low	43.7	Very low	179 Å²	179	131.9 Å²	131.9	96%	0.957	71%	0.706	S	S	*	*			trans	-67.8	107	171.5	-84.8	-41.2	0	0	0	109.4
523	T	37.5	Very low	46.1	Very low	103 Å²	103	126 Å²	126	63%	0.632	68%	0.681	S	S	*	*			trans	-122.2	142	165.4	41.4	0	0	0	0	108.9	L521 R525	L521-T523 PolarHBondContact O-N 3Å; T523-R525 PolarHBondContact O-N 2.99Å; T523-R525 VanDerWaalsContact O-N 3.14Å
524	P	38.5	Very low	48.8	Very low	120 Å²	120	121.9 Å²	121.9	78%	0.779	65%	0.648	S	S	*	*			trans	-66	117.7	-169.7	25.8	-32.1	0	0	0	110.5	T526	P524-T526 PolarHBondContact O-N 3.02Å
525	R	36.1	Very low	51.4	Low	232 Å²	232	116.4 Å²	116.4	88%	0.875	61%	0.61	S	S	*	*			trans	-59.7	90.9	175.9	-73.1	178.4	171.2	-178.8	-5.3	111.2	T523 R527	T523-R525 PolarHBondContact O-N 2.99Å; T523-R525 VanDerWaalsContact O-N 3.14Å; R525-R527 PolarHBondContact O-N 3.19Å
526	T	42.2	Very low	54	Low	123 Å²	123	112.6 Å²	112.6	76%	0.755	57%	0.571	S	S	*	*			trans	-74	105.4	163.1	38.9	0	0	0	0	108.7	P524 A528	P524-T526 PolarHBondContact O-N 3.02Å; T526-A528 PolarHBondContact O-N 2.92Å
527	R	45.6	Very low	56.5	Low	207 Å²	207	108.2 Å²	108.2	78%	0.781	54%	0.535	S	S	*	.			trans	-66	120.6	176.9	-78.8	-178.8	172.6	170.8	-2.5	110.1	R525 H529	R525-R527 PolarHBondContact O-N 3.19Å; R527-H529 PolarHBondContact O-N 3.17Å
528	A	50.8	Low	59.1	Low	29 Å²	29	100.4 Å²	100.4	24%	0.24	49%	0.493	C	S	.	.	S	Bend	trans	-70.6	-9.5	179.9	0	0	0	0	0	114.7	T526 I596	T526-A528 PolarHBondContact O-N 2.92Å; A528-I596 HydrophobicContact CB-CD1 4.28Å
529	H	60.6	Low	61.4	Low	37 Å²	37	92.5 Å²	92.5	17%	0.171	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	150.8	-179.1	62.2	-90.3	0	0	0	111.4	F493 R527	F493-H529 HydrophobicContact CD1-CB 4.15Å; F493-H529 HydrophobicContact CE1-CB 4.3Å; R527-H529 PolarHBondContact O-N 3.17Å
530	K	68.6	Low	63.3	Low	125 Å²	125	86.1 Å²	86.1	54%	0.543	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	116	173.7	-171.9	174.1	-176.5	172.8	0	109.4	V492 T532	V492-K530 WeakPolarHBondContact CA-O 3.47Å; V492-K530 WeakPolarHBondContact CB-O 3Å; V492-K530 PolarHBondContact N-O 3.3Å; V492-K530 PolarHBondContact O-N 3.5Å; K530-T532 HydrophobicContact CG-CG2 4.26Å
531	T	75.1	Confident	65.3	Low	61 Å²	61	75.7 Å²	75.7	37%	0.374	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	140.5	168.8	51	0	0	0	0	109.6	K490 L621	K490-T531 WeakPolarHBondContact O-CA 3.44Å; T531-L621 HydrophobicContact CG2-CD1 4.41Å
532	T	82.9	Confident	67.7	Low	30 Å²	30	68.3 Å²	68.3	18%	0.184	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	123	175.2	63.7	0	0	0	0	109.4	K490 K530 R534	K490-T532 PolarHBondContact N-O 3.16Å; K490-T532 PolarHBondContact O-N 3.14Å; K530-T532 HydrophobicContact CG-CG2 4.26Å; T532-R534 VanDerWaalsContact OG1-CZ 3.24Å; T532-R534 PolarHBondContact OG1-NH1 2.98Å; T532-R534 PolarHBondContact OG1-NH2 2.96Å
533	E	86.3	Confident	70.4	Confident	91 Å²	91	59.8 Å²	59.8	43%	0.425	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	139.1	178	-166	177	178.4	0	0	110.4	K487	K487-E533 WeakPolarHBondContact CD-OE1 3.29Å; K487-E533 IonicContact NZ-OE1 3.84Å
534	R	89.7	Confident	72.9	Confident	26 Å²	26	54.9 Å²	54.9	10%	0.098	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	137.4	173.8	-65.5	-67.5	-177.8	-73.4	-13.6	108.1	L488 K490 T532 V536 F545 C546	L488-R534 PolarHBondContact N-O 3.07Å; L488-R534 PolarHBondContact O-N 2.97Å; L488-R534 VanDerWaalsContact O-O 3.07Å; K490-R534 HydrophobicContact CB-CG 4.36Å; T532-R534 VanDerWaalsContact OG1-CZ 3.24Å; T532-R534 PolarHBondContact OG1-NH1 2.98Å; T532-R534 PolarHBondContact OG1-NH2 2.96Å; R534-V536 HydrophobicContact CB-CG2 4.07Å; R534-F545 HydrophobicContact CB-CD1 4.19Å; R534-F545 HydrophobicContact CG-CB 4.47Å; R534-F545 HydrophobicContact CG-CD1 4.31Å; R534-C546 CarbonylContact C-O 3.37Å; R534-C546 VanDerWaalsContact CA-O 3.24Å; R534-C546 WeakPolarHBondContact CA-O 3.43Å; R534-C546 WeakPolarHBondContact CD-O 3.34Å
535	F	90.4	Very high	75.4	Confident	27 Å²	27	49.2 Å²	49.2	12%	0.118	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	124.5	162.4	-156.6	-86.2	0	0	0	106.9	E485 K487 F537 C546 Y561	E485-F535 HydrophobicContact CB-CE1 3.91Å; E485-F535 HydrophobicContact CB-CZ 4.36Å; E485-F535 HydrophobicContact CG-CE1 4.37Å; E485-F535 HydrophobicContact CG-CZ 4.42Å; K487-F535 HydrophobicContact CG-CD2 3.71Å; K487-F535 HydrophobicContact CG-CE2 4.01Å; F535-F537 HydrophobicContact CD1-CD1 4.32Å; F535-F537 HydrophobicContact CD1-CD2 4.35Å; F535-F537 AromaticContact CD1-CE1 3.69Å; F535-F537 HydrophobicContact CD1-CE1 3.69Å; F535-F537 AromaticContact CD1-CE2 3.72Å; F535-F537 HydrophobicContact CD1-CE2 3.72Å; F535-F537 AromaticContact CD1-CZ 3.35Å; F535-F537 HydrophobicContact CD1-CZ 3.35Å; F535-F537 HydrophobicContact CE1-CD1 4.12Å; F535-F537 AromaticContact CE1-CE1 3.41Å; F535-F537 HydrophobicContact CE1-CE1 3.41Å; F535-F537 VanDerWaalsContact CE1-CE1 3.41Å; F535-F537 HydrophobicContact CE1-CE2 4.31Å; F535-F537 AromaticContact CE1-CZ 3.54Å; F535-F537 HydrophobicContact CE1-CZ 3.54Å; F535-C546 PolarHBondContact N-O 3.22Å; F535-C546 WeakPolarHBondContact O-CA 3.49Å; F535-C546 WeakPolarHBondContact O-CB 3.47Å; F535-C546 PolarHBondContact O-N 3.36Å; F535-Y561 HydrophobicContact CB-CD1 4.02Å; F535-Y561 HydrophobicContact CB-CE1 3.64Å; F535-Y561 HydrophobicContact CD1-CE1 4.04Å; F535-Y561 HydrophobicContact CD2-CE1 4.14Å; F535-Y561 HydrophobicContact CG-CD1 4.45Å; F535-Y561 AromaticContact CG-CE1 3.67Å; F535-Y561 HydrophobicContact CG-CE1 3.67Å
536	V	90.9	Very high	77.9	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	130.9	-171.2	-177.1	0	0	0	0	108.7	E485 G486 L488 R534 I543 V544 F545 W631	E485-V536 VanDerWaalsContact CA-O 3.31Å; E485-V536 WeakPolarHBondContact CA-O 3.36Å; G486-V536 PolarHBondContact N-O 3.24Å; G486-V536 VanDerWaalsContact N-O 3.11Å; G486-V536 PolarHBondContact O-N 2.92Å; L488-V536 HydrophobicContact CB-CG2 4.07Å; L488-V536 HydrophobicContact CD1-CB 4.34Å; L488-V536 HydrophobicContact CD1-CG2 4.02Å; L488-V536 HydrophobicContact CG-CG2 4.31Å; R534-V536 HydrophobicContact CB-CG2 4.07Å; V536-I543 HydrophobicContact CG1-CD1 3.77Å; V536-I543 HydrophobicContact CG1-CG1 3.55Å; V536-V544 VanDerWaalsContact CA-O 3.31Å; V536-V544 WeakPolarHBondContact CA-O 3.43Å; V536-F545 HydrophobicContact CG1-CD1 4.39Å; V536-F545 HydrophobicContact CG1-CE1 4.22Å; V536-F545 HydrophobicContact CG2-CD1 3.5Å; V536-F545 VanDerWaalsContact CG2-CD1 3.5Å; V536-F545 HydrophobicContact CG2-CE1 3.71Å; V536-F545 HydrophobicContact CG2-CG 4.38Å; V536-W631 HydrophobicContact CB-CH2 3.73Å; V536-W631 HydrophobicContact CB-CZ2 4.36Å; V536-W631 HydrophobicContact CB-CZ3 4.31Å; V536-W631 HydrophobicContact CG1-CH2 3.75Å; V536-W631 HydrophobicContact CG1-CZ3 3.85Å
537	F	89.5	Confident	80.1	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.009	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	123.3	172	-55.6	-83.7	0	0	0	108.4	L463 F482 E485 F535 F539 V544 C546 Y561	L463-F537 HydrophobicContact CD1-CB 4.13Å; L463-F537 HydrophobicContact CD1-CD1 3.83Å; L463-F537 HydrophobicContact CD1-CD2 4.16Å; L463-F537 HydrophobicContact CD1-CE1 4.23Å; L463-F537 HydrophobicContact CD1-CG 3.78Å; L463-F537 HydrophobicContact CD2-CD1 3.96Å; L463-F537 HydrophobicContact CD2-CD2 4.34Å; L463-F537 HydrophobicContact CD2-CE1 3.48Å; L463-F537 VanDerWaalsContact CD2-CE1 3.48Å; L463-F537 HydrophobicContact CD2-CE2 3.91Å; L463-F537 HydrophobicContact CD2-CG 4.36Å; L463-F537 HydrophobicContact CD2-CZ 3.44Å; L463-F537 VanDerWaalsContact CD2-CZ 3.44Å; L463-F537 HydrophobicContact CG-CE1 4.49Å; F482-F537 HydrophobicContact CE2-CD1 4.29Å; E485-F537 HydrophobicContact CB-CD1 3.82Å; E485-F537 HydrophobicContact CB-CE1 4.21Å; E485-F537 WeakPolarHBondContact OE2-CE1 3.47Å; F535-F537 HydrophobicContact CD1-CD1 4.32Å; F535-F537 HydrophobicContact CD1-CD2 4.35Å; F535-F537 AromaticContact CD1-CE1 3.69Å; F535-F537 HydrophobicContact CD1-CE1 3.69Å; F535-F537 AromaticContact CD1-CE2 3.72Å; F535-F537 HydrophobicContact CD1-CE2 3.72Å; F535-F537 AromaticContact CD1-CZ 3.35Å; F535-F537 HydrophobicContact CD1-CZ 3.35Å; F535-F537 HydrophobicContact CE1-CD1 4.12Å; F535-F537 AromaticContact CE1-CE1 3.41Å; F535-F537 HydrophobicContact CE1-CE1 3.41Å; F535-F537 VanDerWaalsContact CE1-CE1 3.41Å; F535-F537 HydrophobicContact CE1-CE2 4.31Å; F535-F537 AromaticContact CE1-CZ 3.54Å; F535-F537 HydrophobicContact CE1-CZ 3.54Å; F537-F539 HydrophobicContact CB-CE2 3.93Å; F537-V544 HydrophobicContact CB-CB 4.28Å; F537-V544 PolarHBondContact N-O 3.02Å; F537-V544 PolarHBondContact O-N 3.33Å; F537-C546 HydrophobicContact CE2-CB 4.18Å; F537-Y561 HydrophobicContact CZ-CD2 4.26Å; F537-Y561 HydrophobicContact CZ-CE2 4.13Å
538	L	87.4	Confident	81.8	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	119.3	177.9	-177.3	63.1	0	0	0	109.7	I483 L484 I543 W631 A634 L635 L638	I483-L538 HydrophobicContact CB-CD2 4.36Å; I483-L538 HydrophobicContact CB-CG 4.24Å; I483-L538 HydrophobicContact CG2-CD2 4.07Å; I483-L538 HydrophobicContact CG2-CG 4.5Å; I483-L538 PolarHBondContact N-O 3.45Å; L484-L538 HydrophobicContact CB-CB 4.24Å; L484-L538 HydrophobicContact CB-CD2 4.39Å; L484-L538 PolarHBondContact N-O 2.93Å; L484-L538 PolarHBondContact O-N 2.99Å; L538-I543 HydrophobicContact CD1-CB 3.93Å; L538-I543 HydrophobicContact CD1-CD1 4.39Å; L538-I543 HydrophobicContact CD1-CG1 4.18Å; L538-W631 HydrophobicContact CB-CZ3 4.08Å; L538-W631 HydrophobicContact CD2-CZ3 4.48Å; L538-A634 HydrophobicContact CD2-CB 3.75Å; L538-L635 HydrophobicContact CD1-CD2 3.65Å; L538-L635 HydrophobicContact CD2-CD2 3.91Å; L538-L635 HydrophobicContact CD2-CG 4.37Å; L538-L635 HydrophobicContact CG-CD2 4.45Å; L538-L638 HydrophobicContact CD1-CD1 3.97Å; L538-L638 HydrophobicContact CD2-CD1 4.22Å; L538-L638 HydrophobicContact CG-CD1 4.18Å
539	F	83.5	Confident	82.8	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	166.6	166.4	-61.6	-90.9	0	0	0	109.3	T456 L460 L463 C479 M481 F482 F537 G541 V542 V544	T456-F539 HydrophobicContact CG2-CD1 4.17Å; T456-F539 HydrophobicContact CG2-CE1 4.16Å; L460-F539 HydrophobicContact CD2-CD1 4.24Å; L460-F539 HydrophobicContact CD2-CE1 3.59Å; L460-F539 HydrophobicContact CD2-CE2 4.38Å; L460-F539 HydrophobicContact CD2-CZ 3.69Å; L460-F539 HydrophobicContact CG-CE1 3.91Å; L460-F539 HydrophobicContact CG-CZ 4.35Å; L463-F539 HydrophobicContact CD1-CE2 3.87Å; L463-F539 HydrophobicContact CD1-CZ 3.57Å; C479-F539 HydrophobicContact CB-CB 3.93Å; C479-F539 HydrophobicContact CB-CD1 3.82Å; C479-F539 HydrophobicContact CB-CG 3.96Å; C479-F539 WeakPolarHBondContact SG-CB 3.49Å; C479-F539 WeakPolarHBondContact SG-CG 3.47Å; M481-F539 CarbonylContact O-C 3.59Å; M481-F539 VanDerWaalsContact O-CA 3.24Å; M481-F539 WeakPolarHBondContact O-CA 3.39Å; F482-F539 HydrophobicContact CB-CD1 4.05Å; F482-F539 HydrophobicContact CB-CE1 3.9Å; F482-F539 HydrophobicContact CD2-CD1 4.22Å; F482-F539 AromaticContact CD2-CE1 3.72Å; F482-F539 HydrophobicContact CD2-CE1 3.72Å; F482-F539 HydrophobicContact CD2-CE2 4.5Å; F482-F539 AromaticContact CD2-CZ 3.87Å; F482-F539 HydrophobicContact CD2-CZ 3.87Å; F482-F539 HydrophobicContact CG-CE1 4.31Å; F537-F539 HydrophobicContact CB-CE2 3.93Å; F539-G541 VanDerWaalsContact C-N 3.34Å; F539-G541 PolarHBondContact O-N 2.81Å; F539-V542 WeakPolarHBondContact CA-O 3.25Å; F539-V542 WeakPolarHBondContact CB-O 3.26Å; F539-V542 PolarHBondContact N-O 3.24Å; F539-V544 HydrophobicContact CD2-CG2 4.33Å; F539-V544 HydrophobicContact CE2-CG2 4.38Å
540	D	74.8	Confident	82.8	Confident	25 Å²	25	34.7 Å²	34.7	13%	0.134	19%	0.19	C	C	.	.	S	Bend	trans	-55.7	-44.7	176.5	60.7	-30.5	0	0	0	113.3	C479 V480 M481 I483 T569 L638	C479-D540 WeakPolarHBondContact CA-OD1 3.42Å; V480-D540 VanDerWaalsContact CB-OD2 3.25Å; V480-D540 WeakPolarHBondContact CB-OD2 3.28Å; V480-D540 PolarHBondContact N-OD1 3.44Å; V480-D540 PolarHBondContact N-OD2 3.24Å; M481-D540 HydrophobicContact CB-CB 4.31Å; M481-D540 PolarHBondContact N-OD1 3.18Å; M481-D540 PolarHBondContact O-N 2.86Å; I483-D540 HydrophobicContact CD1-CB 4.12Å; D540-T569 PolarHBondContact O-OG1 3.1Å; D540-L638 HydrophobicContact CB-CD2 4.23Å
541	G	74.7	Confident	82.1	Confident	18 Å²	18	34.6 Å²	34.6	19%	0.186	21%	0.205	C	C	.	.	S	Bend	trans	-94.6	-17.9	179.9	0	0	0	0	0	115.9	F539 L568 T569	F539-G541 VanDerWaalsContact C-N 3.34Å; F539-G541 PolarHBondContact O-N 2.81Å; G541-L568 WeakPolarHBondContact O-CA 3.32Å; G541-T569 VanDerWaalsContact C-OG1 3.23Å; G541-T569 PolarHBondContact O-N 2.88Å; G541-T569 PolarHBondContact O-OG1 2.85Å
542	V	84.5	Confident	80.8	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	136.6	-168.7	-171.4	0	0	0	0	112.3	I475 N478 F539 V544 F566 Y567 L568 T569	I475-V542 HydrophobicContact CG2-CG1 4.44Å; N478-V542 HydrophobicContact CB-CG2 3.82Å; F539-V542 WeakPolarHBondContact CA-O 3.25Å; F539-V542 WeakPolarHBondContact CB-O 3.26Å; F539-V542 PolarHBondContact N-O 3.24Å; V542-V544 HydrophobicContact CG1-CG2 3.82Å; V542-F566 HydrophobicContact CG1-CB 4.03Å; V542-F566 HydrophobicContact CG1-CD2 3.97Å; V542-F566 HydrophobicContact CG1-CG 4.38Å; V542-Y567 WeakPolarHBondContact CA-O 3.41Å; V542-L568 HydrophobicContact CG2-CD2 4.11Å; V542-T569 PolarHBondContact N-OG1 3.4Å
543	I	88.7	Confident	79	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	125.9	164	-172.4	172.6	0	0	0	110.1	V536 L538 F545 F566 Y567 I572 I609 L635	V536-I543 HydrophobicContact CG1-CD1 3.77Å; V536-I543 HydrophobicContact CG1-CG1 3.55Å; L538-I543 HydrophobicContact CD1-CB 3.93Å; L538-I543 HydrophobicContact CD1-CD1 4.39Å; L538-I543 HydrophobicContact CD1-CG1 4.18Å; I543-F545 HydrophobicContact CB-CE2 4.48Å; I543-F545 HydrophobicContact CD1-CE2 4.01Å; I543-F545 HydrophobicContact CD1-CZ 3.69Å; I543-F545 HydrophobicContact CG1-CE2 3.89Å; I543-F545 HydrophobicContact CG1-CZ 4.04Å; I543-F545 HydrophobicContact CG2-CE2 3.96Å; I543-F566 CarbonylContact O-C 3.51Å; I543-F566 WeakPolarHBondContact O-CA 3.25Å; I543-F566 WeakPolarHBondContact O-CB 3.37Å; I543-Y567 HydrophobicContact CG2-CD2 4.12Å; I543-Y567 HydrophobicContact CG2-CG 4.41Å; I543-Y567 WeakPolarHBondContact CG2-O 3.27Å; I543-Y567 PolarHBondContact N-O 3.37Å; I543-Y567 PolarHBondContact O-N 3.09Å; I543-I572 HydrophobicContact CG2-CD1 4.25Å; I543-I609 HydrophobicContact CD1-CD1 3.94Å; I543-L635 HydrophobicContact CD1-CD2 4.14Å
544	V	89.7	Confident	76.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	122.4	-172.5	-175.8	0	0	0	0	110	W470 I475 V536 F537 F539 V542 L563 F566	W470-V544 HydrophobicContact CZ3-CG1 4.32Å; I475-V544 HydrophobicContact CD1-CG2 4.38Å; I475-V544 HydrophobicContact CG2-CG2 4.07Å; V536-V544 VanDerWaalsContact CA-O 3.31Å; V536-V544 WeakPolarHBondContact CA-O 3.43Å; F537-V544 HydrophobicContact CB-CB 4.28Å; F537-V544 PolarHBondContact N-O 3.02Å; F537-V544 PolarHBondContact O-N 3.33Å; F539-V544 HydrophobicContact CD2-CG2 4.33Å; F539-V544 HydrophobicContact CE2-CG2 4.38Å; V542-V544 HydrophobicContact CG1-CG2 3.82Å; V544-L563 HydrophobicContact CG1-CD1 3.36Å; V544-F566 HydrophobicContact CG2-CB 4.49Å
545	F	90.6	Very high	74.6	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	116	178.1	-63.9	-94.6	0	0	0	111.1	R534 V536 I543 K564 E565 Y567 I609 L620	R534-F545 HydrophobicContact CB-CD1 4.19Å; R534-F545 HydrophobicContact CG-CB 4.47Å; R534-F545 HydrophobicContact CG-CD1 4.31Å; V536-F545 HydrophobicContact CG1-CD1 4.39Å; V536-F545 HydrophobicContact CG1-CE1 4.22Å; V536-F545 HydrophobicContact CG2-CD1 3.5Å; V536-F545 VanDerWaalsContact CG2-CD1 3.5Å; V536-F545 HydrophobicContact CG2-CE1 3.71Å; V536-F545 HydrophobicContact CG2-CG 4.38Å; I543-F545 HydrophobicContact CB-CE2 4.48Å; I543-F545 HydrophobicContact CD1-CE2 4.01Å; I543-F545 HydrophobicContact CD1-CZ 3.69Å; I543-F545 HydrophobicContact CG1-CE2 3.89Å; I543-F545 HydrophobicContact CG1-CZ 4.04Å; I543-F545 HydrophobicContact CG2-CE2 3.96Å; F545-K564 WeakPolarHBondContact O-CB 3.45Å; F545-K564 PolarHBondContact O-N 3.44Å; F545-E565 HydrophobicContact CB-CG 3.71Å; F545-E565 WeakPolarHBondContact CB-O 3.35Å; F545-E565 HydrophobicContact CD2-CG 3.87Å; F545-E565 HydrophobicContact CG-CG 3.99Å; F545-E565 PolarHBondContact N-O 3.07Å; F545-Y567 HydrophobicContact CD2-CD2 4.32Å; F545-Y567 HydrophobicContact CD2-CE2 4.23Å; F545-Y567 AromaticContact CE2-CD2 3.56Å; F545-Y567 HydrophobicContact CE2-CD2 3.56Å; F545-Y567 AromaticContact CE2-CE2 3.63Å; F545-Y567 HydrophobicContact CE2-CE2 3.63Å; F545-Y567 HydrophobicContact CZ-CD2 4.37Å; F545-Y567 HydrophobicContact CZ-CE2 4.29Å; F545-I609 HydrophobicContact CZ-CD1 4.24Å; F545-L620 HydrophobicContact CE1-CD1 3.84Å; F545-L620 HydrophobicContact CE1-CD2 3.81Å; F545-L620 HydrophobicContact CE1-CG 4.5Å; F545-L620 HydrophobicContact CZ-CD1 3.96Å
546	C	90.2	Very high	72.9	Confident	0 Å²	0	61 Å²	61	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	142.6	-179.4	-72.3	0	0	0	0	111.5	R534 F535 F537 Y561 R562	R534-C546 CarbonylContact C-O 3.37Å; R534-C546 VanDerWaalsContact CA-O 3.24Å; R534-C546 WeakPolarHBondContact CA-O 3.43Å; R534-C546 WeakPolarHBondContact CD-O 3.34Å; F535-C546 PolarHBondContact N-O 3.22Å; F535-C546 WeakPolarHBondContact O-CA 3.49Å; F535-C546 WeakPolarHBondContact O-CB 3.47Å; F535-C546 PolarHBondContact O-N 3.36Å; F537-C546 HydrophobicContact CE2-CB 4.18Å; C546-Y561 HydrophobicContact CB-CD1 4.09Å; C546-Y561 HydrophobicContact CB-CG 4.26Å; C546-R562 WeakPolarHBondContact CA-O 3.44Å
547	K	87.8	Confident	71	Confident	102 Å²	102	67.8 Å²	67.8	44%	0.443	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	128.4	166.5	-173.3	-179.4	176.6	-175.5	0	108.6	S549 R562 K564	K547-S549 PolarHBondContact O-N 2.97Å; K547-R562 PolarHBondContact N-O 3.46Å; K547-R562 PolarHBondContact O-N 3.13Å; K547-K564 HydrophobicContact CB-CG 3.93Å
548	P	81.7	Confident	69.4	Low	52 Å²	52	70.7 Å²	70.7	34%	0.338	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	131.6	171.7	-18.8	29.8	0	0	0	110.5
549	S	70.6	Confident	68.3	Low	64 Å²	64	72.6 Å²	72.6	45%	0.448	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-78.4	126.2	176.3	-166.5	0	0	0	0	109.9	K547 S551 E560	K547-S549 PolarHBondContact O-N 2.97Å; S549-S551 PolarHBondContact O-N 3.33Å; S549-S551 VanDerWaalsContact O-N 3.16Å; S549-E560 WeakPolarHBondContact CB-O 3.45Å; S549-E560 PolarHBondContact N-O 2.77Å
550	P	61.4	Low	68.1	Low	105 Å²	105	78.5 Å²	78.5	68%	0.682	45%	0.452	S	S	*	.			trans	-67.7	115.2	175.3	26.6	-31	0	0	0	109.4	R552	P550-R552 PolarHBondContact O-N 3.08Å
551	S	53	Low	68.5	Low	123 Å²	123	79.3 Å²	79.3	86%	0.86	45%	0.453	S	S	*	.			trans	-56.3	97.2	178.7	-173.1	0	0	0	0	111.9	S549	S549-S551 PolarHBondContact O-N 3.33Å; S549-S551 VanDerWaalsContact O-N 3.16Å
552	R	48.2	Very low	69.1	Low	227 Å²	227	85 Å²	85	86%	0.857	47%	0.47	S	S	*	.			trans	-148.8	105.8	168.6	-73.3	-165	-178.9	-164.2	-0.4	113.2	P550	P550-R552 PolarHBondContact O-N 3.08Å
553	R	45.2	Very low	69.2	Low	251 Å²	251	86.4 Å²	86.4	95%	0.947	48%	0.477	S	S	*	.			trans	60.8	43.9	142.7	-56.7	-174.4	-174.6	175.5	0.5	121.1
554	S	43.2	Very low	69.2	Low	107 Å²	107	91 Å²	91	75%	0.748	50%	0.497	S	S	*	.			trans	-117	129.3	165.4	178.9	0	0	0	0	111.4	G556	S554-G556 PolarHBondContact O-N 3.31Å
555	V	40.3	Very low	69.1	Low	163 Å²	163	93.2 Å²	93.2	99%	0.988	51%	0.507	S	S	*	.	S	Bend	trans	-81.4	64.1	-179.4	-174.5	0	0	0	0	110.1
556	G	55.4	Low	69	Low	41 Å²	41	96.1 Å²	96.1	42%	0.423	52%	0.52	S	S	.	.	S	Bend	trans	-150.9	166.3	172.4	0	0	0	0	0	109.9	S554 G558	S554-G556 PolarHBondContact O-N 3.31Å; G556-G558 VanDerWaalsContact C-N 3.26Å; G556-G558 PolarHBondContact O-N 3.2Å
557	P	51.6	Low	68.8	Low	144 Å²	144	97.3 Å²	97.3	94%	0.935	52%	0.524	S	S	*	.			trans	-64	94.3	173.8	20.5	-17.1	0	0	0	107.5	S559	P557-S559 PolarHBondContact O-N 3.43Å
558	G	56	Low	68.4	Low	63 Å²	63	94 Å²	94	65%	0.649	51%	0.511	S	S	*	.			trans	-75.7	124	-172	0	0	0	0	0	110.3	G556 E560	G556-G558 VanDerWaalsContact C-N 3.26Å; G556-G558 PolarHBondContact O-N 3.2Å; G558-E560 PolarHBondContact O-N 3.37Å
559	S	64.3	Low	68.3	Low	39 Å²	39	91.7 Å²	91.7	27%	0.273	50%	0.496	S	S	.	.			trans	-57.3	123.6	169.1	54.7	0	0	0	0	110.6	S466 P557 Y561	S466-S559 CarbonylContact O-C 3.35Å; S466-S559 WeakPolarHBondContact O-CA 3.5Å; S466-S559 WeakPolarHBondContact O-CB 3.14Å; P557-S559 PolarHBondContact O-N 3.43Å; S559-Y561 VanDerWaalsContact C-N 3.27Å; S559-Y561 PolarHBondContact O-N 2.74Å
560	E	78.2	Confident	68.5	Low	125 Å²	125	89.6 Å²	89.6	58%	0.584	48%	0.479	S	S	*	.	S	Bend	trans	-67.7	-29.7	177.6	-64.3	-174.3	172.2	0	0	112.2	S466 S549 G558	S466-E560 PolarHBondContact O-N 2.92Å; S549-E560 WeakPolarHBondContact CB-O 3.45Å; S549-E560 PolarHBondContact N-O 2.77Å; G558-E560 PolarHBondContact O-N 3.37Å
561	Y	84.5	Confident	69.2	Low	41 Å²	41	87.1 Å²	87.1	16%	0.161	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	155.7	-173.6	-62.7	-74	0	0	0	111.2	S466 V467 D468 F535 F537 C546 S559	S466-Y561 PolarHBondContact O-N 3.02Å; V467-Y561 CarbonylContact C-O 3.57Å; V467-Y561 WeakPolarHBondContact CA-O 3.32Å; D468-Y561 PolarHBondContact N-O 2.84Å; F535-Y561 HydrophobicContact CB-CD1 4.02Å; F535-Y561 HydrophobicContact CB-CE1 3.64Å; F535-Y561 HydrophobicContact CD1-CE1 4.04Å; F535-Y561 HydrophobicContact CD2-CE1 4.14Å; F535-Y561 HydrophobicContact CG-CD1 4.45Å; F535-Y561 AromaticContact CG-CE1 3.67Å; F535-Y561 HydrophobicContact CG-CE1 3.67Å; F537-Y561 HydrophobicContact CZ-CD2 4.26Å; F537-Y561 HydrophobicContact CZ-CE2 4.13Å; C546-Y561 HydrophobicContact CB-CD1 4.09Å; C546-Y561 HydrophobicContact CB-CG 4.26Å; S559-Y561 VanDerWaalsContact C-N 3.27Å; S559-Y561 PolarHBondContact O-N 2.74Å
562	R	86.1	Confident	70.5	Confident	139 Å²	139	81.4 Å²	81.4	53%	0.525	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	124.4	168.6	-178.5	171.8	175.5	173.7	4.8	110	D468 C546 K547 K564	D468-R562 HydrophobicContact CB-CB 4.38Å; D468-R562 HydrophobicContact CB-CG 4.34Å; C546-R562 WeakPolarHBondContact CA-O 3.44Å; K547-R562 PolarHBondContact N-O 3.46Å; K547-R562 PolarHBondContact O-N 3.13Å; R562-K564 PolarHBondContact O-N 2.96Å
563	L	87.7	Confident	72	Confident	28 Å²	28	71.6 Å²	71.6	15%	0.147	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	132.6	176.7	-174.7	62.2	0	0	0	109.8	V467 D468 G469 I475 V544	V467-L563 HydrophobicContact CG1-CB 3.76Å; D468-L563 WeakPolarHBondContact O-CB 3.44Å; D468-L563 PolarHBondContact O-N 2.99Å; G469-L563 VanDerWaalsContact O-CD2 3.24Å; G469-L563 WeakPolarHBondContact O-CD2 3.34Å; I475-L563 HydrophobicContact CD1-CD2 4.04Å; V544-L563 HydrophobicContact CG1-CD1 3.36Å
564	K	88.1	Confident	73.8	Confident	98 Å²	98	59.8 Å²	59.8	43%	0.426	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	-48.5	175.7	-74.9	-67.8	176.4	-167.8	0	112.4	F545 K547 R562	F545-K564 WeakPolarHBondContact O-CB 3.45Å; F545-K564 PolarHBondContact O-N 3.44Å; K547-K564 HydrophobicContact CB-CG 3.93Å; R562-K564 PolarHBondContact O-N 2.96Å
565	E	87.3	Confident	75.5	Confident	45 Å²	45	56.5 Å²	56.5	21%	0.21	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	158	-177	57.7	-160	151.1	0	0	108.1	K490 F545 Y567	K490-E565 VanDerWaalsContact CD-OE1 3.27Å; K490-E565 WeakPolarHBondContact CD-OE1 3.44Å; K490-E565 WeakPolarHBondContact CE-OE1 3.41Å; K490-E565 IonicContact NZ-OE1 2.7Å; K490-E565 PolarHBondContact NZ-OE1 3.38Å; K490-E565 IonicContact NZ-OE2 3.3Å; K490-E565 PolarHBondContact NZ-OE2 3.45Å; F545-E565 HydrophobicContact CB-CG 3.71Å; F545-E565 WeakPolarHBondContact CB-O 3.35Å; F545-E565 HydrophobicContact CD2-CG 3.87Å; F545-E565 HydrophobicContact CG-CG 3.99Å; F545-E565 PolarHBondContact N-O 3.07Å; E565-Y567 PolarHBondContact OE2-OH 2.78Å
566	F	87.7	Confident	77.4	Confident	61 Å²	61	50.6 Å²	50.6	27%	0.268	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	154.7	170.2	68.5	-89.6	0	0	0	108.4	N474 I475 V542 I543 V544	N474-F566 HydrophobicContact CB-CE2 3.9Å; N474-F566 HydrophobicContact CB-CZ 3.64Å; I475-F566 HydrophobicContact CD1-CD1 4.38Å; I475-F566 HydrophobicContact CG1-CD1 4.49Å; I475-F566 HydrophobicContact CG1-CG 4.39Å; V542-F566 HydrophobicContact CG1-CB 4.03Å; V542-F566 HydrophobicContact CG1-CD2 3.97Å; V542-F566 HydrophobicContact CG1-CG 4.38Å; I543-F566 CarbonylContact O-C 3.51Å; I543-F566 WeakPolarHBondContact O-CA 3.25Å; I543-F566 WeakPolarHBondContact O-CB 3.37Å; V544-F566 HydrophobicContact CG2-CB 4.49Å
567	Y	85.9	Confident	78.2	Confident	25 Å²	25	49.9 Å²	49.9	10%	0.098	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	142.8	172.6	-52.8	-56.2	0	0	0	109.7	V542 I543 F545 E565 I572 I609 T618	V542-Y567 WeakPolarHBondContact CA-O 3.41Å; I543-Y567 HydrophobicContact CG2-CD2 4.12Å; I543-Y567 HydrophobicContact CG2-CG 4.41Å; I543-Y567 WeakPolarHBondContact CG2-O 3.27Å; I543-Y567 PolarHBondContact N-O 3.37Å; I543-Y567 PolarHBondContact O-N 3.09Å; F545-Y567 HydrophobicContact CD2-CD2 4.32Å; F545-Y567 HydrophobicContact CD2-CE2 4.23Å; F545-Y567 AromaticContact CE2-CD2 3.56Å; F545-Y567 HydrophobicContact CE2-CD2 3.56Å; F545-Y567 AromaticContact CE2-CE2 3.63Å; F545-Y567 HydrophobicContact CE2-CE2 3.63Å; F545-Y567 HydrophobicContact CZ-CD2 4.37Å; F545-Y567 HydrophobicContact CZ-CE2 4.29Å; E565-Y567 PolarHBondContact OE2-OH 2.78Å; Y567-I572 HydrophobicContact CD2-CG2 4.49Å; Y567-I572 HydrophobicContact CG-CG2 4.16Å; Y567-I609 HydrophobicContact CD2-CG2 4.39Å; Y567-T618 PolarHBondContact OH-OG1 3.32Å
568	L	81	Confident	78.8	Confident	33 Å²	33	47.3 Å²	47.3	17%	0.173	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	128.3	169.1	-66.1	169.4	0	0	0	108.3	G541 V542 R570 K571	G541-L568 WeakPolarHBondContact O-CA 3.32Å; V542-L568 HydrophobicContact CG2-CD2 4.11Å; L568-R570 HydrophobicContact CB-CG 4.19Å; L568-R570 PolarHBondContact O-N 3.04Å; L568-R570 VanDerWaalsContact O-N 3.14Å; L568-K571 HydrophobicContact CB-CB 4.48Å; L568-K571 HydrophobicContact CB-CG 4.28Å; L568-K571 HydrophobicContact CD1-CD 4.33Å; L568-K571 PolarHBondContact O-N 2.87Å
569	T	79.3	Confident	79.1	Confident	3 Å²	3	48 Å²	48	2%	0.018	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-58	-32.5	-175.4	-49.6	0	0	0	0	112.3	D540 G541 V542 K571 I572 L638	D540-T569 PolarHBondContact O-OG1 3.1Å; G541-T569 VanDerWaalsContact C-OG1 3.23Å; G541-T569 PolarHBondContact O-N 2.88Å; G541-T569 PolarHBondContact O-OG1 2.85Å; V542-T569 PolarHBondContact N-OG1 3.4Å; T569-K571 VanDerWaalsContact C-N 3.31Å; T569-K571 PolarHBondContact O-N 3.44Å; T569-I572 WeakPolarHBondContact O-CG1 3.17Å; T569-I572 PolarHBondContact O-N 3.32Å; T569-L638 HydrophobicContact CG2-CB 3.61Å; T569-L638 HydrophobicContact CG2-CD1 3.78Å; T569-L638 HydrophobicContact CG2-CG 4.31Å
570	R	74.6	Confident	78.7	Confident	21 Å²	21	49.8 Å²	49.8	8%	0.079	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-65	-27.4	175.7	70.5	-173	176.3	172	5.2	114.9	N195 D204 L568	N195-R570 HydrophobicContact CB-CB 4Å; N195-R570 WeakPolarHBondContact OD1-CB 3.26Å; D204-R570 IonicContact OD1-NH2 3.54Å; L568-R570 HydrophobicContact CB-CG 4.19Å; L568-R570 PolarHBondContact O-N 3.04Å; L568-R570 VanDerWaalsContact O-N 3.14Å
571	K	76.5	Confident	77.6	Confident	53 Å²	53	48 Å²	48	23%	0.23	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-93.9	-0.3	-175.3	-65.1	-161.3	177	-168.6	0	113.4	D204 L568 T569 Q611 R612	D204-K571 WeakPolarHBondContact OD1-CE 3.44Å; D204-K571 IonicContact OD1-NZ 3.65Å; D204-K571 PolarHBondContact OD1-NZ 2.86Å; D204-K571 IonicContact OD2-NZ 3.16Å; D204-K571 PolarHBondContact OD2-NZ 3.4Å; L568-K571 HydrophobicContact CB-CB 4.48Å; L568-K571 HydrophobicContact CB-CG 4.28Å; L568-K571 HydrophobicContact CD1-CD 4.33Å; L568-K571 PolarHBondContact O-N 2.87Å; T569-K571 VanDerWaalsContact C-N 3.31Å; T569-K571 PolarHBondContact O-N 3.44Å; K571-Q611 WeakPolarHBondContact O-CA 3.28Å; K571-R612 PolarHBondContact O-N 3.07Å
572	I	79.2	Confident	76.1	Confident	3 Å²	3	46.1 Å²	46.1	2%	0.015	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	150.5	-178.9	61.3	167.2	0	0	0	111.5	I543 Y567 T569 I609 R610	I543-I572 HydrophobicContact CG2-CD1 4.25Å; Y567-I572 HydrophobicContact CD2-CG2 4.49Å; Y567-I572 HydrophobicContact CG-CG2 4.16Å; T569-I572 WeakPolarHBondContact O-CG1 3.17Å; T569-I572 PolarHBondContact O-N 3.32Å; I572-I609 HydrophobicContact CB-CG2 3.63Å; I572-I609 HydrophobicContact CD1-CG2 3.88Å; I572-I609 HydrophobicContact CG1-CG2 4.34Å; I572-I609 HydrophobicContact CG2-CG2 3.58Å; I572-R610 CarbonylContact C-O 3.59Å; I572-R610 VanDerWaalsContact CA-O 3.32Å; I572-R610 WeakPolarHBondContact CA-O 3.42Å
573	E	79.5	Confident	74.5	Confident	20 Å²	20	40.6 Å²	40.6	9%	0.093	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	129.8	170	-177.4	-178.2	-166.9	0	0	108.2	L575 R610	E573-L575 HydrophobicContact CG-CD2 4.35Å; E573-R610 PolarHBondContact N-O 2.94Å; E573-R610 PolarHBondContact O-N 3.46Å; E573-R610 IonicContact OE2-CZ 3.91Å; E573-R610 VanDerWaalsContact OE2-CZ 3.3Å; E573-R610 IonicContact OE2-NE 2.9Å; E573-R610 PolarHBondContact OE2-NE 2.97Å; E573-R610 VanDerWaalsContact OE2-NE 3.16Å; E573-R610 IonicContact OE2-NH2 3.94Å; E573-R610 PolarHBondContact OE2-NH2 3.02Å
574	V	83	Confident	72.8	Confident	3 Å²	3	44.6 Å²	44.6	2%	0.018	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	123.4	178.1	-172.3	0	0	0	0	109.5	E608 M632 L635 Q639	V574-E608 WeakPolarHBondContact CA-O 3.18Å; V574-M632 HydrophobicContact CG1-CE 3.73Å; V574-M632 HydrophobicContact CG1-SD 3.51Å; V574-M632 VanDerWaalsContact CG1-SD 3.51Å; V574-L635 HydrophobicContact CG2-CB 3.67Å; V574-L635 HydrophobicContact CG2-CD1 4.11Å; V574-L635 HydrophobicContact CG2-CG 4.44Å; V574-Q639 VanDerWaalsContact N-OE1 3.08Å
575	L	79.8	Confident	71.2	Confident	39 Å²	39	41.3 Å²	41.3	20%	0.204	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	128.6	176.8	-61.6	168.2	0	0	0	109	E573 E608 R610	E573-L575 HydrophobicContact CG-CD2 4.35Å; L575-E608 HydrophobicContact CB-CB 4.22Å; L575-E608 PolarHBondContact N-O 3.3Å; L575-E608 PolarHBondContact O-N 2.96Å; L575-R610 HydrophobicContact CD1-CB 4.35Å
576	E	79.4	Confident	69.7	Low	38 Å²	38	39.3 Å²	39.3	18%	0.178	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	138.8	169.2	-172.4	170.6	-156.7	0	0	109.7	L373 K376 H377 K628 M632	L373-E576 HydrophobicContact CD2-CB 3.67Å; L373-E576 WeakPolarHBondContact CD2-OE2 3.27Å; K376-E576 WeakPolarHBondContact CD-OE2 3.49Å; K376-E576 WeakPolarHBondContact CE-OE2 3.38Å; K376-E576 IonicContact NZ-OE1 2.93Å; K376-E576 PolarHBondContact NZ-OE1 2.96Å; K376-E576 IonicContact NZ-OE2 3.88Å; K376-E576 PolarHBondContact NZ-OE2 3.26Å; H377-E576 IonicContact CD2-OE2 2.72Å; H377-E576 IonicContact CE1-OE1 3.69Å; H377-E576 PolarHBondContact CE1-OE1 3.15Å; H377-E576 IonicContact CE1-OE2 3.18Å; H377-E576 IonicContact NE2-OE1 2.65Å; H377-E576 PolarHBondContact NE2-OE1 3.42Å; H377-E576 IonicContact NE2-OE2 3.29Å; H377-E576 PolarHBondContact NE2-OE2 3.32Å; E576-K628 WeakPolarHBondContact OE1-CE 3.3Å; E576-K628 IonicContact OE1-NZ 2.77Å; E576-K628 PolarHBondContact OE1-NZ 2.91Å; E576-K628 VanDerWaalsContact OE1-NZ 3.16Å; E576-M632 HydrophobicContact CB-CE 3.81Å; E576-M632 HydrophobicContact CG-CE 4.44Å
577	H	71.8	Confident	68.2	Low	27 Å²	27	37.3 Å²	37.3	13%	0.125	20%	0.2	C	C	.	.			trans	-117.8	136.1	167.2	-67.5	-80.3	0	0	0	109	L585 E608 K628	H577-L585 VanDerWaalsContact CE1-CD2 3.48Å; H577-L585 WeakPolarHBondContact CE1-CD2 3.39Å; H577-L585 VanDerWaalsContact NE2-CD2 3.28Å; H577-L585 WeakPolarHBondContact NE2-CD2 3.39Å; H577-E608 IonicContact CD2-OE2 2.65Å; H577-E608 IonicContact CE1-OE2 3.73Å; H577-E608 IonicContact NE2-OE2 3.78Å; H577-E608 PolarHBondContact NE2-OE2 3.18Å; H577-K628 PolarHBondContact O-NZ 3.34Å; H577-K628 VanDerWaalsContact O-NZ 3.13Å
578	D	66.2	Low	66.8	Low	90 Å²	90	46.8 Å²	46.8	48%	0.481	24%	0.236	S	C	.	.			trans	-70.5	151.2	167.4	-73.9	-25.3	0	0	0	109.4	A580 D581 G582	D578-A580 PolarHBondContact O-N 3.18Å; D578-D581 HydrophobicContact CB-CB 4.44Å; D578-D581 PolarHBondContact O-N 2.94Å; D578-G582 PolarHBondContact O-N 3.49Å
579	D	61.7	Low	65.6	Low	76 Å²	76	48.7 Å²	48.7	41%	0.406	25%	0.245	S	C	.	.	H	α-helix	trans	-57.9	-27	-175.3	-71.2	-26.9	0	0	0	112.1	Y605	D579-Y605 PolarHBondContact OD1-N 3.09Å; D579-Y605 VanDerWaalsContact OD1-N 3.1Å
580	A	55.4	Low	64.5	Low	77 Å²	77	49.6 Å²	49.6	64%	0.636	25%	0.251	S	S	*	.	H	α-helix	trans	-75.2	-42.9	173.2	0	0	0	0	0	112.9	D578 T583	D578-A580 PolarHBondContact O-N 3.18Å; A580-T583 WeakPolarHBondContact O-CB 3.4Å; A580-T583 PolarHBondContact O-N 2.97Å
581	D	55.2	Low	63.4	Low	88 Å²	88	51.9 Å²	51.9	47%	0.471	28%	0.282	S	S	.	.	H	α-helix	trans	-75.4	-28.9	-178	-74.9	-21.2	0	0	0	112.9	D578 T583 M584 L585	D578-D581 HydrophobicContact CB-CB 4.44Å; D578-D581 PolarHBondContact O-N 2.94Å; D581-T583 PolarHBondContact O-N 2.93Å; D581-M584 CarbonylContact O-C 3.53Å; D581-M584 WeakPolarHBondContact O-CA 3.34Å; D581-M584 WeakPolarHBondContact O-CB 3.47Å; D581-M584 PolarHBondContact O-N 2.75Å; D581-L585 PolarHBondContact O-N 3.22Å
582	G	53.6	Low	62.3	Low	1 Å²	1	53.3 Å²	53.3	1%	0.01	29%	0.286	C	S	.	.	H	α-helix	trans	-53.2	-38.2	171.8	0	0	0	0	0	111.3	D578 M584 L585 L586	D578-G582 PolarHBondContact O-N 3.49Å; G582-M584 PolarHBondContact O-N 2.77Å; G582-L585 PolarHBondContact O-N 2.76Å; G582-L586 WeakPolarHBondContact O-CB 3.36Å; G582-L586 WeakPolarHBondContact O-CD1 3.41Å; G582-L586 WeakPolarHBondContact O-CG 3.42Å; G582-L586 PolarHBondContact O-N 3.07Å
583	T	51.6	Low	60.9	Low	24 Å²	24	57.8 Å²	57.8	15%	0.147	32%	0.318	C	S	.	.	H	α-helix	trans	-63.8	-41.1	176	-50.9	0	0	0	0	111.9	A580 D581 L587 L597 V600	A580-T583 WeakPolarHBondContact O-CB 3.4Å; A580-T583 PolarHBondContact O-N 2.97Å; D581-T583 PolarHBondContact O-N 2.93Å; T583-L587 WeakPolarHBondContact O-CG 3.32Å; T583-L587 PolarHBondContact O-N 3.46Å; T583-L597 HydrophobicContact CG2-CD2 4.21Å; T583-L597 HydrophobicContact CG2-CG 4.34Å; T583-V600 HydrophobicContact CG2-CB 4.12Å; T583-V600 HydrophobicContact CG2-CG1 3.87Å
584	M	53.3	Low	59.5	Low	112 Å²	112	62.9 Å²	62.9	55%	0.552	35%	0.345	S	S	*	.	H	α-helix	trans	-72	-37.7	177.3	-85.5	-63.8	-63.1	0	0	113.2	D581 G582 L586 L587 R588	D581-M584 CarbonylContact O-C 3.53Å; D581-M584 WeakPolarHBondContact O-CA 3.34Å; D581-M584 WeakPolarHBondContact O-CB 3.47Å; D581-M584 PolarHBondContact O-N 2.75Å; G582-M584 PolarHBondContact O-N 2.77Å; M584-L586 VanDerWaalsContact C-N 3.35Å; M584-L587 WeakPolarHBondContact O-CB 3.46Å; M584-L587 PolarHBondContact O-N 2.8Å; M584-L587 HydrophobicContact SD-CD1 3.85Å; M584-R588 PolarHBondContact O-N 2.82Å
585	L	54.4	Low	58	Low	28 Å²	28	71.8 Å²	71.8	15%	0.147	38%	0.384	C	S	.	.	H	α-helix	trans	-64.1	-42.7	174.3	-172.5	81.2	0	0	0	111	H577 D581 G582 L587 R588 I589 E608 V619	H577-L585 VanDerWaalsContact CE1-CD2 3.48Å; H577-L585 WeakPolarHBondContact CE1-CD2 3.39Å; H577-L585 VanDerWaalsContact NE2-CD2 3.28Å; H577-L585 WeakPolarHBondContact NE2-CD2 3.39Å; D581-L585 PolarHBondContact O-N 3.22Å; G582-L585 PolarHBondContact O-N 2.76Å; L585-L587 PolarHBondContact O-N 3.49Å; L585-R588 PolarHBondContact O-N 2.97Å; L585-I589 HydrophobicContact CD1-CD1 4.27Å; L585-I589 HydrophobicContact CD2-CD1 3.8Å; L585-I589 HydrophobicContact CG-CD1 3.69Å; L585-I589 HydrophobicContact CG-CG1 4.24Å; L585-I589 WeakPolarHBondContact O-CG1 3.47Å; L585-I589 PolarHBondContact O-N 2.88Å; L585-E608 WeakPolarHBondContact CD2-OE2 3.47Å; L585-V619 HydrophobicContact CD2-CG2 4.27Å
586	L	55.5	Low	56.6	Low	4 Å²	4	71.5 Å²	71.5	2%	0.021	38%	0.382	C	S	.	.	H	α-helix	trans	-62.6	-33.3	176.6	-64.1	164.7	0	0	0	110.7	F493 G582 M584 S590 V600 L603 M606	F493-L586 HydrophobicContact CE1-CB 4.41Å; F493-L586 HydrophobicContact CE1-CD2 4.04Å; F493-L586 HydrophobicContact CE2-CD2 3.85Å; F493-L586 HydrophobicContact CZ-CB 3.88Å; F493-L586 HydrophobicContact CZ-CD2 3.16Å; F493-L586 HydrophobicContact CZ-CG 4.04Å; G582-L586 WeakPolarHBondContact O-CB 3.36Å; G582-L586 WeakPolarHBondContact O-CD1 3.41Å; G582-L586 WeakPolarHBondContact O-CG 3.42Å; G582-L586 PolarHBondContact O-N 3.07Å; M584-L586 VanDerWaalsContact C-N 3.35Å; L586-S590 WeakPolarHBondContact O-CB 3.44Å; L586-S590 PolarHBondContact O-N 3.38Å; L586-S590 VanDerWaalsContact O-N 3.12Å; L586-S590 PolarHBondContact O-OG 3.3Å; L586-V600 HydrophobicContact CB-CG1 4.32Å; L586-V600 HydrophobicContact CD1-CG1 3.22Å; L586-V600 HydrophobicContact CG-CG1 4.4Å; L586-L603 HydrophobicContact CD1-CD1 3.56Å; L586-M606 HydrophobicContact CD1-CE 3.72Å; L586-M606 HydrophobicContact CD1-SD 4.27Å; L586-M606 HydrophobicContact CD2-CE 3.77Å; L586-M606 HydrophobicContact CG-CE 3.88Å
587	L	54.9	Low	55.1	Low	18 Å²	18	73.5 Å²	73.5	9%	0.094	39%	0.394	C	S	.	.	H	α-helix	trans	-65.8	-41.6	169.9	-70.6	166.1	0	0	0	112	T583 M584 L585 G591 I596 L597	T583-L587 WeakPolarHBondContact O-CG 3.32Å; T583-L587 PolarHBondContact O-N 3.46Å; M584-L587 WeakPolarHBondContact O-CB 3.46Å; M584-L587 PolarHBondContact O-N 2.8Å; M584-L587 HydrophobicContact SD-CD1 3.85Å; L585-L587 PolarHBondContact O-N 3.49Å; L587-G591 PolarHBondContact O-N 2.93Å; L587-G591 VanDerWaalsContact O-N 3.14Å; L587-I596 HydrophobicContact CD2-CB 4.26Å; L587-L597 HydrophobicContact CD1-CD1 3.82Å; L587-L597 HydrophobicContact CD1-CG 4.17Å
588	R	56.5	Low	54	Low	224 Å²	224	81.4 Å²	81.4	85%	0.845	43%	0.428	S	S	*	.	H	α-helix	trans	-69.4	-39.5	-178.9	-142	177.3	-168	174.8	3.4	113.3	M584 L585	M584-R588 PolarHBondContact O-N 2.82Å; L585-R588 PolarHBondContact O-N 2.97Å
589	I	57.6	Low	53.1	Low	74 Å²	74	81.5 Å²	81.5	38%	0.379	43%	0.428	S	S	.	.	H	α-helix	trans	-76.5	-33	179.2	-63.7	172.7	0	0	0	111.3	F493 L585 V619	F493-I589 HydrophobicContact CD2-CG2 4.11Å; F493-I589 HydrophobicContact CE2-CB 4.32Å; F493-I589 HydrophobicContact CE2-CG2 3.89Å; L585-I589 HydrophobicContact CD1-CD1 4.27Å; L585-I589 HydrophobicContact CD2-CD1 3.8Å; L585-I589 HydrophobicContact CG-CD1 3.69Å; L585-I589 HydrophobicContact CG-CG1 4.24Å; L585-I589 WeakPolarHBondContact O-CG1 3.47Å; L585-I589 PolarHBondContact O-N 2.88Å; I589-V619 HydrophobicContact CD1-CG2 4.12Å
590	S	55.1	Low	52.7	Low	21 Å²	21	78.2 Å²	78.2	15%	0.147	41%	0.411	C	S	.	.	H	α-helix	trans	-88	-15.3	-175.7	71.3	0	0	0	0	114.4	L586 Y592	L586-S590 WeakPolarHBondContact O-CB 3.44Å; L586-S590 PolarHBondContact O-N 3.38Å; L586-S590 VanDerWaalsContact O-N 3.12Å; L586-S590 PolarHBondContact O-OG 3.3Å; S590-Y592 VanDerWaalsContact CB-CD2 3.43Å; S590-Y592 WeakPolarHBondContact O-CD2 3.45Å; S590-Y592 WeakPolarHBondContact O-CE2 3.19Å; S590-Y592 PolarHBondContact O-N 2.95Å; S590-Y592 WeakPolarHBondContact OG-CD2 3.3Å
591	G	52.6	Low	52.6	Low	70 Å²	70	78.2 Å²	78.2	72%	0.722	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	17.1	178	0	0	0	0	0	114.1	L587	L587-G591 PolarHBondContact O-N 2.93Å; L587-G591 VanDerWaalsContact O-N 3.14Å
592	Y	52.8	Low	52.8	Low	82 Å²	82	81 Å²	81	32%	0.322	42%	0.421	S	S	.	.			trans	-101.3	145.7	-175.6	-64.1	-61.3	0	0	0	112.7	S590 I596	S590-Y592 VanDerWaalsContact CB-CD2 3.43Å; S590-Y592 WeakPolarHBondContact O-CD2 3.45Å; S590-Y592 WeakPolarHBondContact O-CE2 3.19Å; S590-Y592 PolarHBondContact O-N 2.95Å; S590-Y592 WeakPolarHBondContact OG-CD2 3.3Å; Y592-I596 HydrophobicContact CD2-CD1 3.8Å; Y592-I596 HydrophobicContact CG-CD1 3.76Å
593	S	49.4	Very low	53.4	Low	97 Å²	97	82 Å²	82	68%	0.678	43%	0.426	S	S	*	.			trans	-60.2	157.2	177.2	-179.7	0	0	0	0	112.6	F595 I596	S593-F595 PolarHBondContact O-N 2.92Å; S593-I596 PolarHBondContact O-N 3.11Å
594	L	50.9	Low	54.5	Low	128 Å²	128	86.4 Å²	86.4	67%	0.67	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-43.9	-14.1	-179.3	-125.4	76.6	0	0	0	115.6	I596 L597	L594-I596 PolarHBondContact O-N 2.88Å; L594-L597 HydrophobicContact CB-CD1 4.33Å; L594-L597 HydrophobicContact CD1-CD1 4.27Å; L594-L597 HydrophobicContact CG-CD1 3.64Å; L594-L597 VanDerWaalsContact O-CD1 3.31Å; L594-L597 WeakPolarHBondContact O-CD1 3.37Å; L594-L597 PolarHBondContact O-N 2.99Å
595	F	49.7	Very low	56	Low	190 Å²	190	84.7 Å²	84.7	83%	0.833	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-67.4	-14.8	179.9	-143.6	-99	0	0	0	114.5	S593	S593-F595 PolarHBondContact O-N 2.92Å
596	I	51.3	Low	57.4	Low	32 Å²	32	83.5 Å²	83.5	16%	0.164	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-83.4	-8.3	177.3	-66.7	-168.6	0	0	0	113.3	A528 L587 Y592 S593 L594 F598 L599 V600	A528-I596 HydrophobicContact CB-CD1 4.28Å; L587-I596 HydrophobicContact CD2-CB 4.26Å; Y592-I596 HydrophobicContact CD2-CD1 3.8Å; Y592-I596 HydrophobicContact CG-CD1 3.76Å; S593-I596 PolarHBondContact O-N 3.11Å; L594-I596 PolarHBondContact O-N 2.88Å; I596-F598 PolarHBondContact O-N 3.44Å; I596-L599 PolarHBondContact O-N 3.09Å; I596-V600 HydrophobicContact CG2-CG2 3.5Å
597	L	48.9	Very low	58.8	Low	81 Å²	81	83.3 Å²	83.3	42%	0.424	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-55.5	-26.7	-178.1	-100.9	124.3	0	0	0	114.4	T583 L587 L594	T583-L597 HydrophobicContact CG2-CD2 4.21Å; T583-L597 HydrophobicContact CG2-CG 4.34Å; L587-L597 HydrophobicContact CD1-CD1 3.82Å; L587-L597 HydrophobicContact CD1-CG 4.17Å; L594-L597 HydrophobicContact CB-CD1 4.33Å; L594-L597 HydrophobicContact CD1-CD1 4.27Å; L594-L597 HydrophobicContact CG-CD1 3.64Å; L594-L597 VanDerWaalsContact O-CD1 3.31Å; L594-L597 WeakPolarHBondContact O-CD1 3.37Å; L594-L597 PolarHBondContact O-N 2.99Å
598	F	47.1	Very low	60.2	Low	192 Å²	192	82.9 Å²	82.9	84%	0.842	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-82.9	-10.7	179.5	-127.1	-87.4	0	0	0	114.7	I596	I596-F598 PolarHBondContact O-N 3.44Å
599	L	48.3	Very low	61.6	Low	92 Å²	92	72.3 Å²	72.3	48%	0.482	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-3.3	-175.1	-71.2	170.6	0	0	0	113.9	I596	I596-L599 PolarHBondContact O-N 3.09Å
600	V	53.8	Low	62.8	Low	8 Å²	8	73.7 Å²	73.7	5%	0.048	38%	0.382	C	S	.	.	S	Bend	trans	-109.7	-10.8	-172.4	175.1	0	0	0	0	113	T583 L586 I596 D602 L603	T583-V600 HydrophobicContact CG2-CB 4.12Å; T583-V600 HydrophobicContact CG2-CG1 3.87Å; L586-V600 HydrophobicContact CB-CG1 4.32Å; L586-V600 HydrophobicContact CD1-CG1 3.22Å; L586-V600 HydrophobicContact CG-CG1 4.4Å; I596-V600 HydrophobicContact CG2-CG2 3.5Å; V600-D602 PolarHBondContact O-N 3.44Å; V600-L603 HydrophobicContact CG1-CD1 4.45Å; V600-L603 PolarHBondContact O-N 3.27Å
601	S	51.7	Low	63.9	Low	76 Å²	76	75.2 Å²	75.2	53%	0.531	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-7.8	-176.9	29	0	0	0	0	116.2
602	D	59.9	Low	64.8	Low	148 Å²	148	77.7 Å²	77.7	79%	0.791	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-0.5	-178.9	-69.6	-21.5	0	0	0	114.5	V600	V600-D602 PolarHBondContact O-N 3.44Å
603	L	67.3	Low	65.4	Low	21 Å²	21	80.2 Å²	80.2	11%	0.11	39%	0.393	C	S	.	.			trans	-98.3	109.8	-176.8	-59.1	178.5	0	0	0	111.4	L586 V600 M606 L621	L586-L603 HydrophobicContact CD1-CD1 3.56Å; V600-L603 HydrophobicContact CG1-CD1 4.45Å; V600-L603 PolarHBondContact O-N 3.27Å; L603-M606 HydrophobicContact CB-CG 4.43Å; L603-M606 HydrophobicContact CB-SD 3.57Å; L603-M606 VanDerWaalsContact CB-SD 3.57Å; L603-M606 HydrophobicContact CD1-SD 4.42Å; L603-L621 HydrophobicContact CB-CD2 3.85Å; L603-L621 HydrophobicContact CD2-CD2 3.67Å; L603-L621 HydrophobicContact CG-CD2 4.24Å
604	K	74.2	Confident	66.2	Low	117 Å²	117	77.2 Å²	77.2	51%	0.509	37%	0.373	S	S	.	.			trans	-116.3	159.7	176.7	-63.7	-174.3	178.5	-175.2	0	111.4	M606	K604-M606 PolarHBondContact O-N 3.19Å
605	Y	83.7	Confident	66.6	Low	75 Å²	75	80.4 Å²	80.4	29%	0.294	38%	0.384	S	S	.	.	S	Bend	trans	62.4	41.1	173.7	-40.1	-52.5	0	0	0	113.6	D579 A622 A625	D579-Y605 PolarHBondContact OD1-N 3.09Å; D579-Y605 VanDerWaalsContact OD1-N 3.1Å; Y605-A622 PolarHBondContact O-N 3.06Å; Y605-A625 HydrophobicContact CD1-CB 3.95Å; Y605-A625 HydrophobicContact CE1-CB 3.73Å
606	M	83.8	Confident	67.6	Low	3 Å²	3	76.5 Å²	76.5	2%	0.015	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	146.1	179.8	-64.3	169.7	62.3	0	0	111.9	L586 L603 K604 V619 L620 L621 K628	L586-M606 HydrophobicContact CD1-CE 3.72Å; L586-M606 HydrophobicContact CD1-SD 4.27Å; L586-M606 HydrophobicContact CD2-CE 3.77Å; L586-M606 HydrophobicContact CG-CE 3.88Å; L603-M606 HydrophobicContact CB-CG 4.43Å; L603-M606 HydrophobicContact CB-SD 3.57Å; L603-M606 VanDerWaalsContact CB-SD 3.57Å; L603-M606 HydrophobicContact CD1-SD 4.42Å; K604-M606 PolarHBondContact O-N 3.19Å; M606-V619 HydrophobicContact CE-CG1 3.42Å; M606-V619 VanDerWaalsContact CE-CG1 3.42Å; M606-L620 WeakPolarHBondContact CA-O 3.42Å; M606-L621 HydrophobicContact CG-CD2 3.58Å; M606-L621 HydrophobicContact CG-CG 3.88Å; M606-L621 HydrophobicContact SD-CD2 4.33Å; M606-K628 WeakPolarHBondContact O-CE 3.48Å; M606-K628 PolarHBondContact O-NZ 2.9Å; M606-K628 VanDerWaalsContact O-NZ 3.12Å
607	F	86.2	Confident	68.7	Low	0 Å²	0	77 Å²	77	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	155.1	164.4	63	-83.6	0	0	0	109.8	L488 I609 L620 K628 W631 M632 L635	L488-F607 HydrophobicContact CD1-CZ 3.82Å; L488-F607 HydrophobicContact CD2-CE1 4.17Å; L488-F607 HydrophobicContact CD2-CZ 4.18Å; F607-I609 HydrophobicContact CE2-CD1 4.49Å; F607-I609 HydrophobicContact CE2-CG1 4.45Å; F607-L620 HydrophobicContact CD1-CB 4.43Å; F607-L620 HydrophobicContact CD2-CB 4.33Å; F607-L620 HydrophobicContact CE1-CB 4.01Å; F607-L620 HydrophobicContact CE2-CB 3.92Å; F607-L620 HydrophobicContact CE2-CD1 3.68Å; F607-L620 HydrophobicContact CE2-CG 4.37Å; F607-L620 HydrophobicContact CZ-CB 3.75Å; F607-L620 HydrophobicContact CZ-CD1 3.97Å; F607-L620 PolarHBondContact N-O 3.12Å; F607-L620 PolarHBondContact O-N 3Å; F607-K628 HydrophobicContact CD1-CG 4.37Å; F607-W631 HydrophobicContact CE1-CB 4.36Å; F607-W631 HydrophobicContact CZ-CB 4.04Å; F607-W631 HydrophobicContact CZ-CG 4.45Å; F607-M632 HydrophobicContact CB-SD 3.54Å; F607-M632 VanDerWaalsContact CB-SD 3.54Å; F607-M632 HydrophobicContact CD2-SD 4.11Å; F607-M632 HydrophobicContact CG-SD 3.87Å; F607-L635 HydrophobicContact CE2-CD1 3.95Å
608	E	84.2	Confident	70.3	Confident	9 Å²	9	73.5 Å²	73.5	4%	0.042	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	137.1	-175	176	-171.9	170.9	0	0	110.5	V574 L575 H577 L585 S617 V619	V574-E608 WeakPolarHBondContact CA-O 3.18Å; L575-E608 HydrophobicContact CB-CB 4.22Å; L575-E608 PolarHBondContact N-O 3.3Å; L575-E608 PolarHBondContact O-N 2.96Å; H577-E608 IonicContact CD2-OE2 2.65Å; H577-E608 IonicContact CE1-OE2 3.73Å; H577-E608 IonicContact NE2-OE2 3.78Å; H577-E608 PolarHBondContact NE2-OE2 3.18Å; L585-E608 WeakPolarHBondContact CD2-OE2 3.47Å; E608-S617 WeakPolarHBondContact OE1-CB 3.39Å; E608-S617 PolarHBondContact OE1-OG 3.28Å; E608-V619 HydrophobicContact CG-CG2 4.5Å
609	I	86.2	Confident	72	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.01	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	109	167.6	-60.6	-173.7	0	0	0	107.3	I543 F545 Y567 I572 F607 T618 L620 L635	I543-I609 HydrophobicContact CD1-CD1 3.94Å; F545-I609 HydrophobicContact CZ-CD1 4.24Å; Y567-I609 HydrophobicContact CD2-CG2 4.39Å; I572-I609 HydrophobicContact CB-CG2 3.63Å; I572-I609 HydrophobicContact CD1-CG2 3.88Å; I572-I609 HydrophobicContact CG1-CG2 4.34Å; I572-I609 HydrophobicContact CG2-CG2 3.58Å; F607-I609 HydrophobicContact CE2-CD1 4.49Å; F607-I609 HydrophobicContact CE2-CG1 4.45Å; I609-T618 PolarHBondContact N-O 3.21Å; I609-T618 PolarHBondContact O-N 3.44Å; I609-L620 HydrophobicContact CD1-CD1 3.48Å; I609-L620 VanDerWaalsContact CD1-CD1 3.48Å; I609-L620 HydrophobicContact CG1-CD1 3.98Å; I609-L635 HydrophobicContact CD1-CD1 4.31Å
610	R	81.8	Confident	73.9	Confident	104 Å²	104	60.2 Å²	60.2	39%	0.392	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	133.9	177.3	-174	173.1	78.1	151.2	2.5	110	I572 E573 L575	I572-R610 CarbonylContact C-O 3.59Å; I572-R610 VanDerWaalsContact CA-O 3.32Å; I572-R610 WeakPolarHBondContact CA-O 3.42Å; E573-R610 PolarHBondContact N-O 2.94Å; E573-R610 PolarHBondContact O-N 3.46Å; E573-R610 IonicContact OE2-CZ 3.91Å; E573-R610 VanDerWaalsContact OE2-CZ 3.3Å; E573-R610 IonicContact OE2-NE 2.9Å; E573-R610 PolarHBondContact OE2-NE 2.97Å; E573-R610 VanDerWaalsContact OE2-NE 3.16Å; E573-R610 IonicContact OE2-NH2 3.94Å; E573-R610 PolarHBondContact OE2-NH2 3.02Å; L575-R610 HydrophobicContact CD1-CB 4.35Å
611	Q	78.6	Confident	75.4	Confident	53 Å²	53	60.4 Å²	60.4	25%	0.248	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	134.7	171.1	-66.2	-174	-24	0	0	110	K571 D613 S614 N616	K571-Q611 WeakPolarHBondContact O-CA 3.28Å; Q611-D613 VanDerWaalsContact C-N 3.29Å; Q611-D613 PolarHBondContact O-N 2.94Å; Q611-S614 WeakPolarHBondContact CB-OG 3.43Å; Q611-S614 PolarHBondContact O-N 3.32Å; Q611-S614 PolarHBondContact OE1-OG 3.05Å; Q611-N616 PolarHBondContact N-O 2.97Å
612	R	70.8	Confident	77.1	Confident	122 Å²	122	57.2 Å²	57.2	46%	0.46	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-35.8	-178.2	-69	-176.2	-177	176.8	1.4	113.2	D199 K571	D199-R612 IonicContact OD2-NH1 3.14Å; D199-R612 PolarHBondContact OD2-NH1 3.47Å; K571-R612 PolarHBondContact O-N 3.07Å
613	D	66.6	Low	78.4	Confident	134 Å²	134	56 Å²	56	72%	0.717	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-1.4	-173.4	-54.2	-38.5	0	0	0	114.1	Q611	Q611-D613 VanDerWaalsContact C-N 3.29Å; Q611-D613 PolarHBondContact O-N 2.94Å
614	S	65	Low	79.2	Confident	35 Å²	35	57.1 Å²	57.1	25%	0.245	28%	0.277	C	S	.	.	S	Bend	trans	-137.8	148.8	-178.5	88.2	0	0	0	0	111.8	Q611 N616	Q611-S614 WeakPolarHBondContact CB-OG 3.43Å; Q611-S614 PolarHBondContact O-N 3.32Å; Q611-S614 PolarHBondContact OE1-OG 3.05Å; S614-N616 PolarHBondContact O-N 2.81Å; S614-N616 VanDerWaalsContact OG-CB 3.27Å; S614-N616 WeakPolarHBondContact OG-CB 3.44Å; S614-N616 PolarHBondContact OG-N 3.18Å; S614-N616 PolarHBondContact OG-ND2 3.22Å
615	Q	60.2	Low	79.7	Confident	194 Å²	194	54.2 Å²	54.2	91%	0.907	28%	0.275	S	S	*	.	S	Bend	trans	-70	7.1	171	-67.4	-88.3	-34.5	0	0	112.1	S617	Q615-S617 PolarHBondContact O-N 3.48Å
616	N	70	Confident	79.6	Confident	109 Å²	109	56.9 Å²	56.9	58%	0.583	29%	0.29	S	S	*	.			trans	-81.2	112.4	-179.9	-61.3	-34.8	0	0	0	110.1	Q611 S614	Q611-N616 PolarHBondContact N-O 2.97Å; S614-N616 PolarHBondContact O-N 2.81Å; S614-N616 VanDerWaalsContact OG-CB 3.27Å; S614-N616 WeakPolarHBondContact OG-CB 3.44Å; S614-N616 PolarHBondContact OG-N 3.18Å; S614-N616 PolarHBondContact OG-ND2 3.22Å
617	S	74.4	Confident	79.7	Confident	41 Å²	41	57.6 Å²	57.6	29%	0.287	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	132.3	172.1	-68.6	0	0	0	0	110.6	E608 Q615	E608-S617 WeakPolarHBondContact OE1-CB 3.39Å; E608-S617 PolarHBondContact OE1-OG 3.28Å; Q615-S617 PolarHBondContact O-N 3.48Å
618	T	81.7	Confident	79.7	Confident	8 Å²	8	58.3 Å²	58.3	5%	0.049	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	115.1	172.3	-69.1	0	0	0	0	109.5	K490 Y567 I609 L620	K490-T618 HydrophobicContact CD-CG2 3.61Å; K490-T618 HydrophobicContact CG-CG2 3.91Å; K490-T618 PolarHBondContact NZ-OG1 2.68Å; K490-T618 VanDerWaalsContact NZ-OG1 3.11Å; Y567-T618 PolarHBondContact OH-OG1 3.32Å; I609-T618 PolarHBondContact N-O 3.21Å; I609-T618 PolarHBondContact O-N 3.44Å; T618-L620 HydrophobicContact CG2-CD2 3.79Å; T618-L620 HydrophobicContact CG2-CG 4.11Å
619	V	83.8	Confident	79.8	Confident	5 Å²	5	59.1 Å²	59.1	3%	0.03	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	125	176.2	-177.4	0	0	0	0	109.9	C491 L585 I589 M606 E608	C491-V619 HydrophobicContact CB-CB 4.29Å; C491-V619 PolarHBondContact N-O 3.5Å; L585-V619 HydrophobicContact CD2-CG2 4.27Å; I589-V619 HydrophobicContact CD1-CG2 4.12Å; M606-V619 HydrophobicContact CE-CG1 3.42Å; M606-V619 VanDerWaalsContact CE-CG1 3.42Å; E608-V619 HydrophobicContact CG-CG2 4.5Å
620	L	87.4	Confident	79.7	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	144.2	-177.2	-60.7	174.3	0	0	0	110.5	L488 K489 K490 F545 M606 F607 I609 T618	L488-L620 HydrophobicContact CD1-CD1 4.09Å; K489-L620 CarbonylContact O-C 3.52Å; K489-L620 WeakPolarHBondContact O-CA 3.28Å; K490-L620 HydrophobicContact CB-CD2 4.03Å; K490-L620 HydrophobicContact CG-CD2 4.49Å; F545-L620 HydrophobicContact CE1-CD1 3.84Å; F545-L620 HydrophobicContact CE1-CD2 3.81Å; F545-L620 HydrophobicContact CE1-CG 4.5Å; F545-L620 HydrophobicContact CZ-CD1 3.96Å; M606-L620 WeakPolarHBondContact CA-O 3.42Å; F607-L620 HydrophobicContact CD1-CB 4.43Å; F607-L620 HydrophobicContact CD2-CB 4.33Å; F607-L620 HydrophobicContact CE1-CB 4.01Å; F607-L620 HydrophobicContact CE2-CB 3.92Å; F607-L620 HydrophobicContact CE2-CD1 3.68Å; F607-L620 HydrophobicContact CE2-CG 4.37Å; F607-L620 HydrophobicContact CZ-CB 3.75Å; F607-L620 HydrophobicContact CZ-CD1 3.97Å; F607-L620 PolarHBondContact N-O 3.12Å; F607-L620 PolarHBondContact O-N 3Å; I609-L620 HydrophobicContact CD1-CD1 3.48Å; I609-L620 VanDerWaalsContact CD1-CD1 3.48Å; I609-L620 HydrophobicContact CG1-CD1 3.98Å; T618-L620 HydrophobicContact CG2-CD2 3.79Å; T618-L620 HydrophobicContact CG2-CG 4.11Å
621	L	86.7	Confident	80	Confident	12 Å²	12	55 Å²	55	6%	0.063	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	128	174.1	-52.1	98.2	0	0	0	110.4	K489 C491 T531 L603 M606	K489-L621 HydrophobicContact CB-CB 4.25Å; K489-L621 HydrophobicContact CB-CD1 4.16Å; K489-L621 PolarHBondContact N-O 3.25Å; K489-L621 WeakPolarHBondContact O-CD1 3.29Å; K489-L621 PolarHBondContact O-N 3.27Å; C491-L621 HydrophobicContact CB-CD1 4.45Å; C491-L621 WeakPolarHBondContact SG-CD1 3.5Å; T531-L621 HydrophobicContact CG2-CD1 4.41Å; L603-L621 HydrophobicContact CB-CD2 3.85Å; L603-L621 HydrophobicContact CD2-CD2 3.67Å; L603-L621 HydrophobicContact CG-CD2 4.24Å; M606-L621 HydrophobicContact CG-CD2 3.58Å; M606-L621 HydrophobicContact CG-CG 3.88Å; M606-L621 HydrophobicContact SD-CD2 4.33Å
622	A	87.6	Confident	80.5	Confident	10 Å²	10	52.4 Å²	52.4	8%	0.083	28%	0.277	C	S	.	.			trans	-83.8	167.8	167.7	0	0	0	0	0	111.1	L488 Y605 E627 K628	L488-A622 HydrophobicContact CD2-CB 4.25Å; Y605-A622 PolarHBondContact O-N 3.06Å; A622-E627 HydrophobicContact CB-CB 4.17Å; A622-E627 HydrophobicContact CB-CG 4.19Å; A622-K628 HydrophobicContact CB-CB 3.88Å
623	Q	85.9	Confident	81.2	Confident	122 Å²	122	46.6 Å²	46.6	57%	0.57	26%	0.255	S	S	*	.	S	Bend	trans	-83.7	-28.6	179.1	-56.8	173.3	40.7	0	0	112.5	E627	Q623-E627 WeakPolarHBondContact CB-OE2 3.45Å; Q623-E627 VanDerWaalsContact CG-OE2 3.27Å; Q623-E627 WeakPolarHBondContact CG-OE2 3.34Å; Q623-E627 PolarHBondContact N-OE2 3.09Å
624	S	85.5	Confident	82	Confident	45 Å²	45	40.2 Å²	40.2	32%	0.315	22%	0.221	S	C	.	.	S	Bend	trans	-141.1	164.4	-179.6	71.9	0	0	0	0	111.7	E626 E627 K628	S624-E626 VanDerWaalsContact C-N 3.27Å; S624-E626 PolarHBondContact O-N 3.11Å; S624-E627 PolarHBondContact O-N 3.3Å; S624-E627 WeakPolarHBondContact OG-CB 3.39Å; S624-E627 PolarHBondContact OG-N 3.49Å; S624-E627 VanDerWaalsContact OG-N 3.09Å; S624-K628 PolarHBondContact O-N 3.37Å
625	A	83.3	Confident	83	Confident	56 Å²	56	38.7 Å²	38.7	46%	0.463	21%	0.21	S	C	.	.	H	α-helix	trans	-60.4	-37	172.8	0	0	0	0	0	112.3	Y605 K628 S629	Y605-A625 HydrophobicContact CD1-CB 3.95Å; Y605-A625 HydrophobicContact CE1-CB 3.73Å; A625-K628 PolarHBondContact O-N 2.62Å; A625-S629 WeakPolarHBondContact O-CB 3.46Å; A625-S629 PolarHBondContact O-N 3.23Å
626	E	82.2	Confident	84.1	Confident	130 Å²	130	29.4 Å²	29.4	61%	0.607	17%	0.167	S	C	*	.	H	α-helix	trans	-66.9	-41.5	177.5	-173.7	-178.1	-176.1	0	0	111.9	S624 S629 T630	S624-E626 VanDerWaalsContact C-N 3.27Å; S624-E626 PolarHBondContact O-N 3.11Å; E626-S629 PolarHBondContact O-N 3.43Å; E626-T630 WeakPolarHBondContact O-CB 3.43Å; E626-T630 PolarHBondContact O-N 3.49Å; E626-T630 PolarHBondContact O-OG1 3.05Å
627	E	85	Confident	84.6	Confident	18 Å²	18	25.6 Å²	25.6	8%	0.084	15%	0.145	C	C	.	.	H	α-helix	trans	-66.7	-43.2	175.1	-171.8	177.9	-150.6	0	0	110.2	N441 A622 Q623 S624 S629 T630 W631	N441-E627 PolarHBondContact ND2-OE1 3.08Å; A622-E627 HydrophobicContact CB-CB 4.17Å; A622-E627 HydrophobicContact CB-CG 4.19Å; Q623-E627 WeakPolarHBondContact CB-OE2 3.45Å; Q623-E627 VanDerWaalsContact CG-OE2 3.27Å; Q623-E627 WeakPolarHBondContact CG-OE2 3.34Å; Q623-E627 PolarHBondContact N-OE2 3.09Å; S624-E627 PolarHBondContact O-N 3.3Å; S624-E627 WeakPolarHBondContact OG-CB 3.39Å; S624-E627 PolarHBondContact OG-N 3.49Å; S624-E627 VanDerWaalsContact OG-N 3.09Å; E627-S629 PolarHBondContact O-N 3.38Å; E627-T630 PolarHBondContact O-N 3.17Å; E627-W631 PolarHBondContact O-N 2.51Å
628	K	88	Confident	84.8	Confident	16 Å²	16	24.2 Å²	24.2	7%	0.07	14%	0.135	C	C	.	.	H	α-helix	trans	-54.8	-51.9	171.8	173.2	178.5	169	-179.8	0	110.8	E576 H577 M606 F607 A622 S624 A625 T630 W631 M632	E576-K628 WeakPolarHBondContact OE1-CE 3.3Å; E576-K628 IonicContact OE1-NZ 2.77Å; E576-K628 PolarHBondContact OE1-NZ 2.91Å; E576-K628 VanDerWaalsContact OE1-NZ 3.16Å; H577-K628 PolarHBondContact O-NZ 3.34Å; H577-K628 VanDerWaalsContact O-NZ 3.13Å; M606-K628 WeakPolarHBondContact O-CE 3.48Å; M606-K628 PolarHBondContact O-NZ 2.9Å; M606-K628 VanDerWaalsContact O-NZ 3.12Å; F607-K628 HydrophobicContact CD1-CG 4.37Å; A622-K628 HydrophobicContact CB-CB 3.88Å; S624-K628 PolarHBondContact O-N 3.37Å; A625-K628 PolarHBondContact O-N 2.62Å; K628-T630 VanDerWaalsContact C-N 3.27Å; K628-T630 PolarHBondContact O-N 3.04Å; K628-W631 PolarHBondContact O-N 3.09Å; K628-M632 HydrophobicContact CG-CG 4.03Å; K628-M632 WeakPolarHBondContact O-CB 3.37Å; K628-M632 WeakPolarHBondContact O-CG 3.46Å; K628-M632 PolarHBondContact O-N 3.25Å
629	S	84.5	Confident	84.6	Confident	26 Å²	26	26 Å²	26	18%	0.182	14%	0.142	C	C	.	.	H	α-helix	trans	-58.9	-39.3	179.8	177.8	0	0	0	0	111.8	A625 E626 E627 M632 A633	A625-S629 WeakPolarHBondContact O-CB 3.46Å; A625-S629 PolarHBondContact O-N 3.23Å; E626-S629 PolarHBondContact O-N 3.43Å; E627-S629 PolarHBondContact O-N 3.38Å; S629-M632 PolarHBondContact O-N 3.29Å; S629-A633 WeakPolarHBondContact O-CB 3.25Å; S629-A633 PolarHBondContact O-N 2.89Å
630	T	85.6	Confident	84.1	Confident	14 Å²	14	26 Å²	26	9%	0.086	14%	0.142	C	C	.	.	H	α-helix	trans	-67.4	-44.4	178.7	-57.3	0	0	0	0	112.3	F443 L484 E626 E627 K628 A634	F443-T630 HydrophobicContact CB-CG2 3.64Å; L484-T630 HydrophobicContact CD2-CG2 4.31Å; E626-T630 WeakPolarHBondContact O-CB 3.43Å; E626-T630 PolarHBondContact O-N 3.49Å; E626-T630 PolarHBondContact O-OG1 3.05Å; E627-T630 PolarHBondContact O-N 3.17Å; K628-T630 VanDerWaalsContact C-N 3.27Å; K628-T630 PolarHBondContact O-N 3.04Å; T630-A634 WeakPolarHBondContact O-CB 3.33Å; T630-A634 PolarHBondContact O-N 2.65Å
631	W	88.4	Confident	83.5	Confident	4 Å²	4	27.6 Å²	27.6	2%	0.015	15%	0.148	C	C	.	.	H	α-helix	trans	-65.6	-43.8	173.9	-80.2	100.9	0	0	0	112.3	L484 L488 V536 L538 F607 E627 K628 A634 L635	L484-W631 HydrophobicContact CD2-CD2 3.61Å; L484-W631 HydrophobicContact CD2-CE3 3.76Å; L484-W631 HydrophobicContact CD2-CG 4.11Å; L484-W631 HydrophobicContact CD2-CH2 4.18Å; L484-W631 HydrophobicContact CD2-CZ2 4.06Å; L484-W631 HydrophobicContact CD2-CZ3 4.05Å; L484-W631 HydrophobicContact CG-CH2 4.2Å; L484-W631 HydrophobicContact CG-CZ2 4.19Å; L484-W631 HydrophobicContact CG-CZ3 4.42Å; L488-W631 HydrophobicContact CD1-CD2 3.86Å; L488-W631 HydrophobicContact CD1-CE3 4.05Å; L488-W631 HydrophobicContact CD1-CG 4.36Å; L488-W631 HydrophobicContact CD1-CH2 4.35Å; L488-W631 HydrophobicContact CD1-CZ2 4.14Å; L488-W631 HydrophobicContact CD1-CZ3 4.29Å; L488-W631 HydrophobicContact CD2-CD2 4.43Å; L488-W631 HydrophobicContact CD2-CG 4.28Å; L488-W631 HydrophobicContact CG-CD2 4.41Å; L488-W631 HydrophobicContact CG-CZ2 4.24Å; V536-W631 HydrophobicContact CB-CH2 3.73Å; V536-W631 HydrophobicContact CB-CZ2 4.36Å; V536-W631 HydrophobicContact CB-CZ3 4.31Å; V536-W631 HydrophobicContact CG1-CH2 3.75Å; V536-W631 HydrophobicContact CG1-CZ3 3.85Å; L538-W631 HydrophobicContact CB-CZ3 4.08Å; L538-W631 HydrophobicContact CD2-CZ3 4.48Å; F607-W631 HydrophobicContact CE1-CB 4.36Å; F607-W631 HydrophobicContact CZ-CB 4.04Å; F607-W631 HydrophobicContact CZ-CG 4.45Å; E627-W631 PolarHBondContact O-N 2.51Å; K628-W631 PolarHBondContact O-N 3.09Å; W631-A634 PolarHBondContact O-N 3.11Å; W631-L635 VanDerWaalsContact O-CG 3.31Å; W631-L635 WeakPolarHBondContact O-CG 3.27Å; W631-L635 PolarHBondContact O-N 2.85Å
632	M	87.8	Confident	82.8	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.6	-48.9	176	-71.9	-66.2	-65.1	0	0	110.5	L373 H377 V574 E576 F607 K628 S629 A634 L635 L636	L373-M632 HydrophobicContact CD2-CE 4.48Å; H377-M632 HydrophobicContact CB-CB 4.05Å; V574-M632 HydrophobicContact CG1-CE 3.73Å; V574-M632 HydrophobicContact CG1-SD 3.51Å; V574-M632 VanDerWaalsContact CG1-SD 3.51Å; E576-M632 HydrophobicContact CB-CE 3.81Å; E576-M632 HydrophobicContact CG-CE 4.44Å; F607-M632 HydrophobicContact CB-SD 3.54Å; F607-M632 VanDerWaalsContact CB-SD 3.54Å; F607-M632 HydrophobicContact CD2-SD 4.11Å; F607-M632 HydrophobicContact CG-SD 3.87Å; K628-M632 HydrophobicContact CG-CG 4.03Å; K628-M632 WeakPolarHBondContact O-CB 3.37Å; K628-M632 WeakPolarHBondContact O-CG 3.46Å; K628-M632 PolarHBondContact O-N 3.25Å; S629-M632 PolarHBondContact O-N 3.29Å; M632-A634 VanDerWaalsContact C-N 3.34Å; M632-A634 PolarHBondContact O-N 2.88Å; M632-L635 PolarHBondContact O-N 2.67Å; M632-L636 HydrophobicContact CB-CD1 4.29Å; M632-L636 HydrophobicContact CE-CD1 4.16Å; M632-L636 WeakPolarHBondContact O-CB 3.26Å; M632-L636 WeakPolarHBondContact O-CD1 3.42Å; M632-L636 WeakPolarHBondContact O-CG 3.34Å; M632-L636 PolarHBondContact O-N 3.17Å
633	A	85.3	Confident	82.2	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.3	-44.7	177.7	0	0	0	0	0	112.2	H377 K381 S629 M637	H377-A633 HydrophobicContact CB-CB 4.48Å; H377-A633 VanDerWaalsContact O-CB 3.3Å; H377-A633 WeakPolarHBondContact O-CB 3.23Å; K381-A633 HydrophobicContact CG-CB 3.89Å; S629-A633 WeakPolarHBondContact O-CB 3.25Å; S629-A633 PolarHBondContact O-N 2.89Å; A633-M637 VanDerWaalsContact O-CB 3.24Å; A633-M637 WeakPolarHBondContact O-CB 3.44Å; A633-M637 PolarHBondContact O-N 3.39Å
634	A	84.5	Confident	81.8	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-64.6	-45.4	179.9	0	0	0	0	0	112.5	F443 I483 L484 L538 T630 W631 M632 L638	F443-A634 HydrophobicContact CD2-CB 3.64Å; F443-A634 HydrophobicContact CE2-CB 3.51Å; I483-A634 HydrophobicContact CG2-CB 4.17Å; L484-A634 HydrophobicContact CD2-CB 4.23Å; L538-A634 HydrophobicContact CD2-CB 3.75Å; T630-A634 WeakPolarHBondContact O-CB 3.33Å; T630-A634 PolarHBondContact O-N 2.65Å; W631-A634 PolarHBondContact O-N 3.11Å; M632-A634 VanDerWaalsContact C-N 3.34Å; M632-A634 PolarHBondContact O-N 2.88Å; A634-L638 WeakPolarHBondContact O-CG 3.46Å; A634-L638 PolarHBondContact O-N 3.45Å
635	L	85.6	Confident	81.3	Confident	2 Å²	2	21 Å²	21	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-72.1	-40.5	179.6	-63.9	167.9	0	0	0	112.1	L538 I543 V574 F607 I609 W631 M632 L638 Q639	L538-L635 HydrophobicContact CD1-CD2 3.65Å; L538-L635 HydrophobicContact CD2-CD2 3.91Å; L538-L635 HydrophobicContact CD2-CG 4.37Å; L538-L635 HydrophobicContact CG-CD2 4.45Å; I543-L635 HydrophobicContact CD1-CD2 4.14Å; V574-L635 HydrophobicContact CG2-CB 3.67Å; V574-L635 HydrophobicContact CG2-CD1 4.11Å; V574-L635 HydrophobicContact CG2-CG 4.44Å; F607-L635 HydrophobicContact CE2-CD1 3.95Å; I609-L635 HydrophobicContact CD1-CD1 4.31Å; W631-L635 VanDerWaalsContact O-CG 3.31Å; W631-L635 WeakPolarHBondContact O-CG 3.27Å; W631-L635 PolarHBondContact O-N 2.85Å; M632-L635 PolarHBondContact O-N 2.67Å; L635-L638 PolarHBondContact O-N 3.5Å; L635-Q639 PolarHBondContact O-N 2.99Å
636	L	83.9	Confident	80.9	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-64.5	-42.3	176.5	-72.7	165.9	0	0	0	110.9	L373 H377 M632 L638 Q639 T640	L373-L636 HydrophobicContact CB-CD1 3.75Å; L373-L636 HydrophobicContact CB-CD2 3.74Å; L373-L636 HydrophobicContact CB-CG 4.42Å; L373-L636 HydrophobicContact CD1-CD2 4.19Å; L373-L636 WeakPolarHBondContact O-CD1 3.29Å; H377-L636 HydrophobicContact CB-CD1 3.94Å; M632-L636 HydrophobicContact CB-CD1 4.29Å; M632-L636 HydrophobicContact CE-CD1 4.16Å; M632-L636 WeakPolarHBondContact O-CB 3.26Å; M632-L636 WeakPolarHBondContact O-CD1 3.42Å; M632-L636 WeakPolarHBondContact O-CG 3.34Å; M632-L636 PolarHBondContact O-N 3.17Å; L636-L638 VanDerWaalsContact C-N 3.25Å; L636-L638 PolarHBondContact O-N 2.82Å; L636-Q639 PolarHBondContact O-N 3.05Å; L636-Q639 VanDerWaalsContact O-N 3.1Å; L636-T640 WeakPolarHBondContact O-CB 3.47Å; L636-T640 PolarHBondContact O-N 2.86Å; L636-T640 PolarHBondContact O-OG1 3.09Å
637	M	79.4	Confident	80.5	Confident	28 Å²	28	13.1 Å²	13.1	14%	0.138	7%	0.065	C	C	.	.	H	α-helix	trans	-52.1	-47.2	172.8	-179.8	-171.8	59.8	0	0	110.6	L378 F443 F447 I483 A633 R641	L378-M637 HydrophobicContact CD1-CB 3.91Å; L378-M637 HydrophobicContact CD1-CG 4.42Å; L378-M637 HydrophobicContact CD2-CB 4.35Å; F443-M637 HydrophobicContact CE2-CE 3.78Å; F443-M637 HydrophobicContact CZ-CE 3.59Å; F443-M637 HydrophobicContact CZ-SD 3.73Å; F447-M637 HydrophobicContact CZ-SD 4.27Å; I483-M637 HydrophobicContact CG2-CE 4.39Å; A633-M637 VanDerWaalsContact O-CB 3.24Å; A633-M637 WeakPolarHBondContact O-CB 3.44Å; A633-M637 PolarHBondContact O-N 3.39Å; M637-R641 WeakPolarHBondContact O-CA 3.37Å; M637-R641 WeakPolarHBondContact O-CB 3.45Å; M637-R641 PolarHBondContact O-N 3.36Å
638	L	78.2	Confident	80.2	Confident	12 Å²	12	12.3 Å²	12.3	6%	0.063	6%	0.061	C	C	.	.	H	α-helix	trans	-67.2	-37.9	179	-64.8	171	0	0	0	113.3	N195 I483 L538 D540 T569 A634 L635 L636	N195-L638 PolarHBondContact ND2-O 3.24Å; I483-L638 HydrophobicContact CD1-CD1 3.53Å; I483-L638 HydrophobicContact CD1-CD2 3.54Å; I483-L638 HydrophobicContact CD1-CG 3.89Å; L538-L638 HydrophobicContact CD1-CD1 3.97Å; L538-L638 HydrophobicContact CD2-CD1 4.22Å; L538-L638 HydrophobicContact CG-CD1 4.18Å; D540-L638 HydrophobicContact CB-CD2 4.23Å; T569-L638 HydrophobicContact CG2-CB 3.61Å; T569-L638 HydrophobicContact CG2-CD1 3.78Å; T569-L638 HydrophobicContact CG2-CG 4.31Å; A634-L638 WeakPolarHBondContact O-CG 3.46Å; A634-L638 PolarHBondContact O-N 3.45Å; L635-L638 PolarHBondContact O-N 3.5Å; L636-L638 VanDerWaalsContact C-N 3.25Å; L636-L638 PolarHBondContact O-N 2.82Å
639	Q	77.4	Confident	79.4	Confident	45 Å²	45	12.9 Å²	12.9	21%	0.21	7%	0.069	C	C	.	.	H	α-helix	trans	-74	-40.7	-179.4	-172.6	176.2	-24.8	0	0	112.5	V574 L635 L636	V574-Q639 VanDerWaalsContact N-OE1 3.08Å; L635-Q639 PolarHBondContact O-N 2.99Å; L636-Q639 PolarHBondContact O-N 3.05Å; L636-Q639 VanDerWaalsContact O-N 3.1Å
640	T	73.9	Confident	78.7	Confident	5 Å²	5	12.8 Å²	12.8	3%	0.031	7%	0.068	C	C	.	.	H	α-helix	trans	-97.7	-6.7	-173	67.5	0	0	0	0	113.8	L636 S642 M643 L644	L636-T640 WeakPolarHBondContact O-CB 3.47Å; L636-T640 PolarHBondContact O-N 2.86Å; L636-T640 PolarHBondContact O-OG1 3.09Å; T640-S642 PolarHBondContact O-N 3.11Å; T640-M643 HydrophobicContact CG2-CE 4.36Å; T640-M643 WeakPolarHBondContact O-CB 3.47Å; T640-M643 PolarHBondContact O-N 2.71Å; T640-M643 VanDerWaalsContact O-N 3.15Å; T640-L644 WeakPolarHBondContact O-CG 3.09Å; T640-L644 PolarHBondContact O-N 3.42Å; T640-L644 WeakPolarHBondContact OG1-CD1 3.42Å
641	R	75.5	Confident	77.9	Confident	34 Å²	34	12.1 Å²	12.1	13%	0.128	6%	0.064	C	C	.	.	H	α-helix	trans	-52.6	-52.4	-177.9	-179.3	175.1	-173.2	178	-0.3	113.2	L169 M637 M643 L644 E645	L169-R641 VanDerWaalsContact CD2-NH2 3.33Å; L169-R641 VanDerWaalsContact CG-NH2 3.34Å; M637-R641 WeakPolarHBondContact O-CA 3.37Å; M637-R641 WeakPolarHBondContact O-CB 3.45Å; M637-R641 PolarHBondContact O-N 3.36Å; R641-M643 VanDerWaalsContact C-N 3.27Å; R641-M643 PolarHBondContact O-N 3.18Å; R641-L644 PolarHBondContact O-N 3.47Å; R641-E645 HydrophobicContact CG-CG 4.1Å; R641-E645 WeakPolarHBondContact O-CB 3.44Å; R641-E645 VanDerWaalsContact O-CG 3.28Å; R641-E645 WeakPolarHBondContact O-CG 3.47Å; R641-E645 PolarHBondContact O-N 3.47Å
642	S	70.9	Confident	77.1	Confident	8 Å²	8	14.2 Å²	14.2	6%	0.056	8%	0.075	C	C	.	.	H	α-helix	trans	-59.2	-40.7	-178.7	-172.8	0	0	0	0	111.2	D194 V196 T640 R646	D194-S642 WeakPolarHBondContact OD1-CB 3.48Å; D194-S642 PolarHBondContact OD1-OG 3.14Å; D194-S642 PolarHBondContact OD2-OG 3.32Å; V196-S642 WeakPolarHBondContact CG2-OG 3.45Å; T640-S642 PolarHBondContact O-N 3.11Å; S642-R646 WeakPolarHBondContact O-CB 3.2Å; S642-R646 WeakPolarHBondContact O-CD 3.3Å; S642-R646 WeakPolarHBondContact O-CG 3.33Å; S642-R646 PolarHBondContact O-N 2.79Å; S642-R646 PolarHBondContact OG-NE 2.82Å; S642-R646 VanDerWaalsContact OG-NE 3.09Å
643	M	75.7	Confident	76.1	Confident	23 Å²	23	17.3 Å²	17.3	11%	0.113	9%	0.09	C	C	.	.	H	α-helix	trans	-63.4	-52.6	174.7	-178.2	-169.6	80.4	0	0	111.9	P83 M351 Y371 T640 R641 E645 R646 M647	P83-M643 HydrophobicContact CG-CB 4.26Å; P83-M643 HydrophobicContact CG-CG 4.15Å; M351-M643 HydrophobicContact CE-CG 4.46Å; M351-M643 HydrophobicContact CE-SD 3.77Å; M351-M643 HydrophobicContact SD-CG 4.36Å; M351-M643 HydrophobicContact SD-SD 4.09Å; Y371-M643 HydrophobicContact CD2-CE 3.92Å; Y371-M643 HydrophobicContact CG-CE 4.47Å; T640-M643 HydrophobicContact CG2-CE 4.36Å; T640-M643 WeakPolarHBondContact O-CB 3.47Å; T640-M643 PolarHBondContact O-N 2.71Å; T640-M643 VanDerWaalsContact O-N 3.15Å; R641-M643 VanDerWaalsContact C-N 3.27Å; R641-M643 PolarHBondContact O-N 3.18Å; M643-E645 PolarHBondContact O-N 3.25Å; M643-R646 PolarHBondContact O-N 2.74Å; M643-M647 HydrophobicContact CE-SD 4.36Å; M643-M647 HydrophobicContact CG-SD 4.15Å; M643-M647 VanDerWaalsContact O-CG 3.31Å; M643-M647 WeakPolarHBondContact O-CG 3.43Å; M643-M647 PolarHBondContact O-N 3.39Å
644	L	77.4	Confident	75.2	Confident	4 Å²	4	19.6 Å²	19.6	2%	0.021	10%	0.101	C	C	.	.	H	α-helix	trans	-62.6	-40.2	-177.7	-67.5	173.7	0	0	0	112.5	M247 V251 F252 Y371 L378 T640 R641 M647 L648	M247-L644 HydrophobicContact CE-CB 4.48Å; M247-L644 HydrophobicContact SD-CB 4.22Å; M247-L644 HydrophobicContact SD-CD1 4.49Å; V251-L644 HydrophobicContact CG1-CD2 4.07Å; F252-L644 HydrophobicContact CE2-CD2 4.4Å; F252-L644 HydrophobicContact CZ-CD1 4.13Å; F252-L644 HydrophobicContact CZ-CD2 4.01Å; Y371-L644 HydrophobicContact CD2-CD2 4.1Å; Y371-L644 HydrophobicContact CE2-CD2 4Å; L378-L644 HydrophobicContact CD2-CD1 3.81Å; T640-L644 WeakPolarHBondContact O-CG 3.09Å; T640-L644 PolarHBondContact O-N 3.42Å; T640-L644 WeakPolarHBondContact OG1-CD1 3.42Å; R641-L644 PolarHBondContact O-N 3.47Å; L644-M647 HydrophobicContact CD2-SD 4.44Å; L644-M647 PolarHBondContact O-N 2.97Å; L644-L648 WeakPolarHBondContact O-CB 3.48Å; L644-L648 PolarHBondContact O-N 3.07Å
645	E	74.6	Confident	74.3	Confident	17 Å²	17	23.1 Å²	23.1	8%	0.079	12%	0.117	C	C	.	.	H	α-helix	trans	-66.5	-38.6	178.4	-73.8	-67	172.4	0	0	112.4	R243 M247 R641 M643 L648 A649	R243-E645 IonicContact CZ-OE2 3.75Å; R243-E645 IonicContact NE-OE1 3.51Å; R243-E645 IonicContact NE-OE2 3.03Å; R243-E645 PolarHBondContact NE-OE2 3.39Å; R243-E645 IonicContact NH2-OE2 3.34Å; R243-E645 PolarHBondContact NH2-OE2 3.2Å; M247-E645 HydrophobicContact CE-CG 4.39Å; M247-E645 WeakPolarHBondContact CE-OE1 3.49Å; R641-E645 HydrophobicContact CG-CG 4.1Å; R641-E645 WeakPolarHBondContact O-CB 3.44Å; R641-E645 VanDerWaalsContact O-CG 3.28Å; R641-E645 WeakPolarHBondContact O-CG 3.47Å; R641-E645 PolarHBondContact O-N 3.47Å; M643-E645 PolarHBondContact O-N 3.25Å; E645-L648 PolarHBondContact O-N 3.06Å; E645-A649 WeakPolarHBondContact O-CB 3.35Å; E645-A649 PolarHBondContact O-N 2.8Å
646	R	74.5	Confident	73.3	Confident	18 Å²	18	28.5 Å²	28.5	7%	0.068	14%	0.14	C	C	.	.	H	α-helix	trans	-75.3	-33.8	177.1	-65.5	162.7	-176.8	-86.8	-5	112	W87 D158 D194 S642 M643 A649 S650	W87-R646 HydrophobicContact CE3-CB 3.81Å; W87-R646 HydrophobicContact CE3-CG 4.36Å; W87-R646 HydrophobicContact CH2-CB 3.14Å; W87-R646 HydrophobicContact CH2-CG 4.31Å; W87-R646 HydrophobicContact CZ2-CB 4.08Å; W87-R646 HydrophobicContact CZ3-CB 2.99Å; W87-R646 HydrophobicContact CZ3-CG 3.73Å; D158-R646 IonicContact OD1-CZ 2.82Å; D158-R646 IonicContact OD1-NH1 3.79Å; D158-R646 PolarHBondContact OD1-NH1 2.96Å; D158-R646 IonicContact OD1-NH2 3.26Å; D158-R646 IonicContact OD2-CZ 3.25Å; D158-R646 IonicContact OD2-NH1 2.67Å; D158-R646 PolarHBondContact OD2-NH1 2.73Å; D158-R646 IonicContact OD2-NH2 3.79Å; D158-R646 PolarHBondContact OD2-NH2 3.02Å; D194-R646 IonicContact OD2-CZ 2.72Å; D194-R646 IonicContact OD2-NH2 3.57Å; D194-R646 PolarHBondContact OD2-NH2 2.96Å; S642-R646 WeakPolarHBondContact O-CB 3.2Å; S642-R646 WeakPolarHBondContact O-CD 3.3Å; S642-R646 WeakPolarHBondContact O-CG 3.33Å; S642-R646 PolarHBondContact O-N 2.79Å; S642-R646 PolarHBondContact OG-NE 2.82Å; S642-R646 VanDerWaalsContact OG-NE 3.09Å; M643-R646 PolarHBondContact O-N 2.74Å; R646-A649 PolarHBondContact O-N 3.01Å; R646-S650 PolarHBondContact O-N 3.45Å
647	M	75	Confident	72.4	Confident	2 Å²	2	34.8 Å²	34.8	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-59.2	-50.2	168.3	-71.9	174	77.5	0	0	110.3	W87 V251 Y350 F354 Y371 M643 L644 A649 S650 C651	W87-M647 HydrophobicContact CH2-CG 4.12Å; W87-M647 HydrophobicContact CZ2-CG 4.06Å; V251-M647 HydrophobicContact CG1-CB 4.39Å; V251-M647 HydrophobicContact CG1-CE 3.9Å; V251-M647 HydrophobicContact CG1-SD 4.29Å; V251-M647 HydrophobicContact CG2-CB 4.33Å; Y350-M647 HydrophobicContact CD1-CE 4.02Å; Y350-M647 HydrophobicContact CE1-CE 3.76Å; F354-M647 HydrophobicContact CD2-CE 4.24Å; Y371-M647 HydrophobicContact CD2-CE 4.47Å; Y371-M647 HydrophobicContact CD2-SD 4.44Å; Y371-M647 HydrophobicContact CE2-CE 4.08Å; Y371-M647 HydrophobicContact CE2-SD 4.42Å; M643-M647 HydrophobicContact CE-SD 4.36Å; M643-M647 HydrophobicContact CG-SD 4.15Å; M643-M647 VanDerWaalsContact O-CG 3.31Å; M643-M647 WeakPolarHBondContact O-CG 3.43Å; M643-M647 PolarHBondContact O-N 3.39Å; L644-M647 HydrophobicContact CD2-SD 4.44Å; L644-M647 PolarHBondContact O-N 2.97Å; M647-A649 PolarHBondContact O-N 2.96Å; M647-S650 WeakPolarHBondContact O-CB 3.05Å; M647-S650 PolarHBondContact O-N 2.78Å; M647-S650 VanDerWaalsContact O-N 3.16Å; M647-C651 PolarHBondContact O-N 3.48Å; M647-C651 PolarHBondContact O-SG 2.99Å
648	L	77.5	Confident	71.8	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-58.5	-45.9	176	175.4	60.5	0	0	0	111.8	R243 N246 M247 L250 V251 L644 E645 S650 C651 L652	R243-L648 HydrophobicContact CG-CD2 3.79Å; N246-L648 HydrophobicContact CB-CD1 3.94Å; M247-L648 HydrophobicContact CB-CD2 4.2Å; M247-L648 HydrophobicContact CE-CD2 4.09Å; L250-L648 HydrophobicContact CB-CD1 4.38Å; L250-L648 HydrophobicContact CD1-CD1 4.15Å; V251-L648 HydrophobicContact CG2-CB 3.98Å; V251-L648 HydrophobicContact CG2-CD1 4.46Å; L644-L648 WeakPolarHBondContact O-CB 3.48Å; L644-L648 PolarHBondContact O-N 3.07Å; E645-L648 PolarHBondContact O-N 3.06Å; L648-S650 VanDerWaalsContact C-N 3.28Å; L648-S650 PolarHBondContact O-N 2.73Å; L648-C651 WeakPolarHBondContact O-CB 3.45Å; L648-C651 PolarHBondContact O-N 3.24Å; L648-C651 VanDerWaalsContact O-N 3.12Å; L648-L652 HydrophobicContact CD1-CD1 4.02Å; L648-L652 HydrophobicContact CD1-CG 4.05Å; L648-L652 HydrophobicContact CG-CD1 3.95Å; L648-L652 HydrophobicContact CG-CG 4.4Å; L648-L652 WeakPolarHBondContact O-CG 3.48Å; L648-L652 PolarHBondContact O-N 2.89Å
649	A	71.1	Confident	71.2	Confident	28 Å²	28	37.6 Å²	37.6	23%	0.231	18%	0.183	C	C	.	.	H	α-helix	trans	-59	-41.1	176.9	0	0	0	0	0	111.5	E645 R646 M647 L652 E653	E645-A649 WeakPolarHBondContact O-CB 3.35Å; E645-A649 PolarHBondContact O-N 2.8Å; R646-A649 PolarHBondContact O-N 3.01Å; M647-A649 PolarHBondContact O-N 2.96Å; A649-L652 PolarHBondContact O-N 2.83Å; A649-E653 WeakPolarHBondContact O-CB 3.4Å; A649-E653 VanDerWaalsContact O-CG 3.27Å; A649-E653 WeakPolarHBondContact O-CG 3.41Å; A649-E653 PolarHBondContact O-N 3.2Å
650	S	69.7	Low	71	Confident	24 Å²	24	38.5 Å²	38.5	17%	0.168	19%	0.189	C	C	.	.	H	α-helix	trans	-62.5	-43.7	173.4	-169.7	0	0	0	0	111.9	R646 M647 L648 L652 E653 E654	R646-S650 PolarHBondContact O-N 3.45Å; M647-S650 WeakPolarHBondContact O-CB 3.05Å; M647-S650 PolarHBondContact O-N 2.78Å; M647-S650 VanDerWaalsContact O-N 3.16Å; L648-S650 VanDerWaalsContact C-N 3.28Å; L648-S650 PolarHBondContact O-N 2.73Å; S650-L652 VanDerWaalsContact C-N 3.32Å; S650-L652 PolarHBondContact O-N 3.12Å; S650-E653 PolarHBondContact O-N 2.98Å; S650-E654 WeakPolarHBondContact O-CG 3.3Å; S650-E654 PolarHBondContact O-N 2.81Å
651	C	70	Confident	71.2	Confident	1 Å²	1	42 Å²	42	1%	0.007	21%	0.207	C	C	.	.	H	α-helix	trans	-58.2	-45	175.2	-55.9	0	0	0	0	111.9	L250 F354 M647 L648 E654 Q655	L250-C651 HydrophobicContact CB-CB 3.86Å; L250-C651 HydrophobicContact CD1-CB 4.04Å; L250-C651 HydrophobicContact CG-CB 4.48Å; L250-C651 PolarHBondContact O-SG 3.4Å; F354-C651 WeakPolarHBondContact CZ-SG 3.39Å; M647-C651 PolarHBondContact O-N 3.48Å; M647-C651 PolarHBondContact O-SG 2.99Å; L648-C651 WeakPolarHBondContact O-CB 3.45Å; L648-C651 PolarHBondContact O-N 3.24Å; L648-C651 VanDerWaalsContact O-N 3.12Å; C651-E654 WeakPolarHBondContact O-CB 3.37Å; C651-E654 PolarHBondContact O-N 3.05Å; C651-Q655 PolarHBondContact O-N 3.34Å
652	L	70.8	Confident	71.4	Confident	47 Å²	47	44.1 Å²	44.1	25%	0.246	22%	0.221	C	C	.	.	H	α-helix	trans	-69.7	-37.3	-178.7	-66.7	172	0	0	0	111.2	L250 L648 A649 S650 Q655 K656	L250-L652 HydrophobicContact CD1-CD2 3.69Å; L250-L652 HydrophobicContact CD1-CG 4.31Å; L648-L652 HydrophobicContact CD1-CD1 4.02Å; L648-L652 HydrophobicContact CD1-CG 4.05Å; L648-L652 HydrophobicContact CG-CD1 3.95Å; L648-L652 HydrophobicContact CG-CG 4.4Å; L648-L652 WeakPolarHBondContact O-CG 3.48Å; L648-L652 PolarHBondContact O-N 2.89Å; A649-L652 PolarHBondContact O-N 2.83Å; S650-L652 VanDerWaalsContact C-N 3.32Å; S650-L652 PolarHBondContact O-N 3.12Å; L652-Q655 WeakPolarHBondContact O-CB 3.41Å; L652-Q655 PolarHBondContact O-N 3.26Å; L652-K656 WeakPolarHBondContact O-CG 3.44Å; L652-K656 PolarHBondContact O-N 3.4Å; L652-K656 VanDerWaalsContact O-N 3.08Å
653	E	66.7	Low	71.9	Confident	65 Å²	65	44.5 Å²	44.5	30%	0.304	22%	0.223	S	C	.	.	H	α-helix	trans	-67	-35	173.2	-72.9	-63.7	146.5	0	0	112.2	A649 S650 Q655 K656 R657	A649-E653 WeakPolarHBondContact O-CB 3.4Å; A649-E653 VanDerWaalsContact O-CG 3.27Å; A649-E653 WeakPolarHBondContact O-CG 3.41Å; A649-E653 PolarHBondContact O-N 3.2Å; S650-E653 PolarHBondContact O-N 2.98Å; E653-Q655 VanDerWaalsContact C-N 3.32Å; E653-Q655 PolarHBondContact O-N 3.48Å; E653-K656 CarbonylContact O-C 3.58Å; E653-K656 WeakPolarHBondContact O-CA 3.37Å; E653-K656 WeakPolarHBondContact O-CB 3.3Å; E653-K656 PolarHBondContact O-N 3.01Å; E653-K656 VanDerWaalsContact O-N 3.09Å; E653-K656 IonicContact OE1-NZ 2.91Å; E653-K656 PolarHBondContact OE1-NZ 3.3Å; E653-R657 PolarHBondContact O-N 3.39Å
654	E	66.8	Low	72.2	Confident	49 Å²	49	46 Å²	46	23%	0.229	24%	0.235	C	C	.	.	H	α-helix	trans	-59.3	-43.6	171.1	-76.6	171.3	-168.3	0	0	111.6	R254 S650 C651 K656 R657	R254-E654 IonicContact CZ-OE2 2.92Å; R254-E654 IonicContact NH1-OE2 3.85Å; R254-E654 PolarHBondContact NH1-OE2 2.95Å; R254-E654 IonicContact NH2-OE2 3.5Å; S650-E654 WeakPolarHBondContact O-CG 3.3Å; S650-E654 PolarHBondContact O-N 2.81Å; C651-E654 WeakPolarHBondContact O-CB 3.37Å; C651-E654 PolarHBondContact O-N 3.05Å; E654-K656 PolarHBondContact O-N 3.47Å; E654-R657 WeakPolarHBondContact O-CB 3.38Å; E654-R657 PolarHBondContact O-N 3.31Å; E654-R657 VanDerWaalsContact O-N 3.11Å
655	Q	66	Low	72.6	Confident	73 Å²	73	49.2 Å²	49.2	34%	0.341	26%	0.255	S	S	.	.	H	α-helix	trans	-62	-34.8	174.3	-67.8	177.4	-19.4	0	0	111.6	C651 L652 E653 R657 I658 R794	C651-Q655 PolarHBondContact O-N 3.34Å; L652-Q655 WeakPolarHBondContact O-CB 3.41Å; L652-Q655 PolarHBondContact O-N 3.26Å; E653-Q655 VanDerWaalsContact C-N 3.32Å; E653-Q655 PolarHBondContact O-N 3.48Å; Q655-R657 VanDerWaalsContact C-N 3.33Å; Q655-R657 PolarHBondContact O-N 3.06Å; Q655-I658 WeakPolarHBondContact O-CB 2.88Å; Q655-I658 WeakPolarHBondContact O-CG1 3.33Å; Q655-I658 PolarHBondContact O-N 3.44Å; Q655-R794 PolarHBondContact O-NH1 3.41Å
656	K	64.5	Low	73	Confident	115 Å²	115	57.5 Å²	57.5	50%	0.5	29%	0.294	S	S	.	.	H	α-helix	trans	-68.2	-24.9	174.9	-70.1	-179.4	-170.4	172.6	0	114.3	L652 E653 E654 I658 R794	L652-K656 WeakPolarHBondContact O-CG 3.44Å; L652-K656 PolarHBondContact O-N 3.4Å; L652-K656 VanDerWaalsContact O-N 3.08Å; E653-K656 CarbonylContact O-C 3.58Å; E653-K656 WeakPolarHBondContact O-CA 3.37Å; E653-K656 WeakPolarHBondContact O-CB 3.3Å; E653-K656 PolarHBondContact O-N 3.01Å; E653-K656 VanDerWaalsContact O-N 3.09Å; E653-K656 IonicContact OE1-NZ 2.91Å; E653-K656 PolarHBondContact OE1-NZ 3.3Å; E654-K656 PolarHBondContact O-N 3.47Å; K656-I658 PolarHBondContact O-N 3.22Å; K656-R794 PolarHBondContact O-NH1 3.02Å
657	R	64.5	Low	73.4	Confident	132 Å²	132	63.1 Å²	63.1	50%	0.498	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-17.2	177.5	-69.6	178.1	-179.2	-165.8	-5.7	113.1	E91 E94 E653 E654 Q655	E91-R657 IonicContact OE1-NH2 3.31Å; E94-R657 IonicContact OE1-NH1 3.75Å; E94-R657 IonicContact OE1-NH2 2.82Å; E94-R657 PolarHBondContact OE1-NH2 3.11Å; E94-R657 IonicContact OE2-CZ 2.72Å; E94-R657 IonicContact OE2-NH2 2.8Å; E94-R657 PolarHBondContact OE2-NH2 3.45Å; E94-R657 VanDerWaalsContact OE2-NH2 3.09Å; E653-R657 PolarHBondContact O-N 3.39Å; E654-R657 WeakPolarHBondContact O-CB 3.38Å; E654-R657 PolarHBondContact O-N 3.31Å; E654-R657 VanDerWaalsContact O-N 3.11Å; Q655-R657 VanDerWaalsContact C-N 3.33Å; Q655-R657 PolarHBondContact O-N 3.06Å
658	I	66.9	Low	74.1	Confident	31 Å²	31	63.1 Å²	63.1	16%	0.159	32%	0.321	C	S	.	.	S	Bend	trans	-61.4	122.5	171	-60	175.5	0	0	0	107.9	Q655 K656 L660 E790 S791 R794	Q655-I658 WeakPolarHBondContact O-CB 2.88Å; Q655-I658 WeakPolarHBondContact O-CG1 3.33Å; Q655-I658 PolarHBondContact O-N 3.44Å; K656-I658 PolarHBondContact O-N 3.22Å; I658-L660 PolarHBondContact O-N 2.97Å; I658-E790 HydrophobicContact CD1-CB 4.02Å; I658-E790 HydrophobicContact CD1-CG 3.39Å; I658-S791 WeakPolarHBondContact CG2-OG 3.36Å; I658-R794 PolarHBondContact O-NH1 3.36Å
659	P	66.7	Low	74.8	Confident	68 Å²	68	68.8 Å²	68.8	44%	0.442	34%	0.342	S	S	.	.			trans	-66.1	137.4	-175.6	25.5	-32.9	0	0	0	110.9	L661 S791	P659-L661 HydrophobicContact CG-CD2 4.5Å; P659-L661 PolarHBondContact O-N 3.32Å; P659-S791 PolarHBondContact O-OG 3.24Å
660	L	72	Confident	75.8	Confident	65 Å²	65	67.6 Å²	67.6	34%	0.34	33%	0.332	S	S	.	.			trans	-74.8	107	165.2	-73.1	171	0	0	0	107.9	I658 L662 R794 E798	I658-L660 PolarHBondContact O-N 2.97Å; L660-L662 PolarHBondContact O-N 3.44Å; L660-L662 VanDerWaalsContact O-N 3.17Å; L660-R794 HydrophobicContact CD2-CB 3.82Å; L660-E798 HydrophobicContact CD2-CB 4.47Å
661	L	77.9	Confident	76.7	Confident	78 Å²	78	67.3 Å²	67.3	41%	0.408	33%	0.331	S	S	.	.			trans	-82.8	91.3	177.9	-62.6	175.2	0	0	0	109	P659 L788 L795	P659-L661 HydrophobicContact CG-CD2 4.5Å; P659-L661 PolarHBondContact O-N 3.32Å; L661-L788 HydrophobicContact CD1-CD1 4.37Å; L661-L795 WeakPolarHBondContact O-CD2 3.45Å
662	L	79.5	Confident	77.6	Confident	79 Å²	79	71 Å²	71	41%	0.414	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-71.5	149.6	172.4	-64.2	175.7	0	0	0	110.3	L660 L795 Y799	L660-L662 PolarHBondContact O-N 3.44Å; L660-L662 VanDerWaalsContact O-N 3.17Å; L662-L795 HydrophobicContact CD2-CD1 3.88Å; L662-Y799 HydrophobicContact CD2-CD1 4.08Å; L662-Y799 HydrophobicContact CD2-CD2 3.66Å; L662-Y799 HydrophobicContact CD2-CE1 4.09Å; L662-Y799 HydrophobicContact CD2-CE2 3.64Å; L662-Y799 HydrophobicContact CD2-CG 3.89Å
663	P	82	Confident	78.4	Confident	16 Å²	16	73.2 Å²	73.2	10%	0.104	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-57.7	155.9	170.5	-20.7	31.8	0	0	0	111.6	Q667 A671 I742 P743	P663-Q667 HydrophobicContact CB-CB 4.39Å; P663-A671 VanDerWaalsContact O-CB 3.31Å; P663-A671 WeakPolarHBondContact O-CB 3.23Å; P663-I742 HydrophobicContact CG-CG2 4.16Å; P663-P743 HydrophobicContact CB-CG 3.89Å; P663-P743 HydrophobicContact CG-CG 3.89Å
664	S	82.3	Confident	79.4	Confident	53 Å²	53	73.4 Å²	73.4	37%	0.371	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-65.3	154.7	177.1	69.9	0	0	0	0	111.3	E666 Q667 Y668	S664-E666 PolarHBondContact O-N 3.33Å; S664-E666 VanDerWaalsContact O-N 3.15Å; S664-Q667 PolarHBondContact O-N 3.44Å; S664-Q667 WeakPolarHBondContact OG-CG 3.43Å; S664-Q667 PolarHBondContact OG-N 3.41Å; S664-Y668 PolarHBondContact O-N 2.99Å
665	V	84.6	Confident	80.3	Confident	73 Å²	73	73.2 Å²	73.2	44%	0.442	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-30	177.9	-175.8	0	0	0	0	111.8	Y668 E672	V665-Y668 CarbonylContact O-C 3.55Å; V665-E672 HydrophobicContact CG1-CB 4.22Å
666	E	83	Confident	81.1	Confident	190 Å²	190	76 Å²	76	89%	0.888	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-33.9	175.9	-63.4	174.4	178.3	0	0	113	S664	S664-E666 PolarHBondContact O-N 3.33Å; S664-E666 VanDerWaalsContact O-N 3.15Å
667	Q	84.4	Confident	82	Confident	136 Å²	136	76.9 Å²	76.9	64%	0.636	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-31.3	178	-69.5	176.7	-27.6	0	0	112.2	P663 S664 P743	P663-Q667 HydrophobicContact CB-CB 4.39Å; S664-Q667 PolarHBondContact O-N 3.44Å; S664-Q667 WeakPolarHBondContact OG-CG 3.43Å; S664-Q667 PolarHBondContact OG-N 3.41Å; Q667-P743 HydrophobicContact CB-CG 4.36Å
668	Y	89.9	Confident	83.1	Confident	3 Å²	3	70.8 Å²	70.8	1%	0.012	37%	0.373	C	S	.	.			trans	-147.4	98.7	-174	-171.6	-116.2	0	0	0	110.5	S664 V665 F670 A671 E738 R739 I742 Y799	S664-Y668 PolarHBondContact O-N 2.99Å; V665-Y668 CarbonylContact O-C 3.55Å; Y668-F670 HydrophobicContact CD1-CB 4.18Å; Y668-F670 HydrophobicContact CD2-CD2 4.15Å; Y668-F670 HydrophobicContact CE1-CB 3.67Å; Y668-F670 HydrophobicContact CE1-CD2 4.23Å; Y668-F670 HydrophobicContact CE1-CG 4.44Å; Y668-F670 AromaticContact CE2-CD2 3.59Å; Y668-F670 HydrophobicContact CE2-CD2 3.59Å; Y668-F670 HydrophobicContact CE2-CE2 4.31Å; Y668-F670 AromaticContact CZ-CD2 3.64Å; Y668-F670 PolarHBondContact O-N 2.64Å; Y668-A671 HydrophobicContact CD1-CB 4.12Å; Y668-A671 VanDerWaalsContact O-CB 3.28Å; Y668-A671 WeakPolarHBondContact O-CB 2.96Å; Y668-A671 PolarHBondContact O-N 2.72Å; Y668-E738 WeakPolarHBondContact CE2-O 3.17Å; Y668-R739 VanDerWaalsContact OH-CD 3.31Å; Y668-R739 WeakPolarHBondContact OH-CD 3.34Å; Y668-R739 PolarHBondContact OH-NH1 3.01Å; Y668-R739 PolarHBondContact OH-O 3.38Å; Y668-R739 VanDerWaalsContact OH-O 3.12Å; Y668-I742 HydrophobicContact CE1-CG1 4.4Å; Y668-I742 HydrophobicContact CE2-CG1 3.89Å; Y668-I742 WeakPolarHBondContact OH-CG1 3.43Å; Y668-Y799 HydrophobicContact CE1-CE1 4.12Å
669	R	91.1	Very high	84.2	Confident	119 Å²	119	69.6 Å²	69.6	45%	0.449	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-59.5	-25	-172.8	73	178.9	77.3	173.4	13.6	114.4	A671 E672 T699 E738	R669-A671 PolarHBondContact O-N 3.18Å; R669-E672 PolarHBondContact O-N 3Å; R669-T699 HydrophobicContact CG-CG2 3.87Å; R669-E738 IonicContact CZ-OE1 3.73Å; R669-E738 IonicContact CZ-OE2 3.88Å; R669-E738 VanDerWaalsContact NE-CD 3.31Å; R669-E738 IonicContact NE-OE1 3.58Å; R669-E738 PolarHBondContact NE-OE1 3.11Å; R669-E738 IonicContact NE-OE2 3.64Å; R669-E738 PolarHBondContact NE-OE2 3.06Å; R669-E738 IonicContact NH1-OE2 2.77Å; R669-E738 IonicContact NH2-OE1 3.53Å; R669-E738 PolarHBondContact NH2-OE1 3.23Å; R669-E738 IonicContact NH2-OE2 3.39Å; R669-E738 PolarHBondContact NH2-OE2 3.35Å
670	F	92.4	Very high	85.2	Confident	2 Å²	2	68.6 Å²	68.6	1%	0.009	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-77.3	1.9	177.7	-49.4	-84.3	0	0	0	113.5	Y668 T699 I702 E703 L735 E738 R739	Y668-F670 HydrophobicContact CD1-CB 4.18Å; Y668-F670 HydrophobicContact CD2-CD2 4.15Å; Y668-F670 HydrophobicContact CE1-CB 3.67Å; Y668-F670 HydrophobicContact CE1-CD2 4.23Å; Y668-F670 HydrophobicContact CE1-CG 4.44Å; Y668-F670 AromaticContact CE2-CD2 3.59Å; Y668-F670 HydrophobicContact CE2-CD2 3.59Å; Y668-F670 HydrophobicContact CE2-CE2 4.31Å; Y668-F670 AromaticContact CZ-CD2 3.64Å; Y668-F670 PolarHBondContact O-N 2.64Å; F670-T699 HydrophobicContact CD1-CG2 3.59Å; F670-T699 HydrophobicContact CE1-CG2 3.87Å; F670-T699 HydrophobicContact CG-CG2 4.33Å; F670-I702 HydrophobicContact CE1-CB 3.92Å; F670-I702 HydrophobicContact CE1-CG2 3.73Å; F670-I702 HydrophobicContact CZ-CG2 4.16Å; F670-E703 HydrophobicContact CD1-CB 4.41Å; F670-L735 HydrophobicContact CZ-CD2 4.38Å; F670-E738 HydrophobicContact CE2-CB 4.1Å; F670-E738 HydrophobicContact CE2-CG 3.89Å; F670-R739 HydrophobicContact CD2-CB 4.43Å; F670-R739 HydrophobicContact CE2-CB 3.92Å; F670-R739 HydrophobicContact CZ-CB 4.01Å
671	A	88.7	Confident	85.8	Confident	19 Å²	19	68.5 Å²	68.5	16%	0.157	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-86.6	-3.5	170.7	0	0	0	0	0	113.3	P663 Y668 R669	P663-A671 VanDerWaalsContact O-CB 3.31Å; P663-A671 WeakPolarHBondContact O-CB 3.23Å; Y668-A671 HydrophobicContact CD1-CB 4.12Å; Y668-A671 VanDerWaalsContact O-CB 3.28Å; Y668-A671 WeakPolarHBondContact O-CB 2.96Å; Y668-A671 PolarHBondContact O-N 2.72Å; R669-A671 PolarHBondContact O-N 3.18Å
672	E	88.3	Confident	85.9	Confident	77 Å²	77	68 Å²	68	36%	0.36	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-57.7	129.8	176.3	-168.1	-170.7	153.1	0	0	110.6	V665 R669 N678 K700	V665-E672 HydrophobicContact CG1-CB 4.22Å; R669-E672 PolarHBondContact O-N 3Å; E672-N678 PolarHBondContact OE1-ND2 3.48Å; E672-K700 WeakPolarHBondContact O-CE 3.35Å; E672-K700 PolarHBondContact O-NZ 3.28Å
673	P	87.4	Confident	85.2	Confident	95 Å²	95	70.8 Å²	70.8	62%	0.617	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-63	151.8	177.3	-23.8	34.3	0	0	0	113.2	S675 N678	P673-S675 PolarHBondContact O-N 2.75Å; P673-N678 PolarHBondContact O-ND2 2.76Å
674	D	87.7	Confident	84	Confident	69 Å²	69	75 Å²	75	37%	0.369	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-64.4	132.6	172.6	-72.4	-9.9	0	0	0	110.8	I679 K700 R704	D674-I679 HydrophobicContact CB-CG2 3.75Å; D674-K700 VanDerWaalsContact OD1-CE 3.26Å; D674-K700 WeakPolarHBondContact OD1-CE 3.36Å; D674-K700 IonicContact OD1-NZ 3.77Å; D674-K700 PolarHBondContact OD1-NZ 2.8Å; D674-R704 IonicContact OD2-CZ 3.67Å; D674-R704 IonicContact OD2-NH2 3.92Å; D674-R704 PolarHBondContact OD2-NH2 3.26Å
675	S	86.2	Confident	82.5	Confident	45 Å²	45	78.9 Å²	78.9	32%	0.315	41%	0.406	S	S	.	.			trans	-143.7	159.3	175.4	75.1	0	0	0	0	110.1	P673 E677 N678 I679	P673-S675 PolarHBondContact O-N 2.75Å; S675-E677 PolarHBondContact O-N 3.21Å; S675-E677 PolarHBondContact OG-N 3.29Å; S675-N678 PolarHBondContact N-OD1 3.15Å; S675-N678 PolarHBondContact O-N 3.47Å; S675-N678 PolarHBondContact O-OD1 2.81Å; S675-N678 PolarHBondContact OG-N 3.08Å; S675-N678 PolarHBondContact OG-ND2 3.14Å; S675-I679 PolarHBondContact O-N 3.48Å
676	D	82.5	Confident	81	Confident	131 Å²	131	76.7 Å²	76.7	70%	0.701	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-17	175.9	-65.7	-31.5	0	0	0	112.7	M1082	D676-M1082 WeakPolarHBondContact O-CE 3.39Å
677	E	83.1	Confident	79.6	Confident	133 Å²	133	70.3 Å²	70.3	62%	0.621	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-22.5	177.2	-58.3	-175.1	174.9	0	0	113.1	S675 L1103	S675-E677 PolarHBondContact O-N 3.21Å; S675-E677 PolarHBondContact OG-N 3.29Å; E677-L1103 WeakPolarHBondContact O-CD2 3.47Å
678	N	89	Confident	78.3	Confident	4 Å²	4	65.7 Å²	65.7	2%	0.021	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-24.1	-175.2	68.2	26.4	0	0	0	114.7	E672 P673 S675 A696 T697 K700	E672-N678 PolarHBondContact OE1-ND2 3.48Å; P673-N678 PolarHBondContact O-ND2 2.76Å; S675-N678 PolarHBondContact N-OD1 3.15Å; S675-N678 PolarHBondContact O-N 3.47Å; S675-N678 PolarHBondContact O-OD1 2.81Å; S675-N678 PolarHBondContact OG-N 3.08Å; S675-N678 PolarHBondContact OG-ND2 3.14Å; N678-A696 CarbonylContact O-C 3.48Å; N678-A696 VanDerWaalsContact O-CA 3.26Å; N678-A696 WeakPolarHBondContact O-CA 3.49Å; N678-T697 HydrophobicContact CB-CG2 4.16Å; N678-T697 PolarHBondContact O-N 2.64Å; N678-K700 HydrophobicContact CB-CG 4.04Å
679	I	89.4	Confident	77	Confident	7 Å²	7	65.6 Å²	65.6	4%	0.036	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	135.7	177.3	-170.3	165.9	0	0	0	112.2	D674 S675 L681 V693 A696 K700 R704	D674-I679 HydrophobicContact CB-CG2 3.75Å; S675-I679 PolarHBondContact O-N 3.48Å; I679-L681 HydrophobicContact CD1-CD2 3.91Å; I679-L681 HydrophobicContact CG1-CD2 4.02Å; I679-L681 HydrophobicContact CG1-CG 4.47Å; I679-V693 HydrophobicContact CD1-CG2 4.28Å; I679-V693 HydrophobicContact CG1-CG1 4.43Å; I679-A696 HydrophobicContact CB-CB 4.24Å; I679-A696 HydrophobicContact CG1-CB 3.99Å; I679-K700 HydrophobicContact CB-CB 4.45Å; I679-K700 HydrophobicContact CB-CG 4.4Å; I679-R704 HydrophobicContact CD1-CG 3.82Å
680	V	88.1	Confident	76	Confident	47 Å²	47	60.5 Å²	60.5	29%	0.285	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	121.5	174.1	-179.4	0	0	0	0	108.7	R694 G695 L1103	V680-R694 HydrophobicContact CG1-CB 4.25Å; V680-R694 WeakPolarHBondContact O-CB 3.42Å; V680-R694 PolarHBondContact O-N 3.18Å; V680-G695 PolarHBondContact N-O 3.31Å; V680-G695 PolarHBondContact O-N 3.39Å; V680-L1103 HydrophobicContact CG2-CD1 3.78Å
681	L	85	Confident	75.1	Confident	62 Å²	62	61.8 Å²	61.8	33%	0.325	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	154	179	-56.7	174.2	0	0	0	110.5	I679 P691 V692 V693	I679-L681 HydrophobicContact CD1-CD2 3.91Å; I679-L681 HydrophobicContact CG1-CD2 4.02Å; I679-L681 HydrophobicContact CG1-CG 4.47Å; L681-P691 HydrophobicContact CD1-CB 4.13Å; L681-P691 HydrophobicContact CD2-CB 4.28Å; L681-V692 CarbonylContact C-O 3.45Å; L681-V692 WeakPolarHBondContact CA-O 3.17Å; L681-V693 HydrophobicContact CD2-CG2 4.06Å
682	E	80	Confident	74.9	Confident	68 Å²	68	62.4 Å²	62.4	32%	0.318	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-81.7	149.9	170.9	-61.3	-174.7	172.9	0	0	110.9	V692 R694 R1110	E682-V692 HydrophobicContact CB-CB 4.32Å; E682-V692 HydrophobicContact CG-CG1 4.38Å; E682-V692 PolarHBondContact N-O 3.31Å; E682-R694 HydrophobicContact CG-CB 3.77Å; E682-R694 HydrophobicContact CG-CG 4.24Å; E682-R1110 IonicContact OE1-CZ 2.83Å; E682-R1110 IonicContact OE1-NH1 3.43Å; E682-R1110 IonicContact OE1-NH2 3.45Å; E682-R1110 PolarHBondContact OE1-NH2 2.84Å; E682-R1110 IonicContact OE2-CZ 3.84Å; E682-R1110 IonicContact OE2-NH2 3.84Å; E682-R1110 PolarHBondContact OE2-NH2 3.28Å
683	D	64.3	Low	74.9	Confident	137 Å²	137	59 Å²	59	73%	0.733	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-56.7	143.6	177.1	-61.9	-37.4	0	0	0	110.9	T685	D683-T685 PolarHBondContact O-N 3.41Å; D683-T685 PolarHBondContact O-OG1 3Å
684	Y	56.1	Low	75	Confident	105 Å²	105	61.4 Å²	61.4	41%	0.412	33%	0.326	S	S	.	.	S	Bend	trans	-60.1	37.2	-169.3	-58.2	-79.4	0	0	0	117.2	Y30	Y30-Y684 HydrophobicContact CD1-CD1 4.04Å; Y30-Y684 HydrophobicContact CD1-CG 4.12Å; Y30-Y684 AromaticContact CE1-CD1 3.63Å; Y30-Y684 HydrophobicContact CE1-CD1 3.63Å; Y30-Y684 HydrophobicContact CE1-CG 4.02Å
685	T	50.3	Low	75.1	Confident	134 Å²	134	58.1 Å²	58.1	82%	0.822	31%	0.309	S	S	*	.			trans	-92.3	-1.8	-173.6	58.4	0	0	0	0	113.7	D683	D683-T685 PolarHBondContact O-N 3.41Å; D683-T685 PolarHBondContact O-OG1 3Å
686	S	54	Low	75.4	Confident	28 Å²	28	56 Å²	56	20%	0.196	29%	0.294	C	S	.	.			trans	-79.7	129.4	175.4	49	0	0	0	0	111.2	Y30 S688	Y30-S686 PolarHBondContact OH-O 3.21Å; S686-S688 PolarHBondContact O-N 3.39Å
687	S	52.8	Low	75.9	Confident	56 Å²	56	50.9 Å²	50.9	39%	0.392	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-18.6	171.8	17	0	0	0	0	113.7	G41 E1271	G41-S687 WeakPolarHBondContact CA-O 3.34Å; S687-E1271 PolarHBondContact OG-OE2 3.41Å
688	S	58.7	Low	76.4	Confident	38 Å²	38	45.9 Å²	45.9	27%	0.266	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-8.1	-168.4	58.4	0	0	0	0	116	S686 I690	S686-S688 PolarHBondContact O-N 3.39Å; S688-I690 PolarHBondContact O-N 2.68Å
689	G	61.8	Low	76.6	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.01	25%	0.252	C	S	.	.	S	Bend	trans	79.9	-36.2	-175.6	0	0	0	0	0	114.5	Y30 Q34	Y30-G689 WeakPolarHBondContact OH-CA 3.47Å; Y30-G689 PolarHBondContact OH-N 3.3Å; Y30-G689 PolarHBondContact OH-O 2.79Å; Q34-G689 PolarHBondContact NE2-O 3.02Å; Q34-G689 PolarHBondContact OE1-O 2.84Å
690	I	69.8	Low	76.8	Confident	13 Å²	13	47 Å²	47	7%	0.067	25%	0.251	C	S	.	.	S	Bend	trans	-74.2	129.1	-173.7	-59.7	168.5	0	0	0	112	S688 V692 Y710 D712	S688-I690 PolarHBondContact O-N 2.68Å; I690-V692 PolarHBondContact O-N 3.49Å; I690-Y710 HydrophobicContact CG1-CD2 4.37Å; I690-Y710 HydrophobicContact CG2-CD2 3.91Å; I690-Y710 HydrophobicContact CG2-CE2 3.67Å; I690-D712 HydrophobicContact CG2-CB 4.36Å
691	P	75	Confident	77.1	Confident	29 Å²	29	44.7 Å²	44.7	19%	0.188	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-59.8	126.4	172.5	-22.9	32.8	0	0	0	112.8	L681 Y710	L681-P691 HydrophobicContact CD1-CB 4.13Å; L681-P691 HydrophobicContact CD2-CB 4.28Å; P691-Y710 WeakPolarHBondContact CD-OH 3.5Å; P691-Y710 WeakPolarHBondContact CG-OH 3.47Å
692	V	83.8	Confident	77.6	Confident	32 Å²	32	41.8 Å²	41.8	19%	0.194	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-94.8	120.8	-178	179.4	0	0	0	0	110	L681 E682 I690 R694	L681-V692 CarbonylContact C-O 3.45Å; L681-V692 WeakPolarHBondContact CA-O 3.17Å; E682-V692 HydrophobicContact CB-CB 4.32Å; E682-V692 HydrophobicContact CG-CG1 4.38Å; E682-V692 PolarHBondContact N-O 3.31Å; I690-V692 PolarHBondContact O-N 3.49Å; V692-R694 PolarHBondContact O-N 2.9Å
693	V	88.8	Confident	78.3	Confident	5 Å²	5	39.2 Å²	39.2	3%	0.03	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	123.4	177.5	-175.8	0	0	0	0	110.4	I679 L681 A696 L701 R704 F715 F1106 R1110	I679-V693 HydrophobicContact CD1-CG2 4.28Å; I679-V693 HydrophobicContact CG1-CG1 4.43Å; L681-V693 HydrophobicContact CD2-CG2 4.06Å; V693-A696 HydrophobicContact CG1-CB 3.9Å; V693-L701 HydrophobicContact CG1-CD2 4.09Å; V693-R704 HydrophobicContact CG2-CB 4.44Å; V693-R704 HydrophobicContact CG2-CG 4.26Å; V693-F715 HydrophobicContact CB-CE2 4.03Å; V693-F715 HydrophobicContact CG2-CE2 3.89Å; V693-F1106 HydrophobicContact CG1-CB 4.27Å; V693-R1110 PolarHBondContact O-NH1 3.32Å
694	R	89.2	Confident	79.7	Confident	146 Å²	146	33.8 Å²	33.8	55%	0.551	18%	0.18	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86	-46.5	171.9	-169.8	177.7	176.3	162.9	-0.5	111	V680 E682 V692 F1106 A1107	V680-R694 HydrophobicContact CG1-CB 4.25Å; V680-R694 WeakPolarHBondContact O-CB 3.42Å; V680-R694 PolarHBondContact O-N 3.18Å; E682-R694 HydrophobicContact CG-CB 3.77Å; E682-R694 HydrophobicContact CG-CG 4.24Å; V692-R694 PolarHBondContact O-N 2.9Å; R694-F1106 PolarHBondContact O-N 3.33Å; R694-A1107 HydrophobicContact CG-CB 4.13Å; R694-A1107 PolarHBondContact O-N 2.98Å
695	G	89.6	Confident	81.4	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162	151.4	172	0	0	0	0	0	112.4	V680 I1104	V680-G695 PolarHBondContact N-O 3.31Å; V680-G695 PolarHBondContact O-N 3.39Å; G695-I1104 CarbonylContact C-O 3.46Å; G695-I1104 WeakPolarHBondContact CA-O 3.5Å
696	A	92.1	Very high	83.4	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	164	-175.6	0	0	0	0	0	111.6	N678 I679 V693 K700 L701 I1104	N678-A696 CarbonylContact O-C 3.48Å; N678-A696 VanDerWaalsContact O-CA 3.26Å; N678-A696 WeakPolarHBondContact O-CA 3.49Å; I679-A696 HydrophobicContact CB-CB 4.24Å; I679-A696 HydrophobicContact CG1-CB 3.99Å; V693-A696 HydrophobicContact CG1-CB 3.9Å; A696-K700 HydrophobicContact CB-CB 3.95Å; A696-L701 HydrophobicContact CB-CD2 3.86Å; A696-L701 HydrophobicContact CB-CG 3.99Å; A696-I1104 PolarHBondContact N-O 3.46Å; A696-I1104 VanDerWaalsContact N-O 3.08Å; A696-I1104 WeakPolarHBondContact O-CB 3.36Å; A696-I1104 PolarHBondContact O-N 3.37Å
697	T	93.1	Very high	85.1	Confident	23 Å²	23	23.2 Å²	23.2	14%	0.141	12%	0.12	C	C	.	.			trans	-65.8	159.1	166.1	62	0	0	0	0	110.5	N678 T699 K700 L701 L1103	N678-T697 HydrophobicContact CB-CG2 4.16Å; N678-T697 PolarHBondContact O-N 2.64Å; T697-T699 VanDerWaalsContact C-N 3.26Å; T697-T699 PolarHBondContact O-N 3.23Å; T697-K700 PolarHBondContact O-N 2.94Å; T697-K700 VanDerWaalsContact O-N 3.16Å; T697-K700 PolarHBondContact OG1-N 2.92Å; T697-L701 WeakPolarHBondContact O-CG 3.42Å; T697-L701 PolarHBondContact O-N 2.97Å; T697-L1103 HydrophobicContact CG2-CD2 4.06Å
698	L	93.5	Very high	86.6	Confident	28 Å²	28	22.6 Å²	22.6	15%	0.147	11%	0.111	C	C	.	.	H	α-helix	trans	-57	-41.9	177.7	-178.2	57.5	0	0	0	111.5	K700 L701 I702 F726 C727 L735 I1104	L698-K700 PolarHBondContact O-N 3.43Å; L698-L701 PolarHBondContact O-N 3.41Å; L698-I702 HydrophobicContact CD1-CG1 4.44Å; L698-I702 WeakPolarHBondContact O-CG1 3.3Å; L698-I702 PolarHBondContact O-N 2.81Å; L698-F726 HydrophobicContact CD1-CD2 4.2Å; L698-F726 HydrophobicContact CD1-CE2 4.08Å; L698-C727 HydrophobicContact CD1-CB 3.95Å; L698-C727 HydrophobicContact CD2-CB 4.08Å; L698-L735 HydrophobicContact CD1-CD1 4.41Å; L698-L735 HydrophobicContact CD2-CD1 3.57Å; L698-L735 HydrophobicContact CG-CD1 3.74Å; L698-I1104 HydrophobicContact CB-CD1 3.99Å; L698-I1104 HydrophobicContact CD1-CD1 4.44Å
699	T	93.4	Very high	87.5	Confident	31 Å²	31	24.6 Å²	24.6	19%	0.19	12%	0.118	C	C	.	.	H	α-helix	trans	-55.5	-48.8	175.4	-49.4	0	0	0	0	111.9	R669 F670 T697 I702 E703	R669-T699 HydrophobicContact CG-CG2 3.87Å; F670-T699 HydrophobicContact CD1-CG2 3.59Å; F670-T699 HydrophobicContact CE1-CG2 3.87Å; F670-T699 HydrophobicContact CG-CG2 4.33Å; T697-T699 VanDerWaalsContact C-N 3.26Å; T697-T699 PolarHBondContact O-N 3.23Å; T699-I702 PolarHBondContact O-N 3.43Å; T699-E703 PolarHBondContact O-N 3.39Å
700	K	94	Very high	88.1	Confident	3 Å²	3	25.9 Å²	25.9	1%	0.013	12%	0.123	C	C	.	.	H	α-helix	trans	-69.2	-32.9	178.8	-76	-66.9	178.7	-175.4	0	113.1	E672 D674 N678 I679 A696 T697 L698 E703 R704	E672-K700 WeakPolarHBondContact O-CE 3.35Å; E672-K700 PolarHBondContact O-NZ 3.28Å; D674-K700 VanDerWaalsContact OD1-CE 3.26Å; D674-K700 WeakPolarHBondContact OD1-CE 3.36Å; D674-K700 IonicContact OD1-NZ 3.77Å; D674-K700 PolarHBondContact OD1-NZ 2.8Å; N678-K700 HydrophobicContact CB-CG 4.04Å; I679-K700 HydrophobicContact CB-CB 4.45Å; I679-K700 HydrophobicContact CB-CG 4.4Å; A696-K700 HydrophobicContact CB-CB 3.95Å; T697-K700 PolarHBondContact O-N 2.94Å; T697-K700 VanDerWaalsContact O-N 3.16Å; T697-K700 PolarHBondContact OG1-N 2.92Å; L698-K700 PolarHBondContact O-N 3.43Å; K700-E703 VanDerWaalsContact CD-OE2 3.24Å; K700-E703 WeakPolarHBondContact CD-OE2 3.13Å; K700-E703 WeakPolarHBondContact CE-OE2 3.43Å; K700-E703 IonicContact NZ-OE1 3.44Å; K700-E703 IonicContact NZ-OE2 3.22Å; K700-E703 PolarHBondContact NZ-OE2 3.3Å; K700-E703 PolarHBondContact O-N 2.98Å; K700-R704 WeakPolarHBondContact O-CB 2.92Å; K700-R704 WeakPolarHBondContact O-CG 3.04Å; K700-R704 PolarHBondContact O-N 2.88Å
701	L	94.7	Very high	88.4	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.2	-42.8	172.1	-69.6	177.6	0	0	0	111.6	V693 A696 T697 L698 R704 L705 F715 F719 F726 I1104 F1106	V693-L701 HydrophobicContact CG1-CD2 4.09Å; A696-L701 HydrophobicContact CB-CD2 3.86Å; A696-L701 HydrophobicContact CB-CG 3.99Å; T697-L701 WeakPolarHBondContact O-CG 3.42Å; T697-L701 PolarHBondContact O-N 2.97Å; L698-L701 PolarHBondContact O-N 3.41Å; L701-R704 PolarHBondContact O-N 3.38Å; L701-L705 WeakPolarHBondContact O-CB 3.37Å; L701-L705 PolarHBondContact O-N 3.33Å; L701-F715 HydrophobicContact CD2-CE2 4.29Å; L701-F715 HydrophobicContact CD2-CZ 3.81Å; L701-F719 HydrophobicContact CB-CD2 4.49Å; L701-F719 HydrophobicContact CB-CE2 4Å; L701-F719 HydrophobicContact CD1-CE2 4.43Å; L701-F726 HydrophobicContact CD1-CE2 4.05Å; L701-F726 HydrophobicContact CD1-CZ 4.15Å; L701-I1104 HydrophobicContact CD1-CB 4.01Å; L701-I1104 HydrophobicContact CD1-CD1 3.9Å; L701-I1104 HydrophobicContact CD1-CG2 4.04Å; L701-F1106 HydrophobicContact CD1-CD2 4.33Å; L701-F1106 HydrophobicContact CD2-CB 4.17Å; L701-F1106 HydrophobicContact CD2-CD2 3.8Å; L701-F1106 HydrophobicContact CD2-CE2 4.45Å; L701-F1106 HydrophobicContact CD2-CG 4.05Å
702	I	95.6	Very high	88.6	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-68	-38.4	176.6	-61.6	-60.2	0	0	0	111.5	F670 L698 T699 L705 T706 F719 L732 L735 L736 R739	F670-I702 HydrophobicContact CE1-CB 3.92Å; F670-I702 HydrophobicContact CE1-CG2 3.73Å; F670-I702 HydrophobicContact CZ-CG2 4.16Å; L698-I702 HydrophobicContact CD1-CG1 4.44Å; L698-I702 WeakPolarHBondContact O-CG1 3.3Å; L698-I702 PolarHBondContact O-N 2.81Å; T699-I702 PolarHBondContact O-N 3.43Å; I702-L705 HydrophobicContact CD1-CD2 4.1Å; I702-L705 WeakPolarHBondContact O-CB 3.2Å; I702-L705 PolarHBondContact O-N 3.26Å; I702-T706 PolarHBondContact O-N 3.1Å; I702-T706 VanDerWaalsContact O-N 3.16Å; I702-T706 PolarHBondContact O-OG1 2.64Å; I702-F719 HydrophobicContact CD1-CE1 4.19Å; I702-F719 HydrophobicContact CD1-CE2 4.21Å; I702-F719 HydrophobicContact CD1-CZ 3.56Å; I702-L732 HydrophobicContact CD1-CD1 3.45Å; I702-L732 VanDerWaalsContact CD1-CD1 3.45Å; I702-L735 HydrophobicContact CG1-CB 4.22Å; I702-L735 HydrophobicContact CG1-CD1 4.2Å; I702-L736 HydrophobicContact CG2-CD2 4.4Å; I702-R739 HydrophobicContact CG2-CB 4.24Å; I702-R739 HydrophobicContact CG2-CG 4.29Å
703	E	94.5	Very high	88.4	Confident	14 Å²	14	30.3 Å²	30.3	7%	0.065	15%	0.15	C	C	.	.	H	α-helix	trans	-59.6	-48.7	173.2	-170.8	-163.1	141.5	0	0	111.3	F670 T699 K700 L705 T706 Y707	F670-E703 HydrophobicContact CD1-CB 4.41Å; T699-E703 PolarHBondContact O-N 3.39Å; K700-E703 VanDerWaalsContact CD-OE2 3.24Å; K700-E703 WeakPolarHBondContact CD-OE2 3.13Å; K700-E703 WeakPolarHBondContact CE-OE2 3.43Å; K700-E703 IonicContact NZ-OE1 3.44Å; K700-E703 IonicContact NZ-OE2 3.22Å; K700-E703 PolarHBondContact NZ-OE2 3.3Å; K700-E703 PolarHBondContact O-N 2.98Å; E703-L705 VanDerWaalsContact C-N 3.34Å; E703-T706 CarbonylContact O-C 3.31Å; E703-T706 PolarHBondContact O-N 3.41Å; E703-Y707 HydrophobicContact CG-CD2 4.47Å; E703-Y707 WeakPolarHBondContact O-CA 3.38Å; E703-Y707 PolarHBondContact O-N 2.88Å
704	R	92.1	Very high	88.2	Confident	24 Å²	24	34.5 Å²	34.5	9%	0.091	17%	0.168	C	C	.	.	H	α-helix	trans	-70.8	-27.8	178.2	-66.8	-62.6	-175.1	136.5	-0.8	113.2	D674 I679 V693 K700 L701 T706 Y710 F715	D674-R704 IonicContact OD2-CZ 3.67Å; D674-R704 IonicContact OD2-NH2 3.92Å; D674-R704 PolarHBondContact OD2-NH2 3.26Å; I679-R704 HydrophobicContact CD1-CG 3.82Å; V693-R704 HydrophobicContact CG2-CB 4.44Å; V693-R704 HydrophobicContact CG2-CG 4.26Å; K700-R704 WeakPolarHBondContact O-CB 2.92Å; K700-R704 WeakPolarHBondContact O-CG 3.04Å; K700-R704 PolarHBondContact O-N 2.88Å; L701-R704 PolarHBondContact O-N 3.38Å; R704-T706 PolarHBondContact O-N 3.49Å; R704-Y710 PolarHBondContact NH1-OH 3.04Å; R704-F715 HydrophobicContact CB-CZ 4.29Å
705	L	93.2	Very high	88.3	Confident	9 Å²	9	28.2 Å²	28.2	5%	0.047	15%	0.145	C	C	.	.	H	α-helix	trans	-62.8	-30.8	171.4	-171.6	65.8	0	0	0	111.9	L701 I702 E703 F715 V716 F719 L736 V810	L701-L705 WeakPolarHBondContact O-CB 3.37Å; L701-L705 PolarHBondContact O-N 3.33Å; I702-L705 HydrophobicContact CD1-CD2 4.1Å; I702-L705 WeakPolarHBondContact O-CB 3.2Å; I702-L705 PolarHBondContact O-N 3.26Å; E703-L705 VanDerWaalsContact C-N 3.34Å; L705-F715 HydrophobicContact CB-CD1 4.33Å; L705-F715 HydrophobicContact CB-CE1 3.9Å; L705-F715 HydrophobicContact CD1-CD1 3.78Å; L705-F715 HydrophobicContact CD1-CE1 3.93Å; L705-V716 HydrophobicContact CD1-CB 4.03Å; L705-V716 HydrophobicContact CD1-CG1 4.07Å; L705-V716 HydrophobicContact CD1-CG2 3.76Å; L705-F719 HydrophobicContact CD1-CB 3.82Å; L705-F719 HydrophobicContact CD1-CD1 4.09Å; L705-F719 HydrophobicContact CD1-CG 3.9Å; L705-F719 HydrophobicContact CD2-CD1 3.7Å; L705-F719 HydrophobicContact CD2-CE1 3.78Å; L705-F719 HydrophobicContact CD2-CG 4.13Å; L705-F719 HydrophobicContact CD2-CZ 4.25Å; L705-L736 HydrophobicContact CD2-CD2 4.41Å; L705-V810 HydrophobicContact CD1-CG2 4.32Å; L705-V810 HydrophobicContact CD2-CG1 3.94Å; L705-V810 HydrophobicContact CD2-CG2 4.29Å; L705-V810 HydrophobicContact CG-CG1 4.39Å; L705-V810 HydrophobicContact CG-CG2 3.88Å
706	T	92.7	Very high	88.3	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.2	45.2	-175.7	58.5	0	0	0	0	110.9	I702 E703 R704 L736 R739 V807 V810	I702-T706 PolarHBondContact O-N 3.1Å; I702-T706 VanDerWaalsContact O-N 3.16Å; I702-T706 PolarHBondContact O-OG1 2.64Å; E703-T706 CarbonylContact O-C 3.31Å; E703-T706 PolarHBondContact O-N 3.41Å; R704-T706 PolarHBondContact O-N 3.49Å; T706-L736 HydrophobicContact CG2-CD2 4.37Å; T706-R739 PolarHBondContact O-NH2 3.43Å; T706-R739 VanDerWaalsContact OG1-CG 3.3Å; T706-R739 WeakPolarHBondContact OG1-CG 3.47Å; T706-R739 PolarHBondContact OG1-NE 3.47Å; T706-V807 HydrophobicContact CG2-CB 4.5Å; T706-V807 HydrophobicContact CG2-CG2 3.78Å; T706-V810 HydrophobicContact CG2-CG2 4.18Å
707	Y	89.6	Confident	88.2	Confident	35 Å²	35	33.6 Å²	33.6	14%	0.137	17%	0.166	C	C	.	.			trans	-74.9	130	-173.9	-157.5	-121.2	0	0	0	110.9	E703 I709 Y710	E703-Y707 HydrophobicContact CG-CD2 4.47Å; E703-Y707 WeakPolarHBondContact O-CA 3.38Å; E703-Y707 PolarHBondContact O-N 2.88Å; Y707-I709 VanDerWaalsContact C-N 3.29Å; Y707-I709 HydrophobicContact CD1-CB 3.91Å; Y707-I709 HydrophobicContact CD1-CG1 4.23Å; Y707-I709 HydrophobicContact CE1-CB 3.71Å; Y707-I709 HydrophobicContact CE1-CD1 3.71Å; Y707-I709 HydrophobicContact CE1-CG1 3.71Å; Y707-I709 PolarHBondContact O-N 3.31Å; Y707-Y710 HydrophobicContact CD1-CD1 4.11Å; Y707-Y710 HydrophobicContact CD1-CD2 4.26Å; Y707-Y710 AromaticContact CD1-CE1 3.71Å; Y707-Y710 HydrophobicContact CD1-CE1 3.71Å; Y707-Y710 AromaticContact CD1-CE2 3.85Å; Y707-Y710 HydrophobicContact CD1-CE2 3.85Å; Y707-Y710 HydrophobicContact CD1-CG 4.35Å; Y707-Y710 AromaticContact CD1-CZ 3.55Å; Y707-Y710 HydrophobicContact CE1-CD1 4.24Å; Y707-Y710 AromaticContact CE1-CE1 3.56Å; Y707-Y710 HydrophobicContact CE1-CE1 3.56Å; Y707-Y710 HydrophobicContact CE1-CE2 4.4Å; Y707-Y710 AromaticContact CE1-CZ 3.63Å
708	H	83.6	Confident	88.2	Confident	43 Å²	43	32.8 Å²	32.8	20%	0.199	16%	0.161	C	C	.	.	S	Bend	trans	-72.7	-17.8	-172	64.3	-74.1	0	0	0	114.5	Y799 P802 V803	H708-Y799 HydrophobicContact CB-CD2 4.19Å; H708-Y799 AromaticContact CD2-CD2 3.64Å; H708-Y799 AromaticContact CE1-CD2 3.76Å; H708-Y799 AromaticContact CE1-CE2 3.66Å; H708-Y799 AromaticContact CG-CD2 3.58Å; H708-Y799 AromaticContact CG-CE2 3.93Å; H708-Y799 AromaticContact ND1-CD2 3.66Å; H708-Y799 AromaticContact ND1-CE2 3.52Å; H708-Y799 AromaticContact NE2-CD2 3.75Å; H708-P802 HydrophobicContact CB-CB 4.16Å; H708-V803 HydrophobicContact CB-CG2 3.9Å
709	I	77.2	Confident	88.2	Confident	80 Å²	80	31.4 Å²	31.4	41%	0.41	15%	0.154	S	C	.	.	S	Bend	trans	-90.4	-41.4	-174.3	-52.4	-175.5	0	0	0	111.9	P38 Y707	P38-I709 HydrophobicContact CB-CG2 3.42Å; P38-I709 VanDerWaalsContact CB-CG2 3.42Å; P38-I709 HydrophobicContact CG-CG2 3.97Å; Y707-I709 VanDerWaalsContact C-N 3.29Å; Y707-I709 HydrophobicContact CD1-CB 3.91Å; Y707-I709 HydrophobicContact CD1-CG1 4.23Å; Y707-I709 HydrophobicContact CE1-CB 3.71Å; Y707-I709 HydrophobicContact CE1-CD1 3.71Å; Y707-I709 HydrophobicContact CE1-CG1 3.71Å; Y707-I709 PolarHBondContact O-N 3.31Å
710	Y	75.2	Confident	88.3	Confident	28 Å²	28	30 Å²	30	11%	0.11	15%	0.145	C	C	.	.			trans	-149.5	140.8	-178.8	49.4	-99.4	0	0	0	111.6	P38 I690 P691 R704 Y707	P38-Y710 HydrophobicContact CB-CD1 4.43Å; I690-Y710 HydrophobicContact CG1-CD2 4.37Å; I690-Y710 HydrophobicContact CG2-CD2 3.91Å; I690-Y710 HydrophobicContact CG2-CE2 3.67Å; P691-Y710 WeakPolarHBondContact CD-OH 3.5Å; P691-Y710 WeakPolarHBondContact CG-OH 3.47Å; R704-Y710 PolarHBondContact NH1-OH 3.04Å; Y707-Y710 HydrophobicContact CD1-CD1 4.11Å; Y707-Y710 HydrophobicContact CD1-CD2 4.26Å; Y707-Y710 AromaticContact CD1-CE1 3.71Å; Y707-Y710 HydrophobicContact CD1-CE1 3.71Å; Y707-Y710 AromaticContact CD1-CE2 3.85Å; Y707-Y710 HydrophobicContact CD1-CE2 3.85Å; Y707-Y710 HydrophobicContact CD1-CG 4.35Å; Y707-Y710 AromaticContact CD1-CZ 3.55Å; Y707-Y710 HydrophobicContact CE1-CD1 4.24Å; Y707-Y710 AromaticContact CE1-CE1 3.56Å; Y707-Y710 HydrophobicContact CE1-CE1 3.56Å; Y707-Y710 HydrophobicContact CE1-CE2 4.4Å; Y707-Y710 AromaticContact CE1-CZ 3.63Å
711	P	74.7	Confident	88.1	Confident	69 Å²	69	30.3 Å²	30.3	45%	0.448	15%	0.148	S	C	.	.			trans	-85.5	130.9	174.2	31.6	-32.7	0	0	0	112
712	D	79.6	Confident	88	Confident	39 Å²	39	30.4 Å²	30.4	21%	0.209	15%	0.148	C	C	.	.			trans	-111.7	95.1	171.3	-173.5	-14.9	0	0	0	111.7	I690 K714 F715 V716	I690-D712 HydrophobicContact CG2-CB 4.36Å; D712-K714 VanDerWaalsContact C-N 3.28Å; D712-K714 PolarHBondContact O-N 2.81Å; D712-K714 WeakPolarHBondContact OD1-CA 3.3Å; D712-K714 WeakPolarHBondContact OD1-CB 3.38Å; D712-K714 PolarHBondContact OD1-N 2.85Å; D712-F715 HydrophobicContact CB-CB 3.72Å; D712-F715 PolarHBondContact O-N 3.44Å; D712-F715 PolarHBondContact OD1-N 3.29Å; D712-F715 WeakPolarHBondContact OD2-CB 3.37Å; D712-V716 WeakPolarHBondContact O-CG2 3.41Å; D712-V716 PolarHBondContact O-N 2.79Å
713	T	80.9	Confident	87.9	Confident	59 Å²	59	30.4 Å²	30.4	36%	0.362	15%	0.148	S	C	.	.	H	α-helix	trans	-66.2	-27.8	-180	63.8	0	0	0	0	113.7	R717	T713-R717 WeakPolarHBondContact O-CG 3.2Å; T713-R717 PolarHBondContact O-N 3.31Å; T713-R717 VanDerWaalsContact O-N 3.09Å
714	K	84	Confident	87.8	Confident	94 Å²	94	31.4 Å²	31.4	41%	0.409	15%	0.151	S	C	.	.	H	α-helix	trans	-73.6	-41	177.5	-174.6	179.5	-180	179.4	0	109.7	D712 R717 T718	D712-K714 VanDerWaalsContact C-N 3.28Å; D712-K714 PolarHBondContact O-N 2.81Å; D712-K714 WeakPolarHBondContact OD1-CA 3.3Å; D712-K714 WeakPolarHBondContact OD1-CB 3.38Å; D712-K714 PolarHBondContact OD1-N 2.85Å; K714-R717 PolarHBondContact O-N 2.96Å; K714-T718 WeakPolarHBondContact O-CB 3.4Å; K714-T718 PolarHBondContact O-N 3.35Å; K714-T718 PolarHBondContact O-OG1 2.65Å
715	F	90.9	Very high	87.5	Confident	13 Å²	13	31.9 Å²	31.9	6%	0.057	16%	0.158	C	C	.	.	H	α-helix	trans	-59.7	-47.9	172.4	-171.5	-86.3	0	0	0	111.3	V693 L701 R704 L705 D712 R717 T718 F719 F1106	V693-F715 HydrophobicContact CB-CE2 4.03Å; V693-F715 HydrophobicContact CG2-CE2 3.89Å; L701-F715 HydrophobicContact CD2-CE2 4.29Å; L701-F715 HydrophobicContact CD2-CZ 3.81Å; R704-F715 HydrophobicContact CB-CZ 4.29Å; L705-F715 HydrophobicContact CB-CD1 4.33Å; L705-F715 HydrophobicContact CB-CE1 3.9Å; L705-F715 HydrophobicContact CD1-CD1 3.78Å; L705-F715 HydrophobicContact CD1-CE1 3.93Å; D712-F715 HydrophobicContact CB-CB 3.72Å; D712-F715 PolarHBondContact O-N 3.44Å; D712-F715 PolarHBondContact OD1-N 3.29Å; D712-F715 WeakPolarHBondContact OD2-CB 3.37Å; F715-R717 PolarHBondContact O-N 3.37Å; F715-T718 PolarHBondContact O-N 3.13Å; F715-F719 HydrophobicContact CE1-CB 4.45Å; F715-F719 HydrophobicContact CE1-CD2 4.31Å; F715-F719 VanDerWaalsContact O-CB 3.31Å; F715-F719 WeakPolarHBondContact O-CB 3.43Å; F715-F719 PolarHBondContact O-N 3.35Å; F715-F1106 HydrophobicContact CD1-CZ 4.43Å; F715-F1106 AromaticContact CD2-CD1 3.99Å; F715-F1106 HydrophobicContact CD2-CD1 3.99Å; F715-F1106 AromaticContact CD2-CE1 3.28Å; F715-F1106 HydrophobicContact CD2-CE1 3.28Å; F715-F1106 AromaticContact CD2-CZ 3.7Å; F715-F1106 HydrophobicContact CD2-CZ 3.7Å; F715-F1106 HydrophobicContact CE1-CZ 4.28Å; F715-F1106 AromaticContact CE2-CD1 3.6Å; F715-F1106 HydrophobicContact CE2-CD1 3.6Å; F715-F1106 HydrophobicContact CE2-CD2 4.41Å; F715-F1106 AromaticContact CE2-CE1 3.24Å; F715-F1106 HydrophobicContact CE2-CE1 3.24Å; F715-F1106 HydrophobicContact CE2-CE2 4.12Å; F715-F1106 HydrophobicContact CE2-CG 4.17Å; F715-F1106 AromaticContact CE2-CZ 3.52Å; F715-F1106 HydrophobicContact CE2-CZ 3.52Å; F715-F1106 HydrophobicContact CG-CE1 4.1Å; F715-F1106 HydrophobicContact CG-CZ 4.16Å; F715-F1106 HydrophobicContact CZ-CD1 4.46Å; F715-F1106 HydrophobicContact CZ-CE1 4.04Å; F715-F1106 HydrophobicContact CZ-CE2 4.13Å; F715-F1106 AromaticContact CZ-CZ 3.84Å; F715-F1106 HydrophobicContact CZ-CZ 3.84Å
716	V	91	Very high	87.4	Confident	11 Å²	11	32.7 Å²	32.7	7%	0.067	16%	0.161	C	C	.	.	H	α-helix	trans	-60.9	-44.9	178.4	-174.4	0	0	0	0	111.8	L705 D712 T718 F719 L720 V810	L705-V716 HydrophobicContact CD1-CB 4.03Å; L705-V716 HydrophobicContact CD1-CG1 4.07Å; L705-V716 HydrophobicContact CD1-CG2 3.76Å; D712-V716 WeakPolarHBondContact O-CG2 3.41Å; D712-V716 PolarHBondContact O-N 2.79Å; V716-T718 PolarHBondContact O-N 3.47Å; V716-F719 PolarHBondContact O-N 3.11Å; V716-L720 HydrophobicContact CG1-CD1 3.85Å; V716-L720 HydrophobicContact CG1-CG 4.25Å; V716-L720 WeakPolarHBondContact O-CB 3.29Å; V716-L720 WeakPolarHBondContact O-CG 3.18Å; V716-L720 PolarHBondContact O-N 3.2Å; V716-V810 HydrophobicContact CG1-CG1 4.49Å; V716-V810 HydrophobicContact CG1-CG2 3.96Å; V716-V810 HydrophobicContact CG2-CG2 4.24Å
717	R	89.3	Confident	87.3	Confident	102 Å²	102	33 Å²	33	39%	0.385	16%	0.163	S	C	.	.	H	α-helix	trans	-59.6	-45.3	175.1	-76.9	175.6	-179.1	157	3.2	112	T713 K714 F715 T721 Q813	T713-R717 WeakPolarHBondContact O-CG 3.2Å; T713-R717 PolarHBondContact O-N 3.31Å; T713-R717 VanDerWaalsContact O-N 3.09Å; K714-R717 PolarHBondContact O-N 2.96Å; F715-R717 PolarHBondContact O-N 3.37Å; R717-T721 WeakPolarHBondContact O-CB 3.29Å; R717-T721 PolarHBondContact O-N 3.35Å; R717-T721 PolarHBondContact O-OG1 2.72Å; R717-Q813 VanDerWaalsContact CG-NE2 3.28Å
718	T	92.2	Very high	87.5	Confident	6 Å²	6	35 Å²	35	4%	0.037	18%	0.179	C	C	.	.	H	α-helix	trans	-61.2	-52	178.3	-58.3	0	0	0	0	110.4	K714 F715 V716 T721 T722 F1106 C1109 R1110 A1113	K714-T718 WeakPolarHBondContact O-CB 3.4Å; K714-T718 PolarHBondContact O-N 3.35Å; K714-T718 PolarHBondContact O-OG1 2.65Å; F715-T718 PolarHBondContact O-N 3.13Å; V716-T718 PolarHBondContact O-N 3.47Å; T718-T721 WeakPolarHBondContact O-CB 3.45Å; T718-T721 PolarHBondContact O-N 3.23Å; T718-T722 PolarHBondContact O-N 3.49Å; T718-T722 PolarHBondContact O-OG1 2.97Å; T718-F1106 HydrophobicContact CG2-CE1 3.76Å; T718-F1106 HydrophobicContact CG2-CE2 4.26Å; T718-F1106 HydrophobicContact CG2-CZ 3.54Å; T718-C1109 HydrophobicContact CG2-CB 4.41Å; T718-R1110 HydrophobicContact CG2-CB 4.12Å; T718-A1113 HydrophobicContact CG2-CB 3.83Å
719	F	94.9	Very high	87.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-58.4	-54.2	-178.3	-174.2	-81.8	0	0	0	111.8	L701 I702 L705 F715 V716 T721 T722 F723 F726 L732 F1106	L701-F719 HydrophobicContact CB-CD2 4.49Å; L701-F719 HydrophobicContact CB-CE2 4Å; L701-F719 HydrophobicContact CD1-CE2 4.43Å; I702-F719 HydrophobicContact CD1-CE1 4.19Å; I702-F719 HydrophobicContact CD1-CE2 4.21Å; I702-F719 HydrophobicContact CD1-CZ 3.56Å; L705-F719 HydrophobicContact CD1-CB 3.82Å; L705-F719 HydrophobicContact CD1-CD1 4.09Å; L705-F719 HydrophobicContact CD1-CG 3.9Å; L705-F719 HydrophobicContact CD2-CD1 3.7Å; L705-F719 HydrophobicContact CD2-CE1 3.78Å; L705-F719 HydrophobicContact CD2-CG 4.13Å; L705-F719 HydrophobicContact CD2-CZ 4.25Å; F715-F719 HydrophobicContact CE1-CB 4.45Å; F715-F719 HydrophobicContact CE1-CD2 4.31Å; F715-F719 VanDerWaalsContact O-CB 3.31Å; F715-F719 WeakPolarHBondContact O-CB 3.43Å; F715-F719 PolarHBondContact O-N 3.35Å; V716-F719 PolarHBondContact O-N 3.11Å; F719-T721 PolarHBondContact O-N 2.92Å; F719-T722 PolarHBondContact O-N 3.13Å; F719-T722 VanDerWaalsContact O-N 3.09Å; F719-F723 HydrophobicContact CD1-CB 4.09Å; F719-F723 HydrophobicContact CE1-CB 3.71Å; F719-F723 HydrophobicContact CE1-CG 4.22Å; F719-F723 HydrophobicContact CZ-CB 3.95Å; F719-F723 WeakPolarHBondContact O-CB 3.45Å; F719-F723 PolarHBondContact O-N 3.41Å; F719-F726 HydrophobicContact CD2-CZ 4.27Å; F719-F726 AromaticContact CE2-CE2 3.93Å; F719-F726 HydrophobicContact CE2-CE2 3.93Å; F719-F726 AromaticContact CE2-CZ 3.98Å; F719-F726 HydrophobicContact CE2-CZ 3.98Å; F719-F726 HydrophobicContact CZ-CE2 4.27Å; F719-L732 HydrophobicContact CE1-CD1 3.59Å; F719-L732 HydrophobicContact CE1-CD2 3.99Å; F719-L732 HydrophobicContact CE1-CG 4.47Å; F719-L732 HydrophobicContact CZ-CD1 3.9Å; F719-F1106 HydrophobicContact CB-CE2 4.19Å; F719-F1106 HydrophobicContact CB-CZ 4.16Å; F719-F1106 HydrophobicContact CD2-CE2 4.01Å
720	L	93.7	Very high	88.7	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.3	-26.5	-178.7	-70.1	177.3	0	0	0	113.2	V716 F723 R724 V810 Q813 W814 H818	V716-L720 HydrophobicContact CG1-CD1 3.85Å; V716-L720 HydrophobicContact CG1-CG 4.25Å; V716-L720 WeakPolarHBondContact O-CB 3.29Å; V716-L720 WeakPolarHBondContact O-CG 3.18Å; V716-L720 PolarHBondContact O-N 3.2Å; L720-F723 WeakPolarHBondContact O-CD1 3.43Å; L720-R724 PolarHBondContact O-NH1 3.36Å; L720-V810 HydrophobicContact CD2-CG1 4.14Å; L720-Q813 HydrophobicContact CD1-CB 3.89Å; L720-Q813 HydrophobicContact CD1-CG 3.81Å; L720-W814 HydrophobicContact CD1-CB 4.29Å; L720-W814 HydrophobicContact CD2-CB 4.03Å; L720-W814 HydrophobicContact CD2-CD2 4.36Å; L720-W814 HydrophobicContact CD2-CG 3.99Å; L720-H818 PolarHBondContact O-CE1 3.4Å
721	T	91.5	Very high	89.6	Confident	11 Å²	11	36.3 Å²	36.3	7%	0.067	19%	0.19	C	C	.	.	H	α-helix	trans	-72	-44.3	173.9	-58.5	0	0	0	0	111.2	R717 T718 F719 P932 I1116	R717-T721 WeakPolarHBondContact O-CB 3.29Å; R717-T721 PolarHBondContact O-N 3.35Å; R717-T721 PolarHBondContact O-OG1 2.72Å; T718-T721 WeakPolarHBondContact O-CB 3.45Å; T718-T721 PolarHBondContact O-N 3.23Å; F719-T721 PolarHBondContact O-N 2.92Å; T721-P932 HydrophobicContact CG2-CB 4.03Å; T721-I1116 HydrophobicContact CG2-CB 4.38Å; T721-I1116 HydrophobicContact CG2-CD1 3.77Å; T721-I1116 HydrophobicContact CG2-CG2 4.03Å
722	T	92.6	Very high	90.7	Very high	2 Å²	2	33 Å²	33	1%	0.012	17%	0.169	C	C	.	.	H	α-helix	trans	-109.7	-9.2	-166	61.7	0	0	0	0	116.5	T718 F719 R724 S725 V936 C1109 A1113	T718-T722 PolarHBondContact O-N 3.49Å; T718-T722 PolarHBondContact O-OG1 2.97Å; F719-T722 PolarHBondContact O-N 3.13Å; F719-T722 VanDerWaalsContact O-N 3.09Å; T722-R724 PolarHBondContact O-N 2.67Å; T722-R724 VanDerWaalsContact O-N 3.08Å; T722-S725 WeakPolarHBondContact O-CB 3.37Å; T722-S725 PolarHBondContact O-N 3.13Å; T722-S725 PolarHBondContact O-OG 2.79Å; T722-V936 HydrophobicContact CG2-CG2 4.44Å; T722-C1109 HydrophobicContact CG2-CB 4.25Å; T722-C1109 WeakPolarHBondContact OG1-CB 3.42Å; T722-A1113 HydrophobicContact CG2-CB 4.18Å
723	F	93.4	Very high	91.4	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-57.2	-30.9	-170.5	78.6	-87.1	0	0	0	114.6	F719 L720 S725 F726 C727 Q729 L732 W814	F719-F723 HydrophobicContact CD1-CB 4.09Å; F719-F723 HydrophobicContact CE1-CB 3.71Å; F719-F723 HydrophobicContact CE1-CG 4.22Å; F719-F723 HydrophobicContact CZ-CB 3.95Å; F719-F723 WeakPolarHBondContact O-CB 3.45Å; F719-F723 PolarHBondContact O-N 3.41Å; L720-F723 WeakPolarHBondContact O-CD1 3.43Å; F723-S725 PolarHBondContact O-N 3.1Å; F723-F726 HydrophobicContact CB-CE2 4.06Å; F723-F726 HydrophobicContact CB-CZ 3.96Å; F723-F726 PolarHBondContact O-N 3.3Å; F723-C727 HydrophobicContact CD2-CB 4.37Å; F723-C727 WeakPolarHBondContact CD2-O 3.38Å; F723-C727 PolarHBondContact O-N 3.24Å; F723-Q729 HydrophobicContact CE2-CG 4.28Å; F723-Q729 HydrophobicContact CZ-CG 4.14Å; F723-L732 HydrophobicContact CD1-CD2 4.08Å; F723-L732 HydrophobicContact CD2-CB 4.36Å; F723-L732 HydrophobicContact CD2-CD2 3.75Å; F723-L732 HydrophobicContact CE1-CD2 3.95Å; F723-L732 HydrophobicContact CE2-CB 4.21Å; F723-L732 HydrophobicContact CE2-CD2 3.65Å; F723-L732 HydrophobicContact CG-CD2 3.97Å; F723-L732 HydrophobicContact CZ-CD2 3.74Å; F723-W814 AromaticContact CZ-CZ2 3.84Å; F723-W814 HydrophobicContact CZ-CZ2 3.84Å
724	R	90.8	Very high	92.2	Very high	35 Å²	35	32.2 Å²	32.2	13%	0.132	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-58.6	-10.2	178.1	-62.1	174.7	-163.9	71.6	0.2	114	L720 T722 C727 Y820 D821	L720-R724 PolarHBondContact O-NH1 3.36Å; T722-R724 PolarHBondContact O-N 2.67Å; T722-R724 VanDerWaalsContact O-N 3.08Å; R724-C727 WeakPolarHBondContact CA-O 3.5Å; R724-Y820 PolarHBondContact NH2-OH 3.24Å; R724-Y820 VanDerWaalsContact NH2-OH 3.12Å; R724-D821 IonicContact CZ-OD1 3.82Å; R724-D821 IonicContact CZ-OD2 2.67Å; R724-D821 VanDerWaalsContact CZ-OD2 3.28Å; R724-D821 IonicContact NE-OD1 2.79Å; R724-D821 PolarHBondContact NE-OD1 2.77Å; R724-D821 IonicContact NE-OD2 2.71Å; R724-D821 PolarHBondContact NE-OD2 3.24Å; R724-D821 IonicContact NH2-OD1 3.62Å; R724-D821 PolarHBondContact NH2-OD1 2.64Å; R724-D821 IonicContact NH2-OD2 3.78Å; R724-D821 PolarHBondContact NH2-OD2 2.82Å
725	S	86.9	Confident	92.8	Very high	33 Å²	33	28.3 Å²	28.3	23%	0.231	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-82	-17	173.7	64.5	0	0	0	0	114	T722 F723	T722-S725 WeakPolarHBondContact O-CB 3.37Å; T722-S725 PolarHBondContact O-N 3.13Å; T722-S725 PolarHBondContact O-OG 2.79Å; F723-S725 PolarHBondContact O-N 3.1Å
726	F	90.3	Very high	93	Very high	27 Å²	27	27.7 Å²	27.7	12%	0.118	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-142.3	-9.8	-175.3	56.9	-105	0	0	0	115.1	L698 L701 F719 F723 I1078 F1079 I1104	L698-F726 HydrophobicContact CD1-CD2 4.2Å; L698-F726 HydrophobicContact CD1-CE2 4.08Å; L701-F726 HydrophobicContact CD1-CE2 4.05Å; L701-F726 HydrophobicContact CD1-CZ 4.15Å; F719-F726 HydrophobicContact CD2-CZ 4.27Å; F719-F726 AromaticContact CE2-CE2 3.93Å; F719-F726 HydrophobicContact CE2-CE2 3.93Å; F719-F726 AromaticContact CE2-CZ 3.98Å; F719-F726 HydrophobicContact CE2-CZ 3.98Å; F719-F726 HydrophobicContact CZ-CE2 4.27Å; F723-F726 HydrophobicContact CB-CE2 4.06Å; F723-F726 HydrophobicContact CB-CZ 3.96Å; F723-F726 PolarHBondContact O-N 3.3Å; F726-I1078 HydrophobicContact CB-CG2 4.3Å; F726-F1079 HydrophobicContact CB-CZ 4.43Å; F726-I1104 HydrophobicContact CB-CD1 4.2Å; F726-I1104 HydrophobicContact CB-CG1 4.34Å; F726-I1104 HydrophobicContact CB-CG2 4.22Å; F726-I1104 HydrophobicContact CD1-CG2 3.63Å; F726-I1104 HydrophobicContact CD2-CD1 3.7Å; F726-I1104 HydrophobicContact CD2-CG2 4.24Å; F726-I1104 HydrophobicContact CE1-CG2 3.96Å; F726-I1104 HydrophobicContact CE2-CD1 4.29Å; F726-I1104 HydrophobicContact CG-CD1 4.06Å; F726-I1104 HydrophobicContact CG-CG1 4.44Å; F726-I1104 HydrophobicContact CG-CG2 3.78Å; F726-I1104 HydrophobicContact CZ-CG2 4.39Å
727	C	91.5	Very high	93.2	Very high	5 Å²	5	28 Å²	28	3%	0.034	14%	0.144	C	C	.	.	S	Bend	trans	-145.2	142.8	179.2	178.6	0	0	0	0	110.2	L698 F723 R724 E731	L698-C727 HydrophobicContact CD1-CB 3.95Å; L698-C727 HydrophobicContact CD2-CB 4.08Å; F723-C727 HydrophobicContact CD2-CB 4.37Å; F723-C727 WeakPolarHBondContact CD2-O 3.38Å; F723-C727 PolarHBondContact O-N 3.24Å; R724-C727 WeakPolarHBondContact CA-O 3.5Å; C727-E731 PolarHBondContact SG-OE2 2.92Å; C727-E731 VanDerWaalsContact SG-OE2 3.32Å
728	T	92.6	Very high	93.4	Very high	77 Å²	77	25.6 Å²	25.6	47%	0.472	14%	0.137	S	C	.	.			trans	-83.1	161.9	177.2	66	0	0	0	0	111.9	E731 L732	T728-E731 PolarHBondContact N-OE2 3.47Å; T728-E731 PolarHBondContact O-N 2.71Å; T728-E731 WeakPolarHBondContact OG1-CB 3.49Å; T728-E731 PolarHBondContact OG1-N 2.71Å; T728-L732 WeakPolarHBondContact O-CB 3.36Å; T728-L732 PolarHBondContact O-N 3.06Å
729	Q	93.4	Very high	93.5	Very high	50 Å²	50	25.3 Å²	25.3	23%	0.234	14%	0.136	C	C	.	.	H	α-helix	trans	-62.3	-46.2	179.4	-62.1	87.8	-26.3	0	0	112	F723 E731 L732 L733 W814 D821 L828	F723-Q729 HydrophobicContact CE2-CG 4.28Å; F723-Q729 HydrophobicContact CZ-CG 4.14Å; Q729-E731 VanDerWaalsContact C-N 3.35Å; Q729-E731 PolarHBondContact O-N 2.84Å; Q729-L732 PolarHBondContact O-N 3.49Å; Q729-L733 PolarHBondContact O-N 3.3Å; Q729-W814 HydrophobicContact CB-CH2 4.37Å; Q729-W814 HydrophobicContact CB-CZ2 4.08Å; Q729-W814 HydrophobicContact CG-CZ2 4.23Å; Q729-W814 WeakPolarHBondContact O-CH2 3.42Å; Q729-D821 HydrophobicContact CG-CB 4.06Å; Q729-D821 PolarHBondContact NE2-OD1 2.96Å; Q729-L828 HydrophobicContact CB-CD1 4.19Å; Q729-L828 HydrophobicContact CB-CD2 3.74Å; Q729-L828 HydrophobicContact CG-CD2 4.36Å
730	S	93.8	Very high	93.4	Very high	51 Å²	51	25.3 Å²	25.3	36%	0.357	14%	0.136	S	C	.	.	H	α-helix	trans	-65.2	-39.7	179.1	-40	0	0	0	0	111.7	L733 N734	S730-L733 PolarHBondContact O-N 3.13Å; S730-N734 WeakPolarHBondContact O-CB 3.31Å; S730-N734 PolarHBondContact O-N 2.83Å; S730-N734 PolarHBondContact O-ND2 2.88Å
731	E	94.7	Very high	93.3	Very high	79 Å²	79	28.2 Å²	28.2	37%	0.369	15%	0.151	S	C	.	.	H	α-helix	trans	-64.5	-43.3	175.3	-177.1	-176.9	-157.1	0	0	111.9	C727 T728 Q729 L733 N734 L735	C727-E731 PolarHBondContact SG-OE2 2.92Å; C727-E731 VanDerWaalsContact SG-OE2 3.32Å; T728-E731 PolarHBondContact N-OE2 3.47Å; T728-E731 PolarHBondContact O-N 2.71Å; T728-E731 WeakPolarHBondContact OG1-CB 3.49Å; T728-E731 PolarHBondContact OG1-N 2.71Å; Q729-E731 VanDerWaalsContact C-N 3.35Å; Q729-E731 PolarHBondContact O-N 2.84Å; E731-L733 PolarHBondContact O-N 3.42Å; E731-N734 PolarHBondContact O-N 2.97Å; E731-L735 HydrophobicContact CG-CD1 4.12Å; E731-L735 WeakPolarHBondContact O-CG 3.2Å; E731-L735 PolarHBondContact O-N 2.88Å
732	L	96	Very high	93.2	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-59.9	-46.4	175.1	175.6	59.2	0	0	0	111.3	I702 F719 F723 T728 Q729 N734 L735 L736 W814	I702-L732 HydrophobicContact CD1-CD1 3.45Å; I702-L732 VanDerWaalsContact CD1-CD1 3.45Å; F719-L732 HydrophobicContact CE1-CD1 3.59Å; F719-L732 HydrophobicContact CE1-CD2 3.99Å; F719-L732 HydrophobicContact CE1-CG 4.47Å; F719-L732 HydrophobicContact CZ-CD1 3.9Å; F723-L732 HydrophobicContact CD1-CD2 4.08Å; F723-L732 HydrophobicContact CD2-CB 4.36Å; F723-L732 HydrophobicContact CD2-CD2 3.75Å; F723-L732 HydrophobicContact CE1-CD2 3.95Å; F723-L732 HydrophobicContact CE2-CB 4.21Å; F723-L732 HydrophobicContact CE2-CD2 3.65Å; F723-L732 HydrophobicContact CG-CD2 3.97Å; F723-L732 HydrophobicContact CZ-CD2 3.74Å; T728-L732 WeakPolarHBondContact O-CB 3.36Å; T728-L732 PolarHBondContact O-N 3.06Å; Q729-L732 PolarHBondContact O-N 3.49Å; L732-N734 VanDerWaalsContact C-N 3.35Å; L732-N734 PolarHBondContact O-N 3.08Å; L732-L735 PolarHBondContact O-N 2.73Å; L732-L736 HydrophobicContact CD1-CD1 4.07Å; L732-L736 HydrophobicContact CD1-CG 4.08Å; L732-L736 HydrophobicContact CG-CD1 4.07Å; L732-L736 HydrophobicContact CG-CG 4.49Å; L732-L736 WeakPolarHBondContact O-CB 3.42Å; L732-L736 VanDerWaalsContact O-CG 3.31Å; L732-L736 WeakPolarHBondContact O-CG 3.48Å; L732-L736 PolarHBondContact O-N 2.7Å; L732-W814 HydrophobicContact CB-CH2 4.14Å; L732-W814 HydrophobicContact CB-CZ3 4.44Å; L732-W814 HydrophobicContact CD2-CD2 4.44Å; L732-W814 HydrophobicContact CD2-CE3 4.13Å; L732-W814 HydrophobicContact CD2-CH2 3.76Å; L732-W814 HydrophobicContact CD2-CZ2 4.06Å; L732-W814 HydrophobicContact CD2-CZ3 3.79Å; L732-W814 HydrophobicContact CG-CH2 4Å; L732-W814 HydrophobicContact CG-CZ3 3.88Å
733	L	95.9	Very high	92.8	Very high	1 Å²	1	30 Å²	30	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-60.3	-45.8	177.6	-178.5	60.6	0	0	0	110.9	Q729 S730 E731 L735 L736 I737 W814 L828 H831 L832	Q729-L733 PolarHBondContact O-N 3.3Å; S730-L733 PolarHBondContact O-N 3.13Å; E731-L733 PolarHBondContact O-N 3.42Å; L733-L735 PolarHBondContact O-N 3.38Å; L733-L736 PolarHBondContact O-N 2.82Å; L733-I737 HydrophobicContact CD1-CD1 4.16Å; L733-I737 HydrophobicContact CD1-CG1 4.32Å; L733-I737 HydrophobicContact CG-CD1 3.93Å; L733-I737 HydrophobicContact CG-CG1 4.49Å; L733-I737 VanDerWaalsContact O-CG1 3.25Å; L733-I737 WeakPolarHBondContact O-CG1 3.41Å; L733-I737 PolarHBondContact O-N 3.45Å; L733-W814 HydrophobicContact CB-CH2 4.44Å; L733-W814 HydrophobicContact CB-CZ3 4.33Å; L733-L828 HydrophobicContact CB-CD1 4.1Å; L733-L828 HydrophobicContact CD2-CD1 3.75Å; L733-H831 HydrophobicContact CD2-CB 3.87Å; L733-L832 HydrophobicContact CD1-CD1 4.13Å; L733-L832 HydrophobicContact CD2-CB 4.32Å
734	N	96.3	Very high	91.8	Very high	79 Å²	79	31.5 Å²	31.5	42%	0.422	17%	0.171	S	C	.	.	H	α-helix	trans	-59.3	-44.5	177.1	-70.1	-19.9	0	0	0	112.5	S730 E731 L732 L736 I737 E738 H831	S730-N734 WeakPolarHBondContact O-CB 3.31Å; S730-N734 PolarHBondContact O-N 2.83Å; S730-N734 PolarHBondContact O-ND2 2.88Å; E731-N734 PolarHBondContact O-N 2.97Å; L732-N734 VanDerWaalsContact C-N 3.35Å; L732-N734 PolarHBondContact O-N 3.08Å; N734-L736 VanDerWaalsContact C-N 3.35Å; N734-I737 PolarHBondContact O-N 3.03Å; N734-E738 WeakPolarHBondContact O-CB 3.19Å; N734-E738 PolarHBondContact O-N 2.95Å; N734-H831 PolarHBondContact OD1-CE1 3.34Å
735	L	96.1	Very high	90.7	Very high	12 Å²	12	33.1 Å²	33.1	6%	0.063	19%	0.186	C	C	.	.	H	α-helix	trans	-66.9	-35.4	178.4	-71.3	169.8	0	0	0	112.3	F670 L698 I702 E731 L732 L733 R739	F670-L735 HydrophobicContact CZ-CD2 4.38Å; L698-L735 HydrophobicContact CD1-CD1 4.41Å; L698-L735 HydrophobicContact CD2-CD1 3.57Å; L698-L735 HydrophobicContact CG-CD1 3.74Å; I702-L735 HydrophobicContact CG1-CB 4.22Å; I702-L735 HydrophobicContact CG1-CD1 4.2Å; E731-L735 HydrophobicContact CG-CD1 4.12Å; E731-L735 WeakPolarHBondContact O-CG 3.2Å; E731-L735 PolarHBondContact O-N 2.88Å; L732-L735 PolarHBondContact O-N 2.73Å; L733-L735 PolarHBondContact O-N 3.38Å; L735-R739 WeakPolarHBondContact O-CB 3.46Å; L735-R739 PolarHBondContact O-N 3.27Å
736	L	95.9	Very high	89.6	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-68.8	-38.9	174.1	-72.8	174.4	0	0	0	111.9	I702 L705 T706 L732 L733 N734 R739 F740 V807 V810 I811 W814	I702-L736 HydrophobicContact CG2-CD2 4.4Å; L705-L736 HydrophobicContact CD2-CD2 4.41Å; T706-L736 HydrophobicContact CG2-CD2 4.37Å; L732-L736 HydrophobicContact CD1-CD1 4.07Å; L732-L736 HydrophobicContact CD1-CG 4.08Å; L732-L736 HydrophobicContact CG-CD1 4.07Å; L732-L736 HydrophobicContact CG-CG 4.49Å; L732-L736 WeakPolarHBondContact O-CB 3.42Å; L732-L736 VanDerWaalsContact O-CG 3.31Å; L732-L736 WeakPolarHBondContact O-CG 3.48Å; L732-L736 PolarHBondContact O-N 2.7Å; L733-L736 PolarHBondContact O-N 2.82Å; N734-L736 VanDerWaalsContact C-N 3.35Å; L736-R739 PolarHBondContact O-N 3.36Å; L736-F740 WeakPolarHBondContact O-CB 3.44Å; L736-F740 PolarHBondContact O-N 3.07Å; L736-V807 HydrophobicContact CB-CG1 4.15Å; L736-V807 HydrophobicContact CD2-CG1 4.45Å; L736-V810 HydrophobicContact CD1-CG1 4.19Å; L736-V810 HydrophobicContact CD2-CG1 4.39Å; L736-I811 HydrophobicContact CD1-CG1 4.21Å; L736-W814 HydrophobicContact CD1-CE3 4.33Å; L736-W814 HydrophobicContact CD1-CZ3 4.26Å
737	I	94.6	Very high	87.8	Confident	17 Å²	17	41.7 Å²	41.7	9%	0.087	23%	0.225	C	C	.	.	H	α-helix	trans	-63.8	-47.1	173.8	-68	171.1	0	0	0	110	L733 N734 R739 F740 D741 F835	L733-I737 HydrophobicContact CD1-CD1 4.16Å; L733-I737 HydrophobicContact CD1-CG1 4.32Å; L733-I737 HydrophobicContact CG-CD1 3.93Å; L733-I737 HydrophobicContact CG-CG1 4.49Å; L733-I737 VanDerWaalsContact O-CG1 3.25Å; L733-I737 WeakPolarHBondContact O-CG1 3.41Å; L733-I737 PolarHBondContact O-N 3.45Å; N734-I737 PolarHBondContact O-N 3.03Å; I737-R739 VanDerWaalsContact C-N 3.29Å; I737-R739 PolarHBondContact O-N 3.12Å; I737-F740 WeakPolarHBondContact O-CA 3.46Å; I737-F740 WeakPolarHBondContact O-CB 3.4Å; I737-F740 PolarHBondContact O-N 2.92Å; I737-D741 PolarHBondContact O-N 3.46Å; I737-F835 HydrophobicContact CB-CD2 4.4Å; I737-F835 HydrophobicContact CB-CE2 4.31Å; I737-F835 HydrophobicContact CD1-CB 4.08Å; I737-F835 HydrophobicContact CD1-CD2 4.15Å; I737-F835 HydrophobicContact CD1-CG 4.09Å; I737-F835 HydrophobicContact CG1-CB 4.41Å; I737-F835 HydrophobicContact CG1-CD1 4.27Å; I737-F835 HydrophobicContact CG1-CD2 3.67Å; I737-F835 HydrophobicContact CG1-CE1 4.45Å; I737-F835 HydrophobicContact CG1-CE2 3.88Å; I737-F835 HydrophobicContact CG1-CG 3.86Å; I737-F835 HydrophobicContact CG1-CZ 4.25Å; I737-F835 HydrophobicContact CG2-CD2 4.09Å; I737-F835 HydrophobicContact CG2-CE2 4.12Å
738	E	94.5	Very high	85.5	Confident	52 Å²	52	45.1 Å²	45.1	24%	0.243	26%	0.261	C	S	.	.	H	α-helix	trans	-60.6	-40	176.2	-170	-177.1	177.6	0	0	111.8	Y668 R669 F670 N734 F740 D741	Y668-E738 WeakPolarHBondContact CE2-O 3.17Å; R669-E738 IonicContact CZ-OE1 3.73Å; R669-E738 IonicContact CZ-OE2 3.88Å; R669-E738 VanDerWaalsContact NE-CD 3.31Å; R669-E738 IonicContact NE-OE1 3.58Å; R669-E738 PolarHBondContact NE-OE1 3.11Å; R669-E738 IonicContact NE-OE2 3.64Å; R669-E738 PolarHBondContact NE-OE2 3.06Å; R669-E738 IonicContact NH1-OE2 2.77Å; R669-E738 IonicContact NH2-OE1 3.53Å; R669-E738 PolarHBondContact NH2-OE1 3.23Å; R669-E738 IonicContact NH2-OE2 3.39Å; R669-E738 PolarHBondContact NH2-OE2 3.35Å; F670-E738 HydrophobicContact CE2-CB 4.1Å; F670-E738 HydrophobicContact CE2-CG 3.89Å; N734-E738 WeakPolarHBondContact O-CB 3.19Å; N734-E738 PolarHBondContact O-N 2.95Å; E738-F740 PolarHBondContact O-N 2.97Å; E738-D741 PolarHBondContact O-N 3.34Å
739	R	94.9	Very high	82.8	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.9	-28.1	174.8	-175.9	69.5	-174.3	152.1	-0.5	112.6	Y668 F670 I702 T706 L735 L736 I737 Y799 V803 V807	Y668-R739 VanDerWaalsContact OH-CD 3.31Å; Y668-R739 WeakPolarHBondContact OH-CD 3.34Å; Y668-R739 PolarHBondContact OH-NH1 3.01Å; Y668-R739 PolarHBondContact OH-O 3.38Å; Y668-R739 VanDerWaalsContact OH-O 3.12Å; F670-R739 HydrophobicContact CD2-CB 4.43Å; F670-R739 HydrophobicContact CE2-CB 3.92Å; F670-R739 HydrophobicContact CZ-CB 4.01Å; I702-R739 HydrophobicContact CG2-CB 4.24Å; I702-R739 HydrophobicContact CG2-CG 4.29Å; T706-R739 PolarHBondContact O-NH2 3.43Å; T706-R739 VanDerWaalsContact OG1-CG 3.3Å; T706-R739 WeakPolarHBondContact OG1-CG 3.47Å; T706-R739 PolarHBondContact OG1-NE 3.47Å; L735-R739 WeakPolarHBondContact O-CB 3.46Å; L735-R739 PolarHBondContact O-N 3.27Å; L736-R739 PolarHBondContact O-N 3.36Å; I737-R739 VanDerWaalsContact C-N 3.29Å; I737-R739 PolarHBondContact O-N 3.12Å; R739-Y799 PolarHBondContact NH1-OH 3.33Å; R739-V803 HydrophobicContact CG-CG1 3.83Å; R739-V803 WeakPolarHBondContact O-CG1 3.49Å; R739-V807 HydrophobicContact CB-CG2 4.23Å; R739-V807 HydrophobicContact CG-CG2 3.9Å
740	F	92.4	Very high	79.7	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-79.2	-38.4	177.3	-173	-84.5	0	0	0	112.5	L736 I737 E738 I742 R804 V807 L808 F835 I839 H843	L736-F740 WeakPolarHBondContact O-CB 3.44Å; L736-F740 PolarHBondContact O-N 3.07Å; I737-F740 WeakPolarHBondContact O-CA 3.46Å; I737-F740 WeakPolarHBondContact O-CB 3.4Å; I737-F740 PolarHBondContact O-N 2.92Å; E738-F740 PolarHBondContact O-N 2.97Å; F740-I742 PolarHBondContact O-N 3.16Å; F740-R804 HydrophobicContact CD1-CG 4.43Å; F740-R804 HydrophobicContact CD2-CB 3.89Å; F740-R804 HydrophobicContact CD2-CG 3.72Å; F740-R804 HydrophobicContact CE1-CG 4.36Å; F740-R804 HydrophobicContact CE2-CB 3.58Å; F740-R804 HydrophobicContact CE2-CG 3.64Å; F740-R804 HydrophobicContact CG-CG 4.12Å; F740-R804 HydrophobicContact CZ-CB 4.22Å; F740-R804 HydrophobicContact CZ-CG 3.97Å; F740-R804 PolarHBondContact O-NE 3.25Å; F740-V807 HydrophobicContact CB-CG1 4.29Å; F740-V807 HydrophobicContact CD2-CB 4.25Å; F740-V807 HydrophobicContact CD2-CG1 4.19Å; F740-L808 HydrophobicContact CE2-CD1 4.18Å; F740-L808 HydrophobicContact CE2-CD2 4.35Å; F740-L808 HydrophobicContact CE2-CG 4.12Å; F740-F835 HydrophobicContact CB-CE2 4.29Å; F740-F835 HydrophobicContact CB-CZ 3.99Å; F740-F835 AromaticContact CD1-CE2 3.99Å; F740-F835 HydrophobicContact CD1-CE2 3.99Å; F740-F835 HydrophobicContact CD1-CZ 4.04Å; F740-F835 HydrophobicContact CD2-CZ 4.02Å; F740-F835 HydrophobicContact CG-CE2 4.11Å; F740-F835 AromaticContact CG-CZ 3.75Å; F740-F835 HydrophobicContact CG-CZ 3.75Å; F740-I839 HydrophobicContact CE1-CD1 4.08Å; F740-I839 HydrophobicContact CE1-CG1 3.77Å; F740-I839 HydrophobicContact CE2-CD1 4.04Å; F740-I839 HydrophobicContact CZ-CD1 3.75Å; F740-I839 HydrophobicContact CZ-CG1 3.73Å; F740-I839 HydrophobicContact CZ-CG2 4.22Å; F740-H843 AromaticContact CE1-CD2 3.88Å; F740-H843 AromaticContact CE1-CE1 3.94Å; F740-H843 AromaticContact CE1-NE2 3.62Å
741	D	90.6	Very high	76.4	Confident	62 Å²	62	50.1 Å²	50.1	33%	0.332	33%	0.325	S	S	.	.			trans	-81.4	60.7	-176.4	-67.5	-20.6	0	0	0	111.9	I737 E738 P743 R838	I737-D741 PolarHBondContact O-N 3.46Å; E738-D741 PolarHBondContact O-N 3.34Å; D741-P743 WeakPolarHBondContact O-CD 3.46Å; D741-R838 IonicContact OD1-CZ 2.64Å; D741-R838 IonicContact OD1-NH2 2.64Å; D741-R838 PolarHBondContact OD1-NH2 3.49Å; D741-R838 IonicContact OD2-CZ 3.31Å; D741-R838 IonicContact OD2-NH1 3.31Å; D741-R838 PolarHBondContact OD2-NH1 3.44Å; D741-R838 IonicContact OD2-NH2 3.23Å; D741-R838 PolarHBondContact OD2-NH2 3.21Å
742	I	89.2	Confident	73.2	Confident	7 Å²	7	50 Å²	50	4%	0.036	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-73	122.2	176.6	-55.9	162.9	0	0	0	109.3	P663 Y668 F740 Y799 I800 V803	P663-I742 HydrophobicContact CG-CG2 4.16Å; Y668-I742 HydrophobicContact CE1-CG1 4.4Å; Y668-I742 HydrophobicContact CE2-CG1 3.89Å; Y668-I742 WeakPolarHBondContact OH-CG1 3.43Å; F740-I742 PolarHBondContact O-N 3.16Å; I742-Y799 HydrophobicContact CD1-CD1 4.03Å; I742-Y799 HydrophobicContact CD1-CE1 3.99Å; I742-I800 HydrophobicContact CB-CG1 4.24Å; I742-I800 HydrophobicContact CD1-CB 4.24Å; I742-I800 HydrophobicContact CD1-CG1 4.07Å; I742-I800 HydrophobicContact CD1-CG2 4.29Å; I742-I800 HydrophobicContact CG2-CD1 4.28Å; I742-I800 HydrophobicContact CG2-CG1 3.96Å; I742-V803 HydrophobicContact CD1-CB 3.98Å; I742-V803 HydrophobicContact CD1-CG1 3.97Å; I742-V803 HydrophobicContact CD1-CG2 4.46Å
743	P	84.2	Confident	69.8	Low	44 Å²	44	55 Å²	55	29%	0.286	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-67.5	135.8	-179.4	21.9	-28	0	0	0	111.9	P663 Q667 D741	P663-P743 HydrophobicContact CB-CG 3.89Å; P663-P743 HydrophobicContact CG-CG 3.89Å; Q667-P743 HydrophobicContact CB-CG 4.36Å; D741-P743 WeakPolarHBondContact O-CD 3.46Å
744	D	73.3	Confident	66.5	Low	31 Å²	31	59.4 Å²	59.4	17%	0.166	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-79.5	125.2	174.3	-165	-43.4	0	0	0	109.2	L746 E747 R796	D744-L746 PolarHBondContact O-N 3.3Å; D744-L746 PolarHBondContact OD1-N 2.95Å; D744-L746 VanDerWaalsContact OD1-N 3.13Å; D744-E747 HydrophobicContact CB-CG 4.1Å; D744-E747 PolarHBondContact O-N 2.92Å; D744-E747 VanDerWaalsContact O-N 3.1Å; D744-R796 IonicContact OD1-NH2 3.78Å; D744-R796 IonicContact OD2-CZ 3.37Å; D744-R796 IonicContact OD2-NE 2.67Å; D744-R796 PolarHBondContact OD2-NE 3.46Å; D744-R796 VanDerWaalsContact OD2-NE 3.1Å; D744-R796 IonicContact OD2-NH2 3.97Å; D744-R796 PolarHBondContact OD2-NH2 3.35Å
745	P	67.4	Low	63.3	Low	68 Å²	68	63.8 Å²	63.8	44%	0.442	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-16.8	-179.2	22.2	-34.6	0	0	0	114.4	V792 L795	P745-V792 HydrophobicContact CG-CG2 3.85Å; P745-L795 HydrophobicContact CG-CD2 3.82Å
746	L	63.4	Low	60	Low	78 Å²	78	67.3 Å²	67.3	41%	0.408	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-14.6	178.4	-65.3	172.9	0	0	0	114.5	D744 G748 L788 V792	D744-L746 PolarHBondContact O-N 3.3Å; D744-L746 PolarHBondContact OD1-N 2.95Å; D744-L746 VanDerWaalsContact OD1-N 3.13Å; L746-G748 VanDerWaalsContact C-N 3.26Å; L746-G748 PolarHBondContact O-N 3.38Å; L746-L788 HydrophobicContact CD2-CD2 3.9Å; L746-V792 HydrophobicContact CD1-CG1 3.93Å; L746-V792 HydrophobicContact CD1-CG2 4.29Å; L746-V792 HydrophobicContact CG-CG1 4.42Å; L746-V792 HydrophobicContact CG-CG2 4.17Å
747	E	53.8	Low	56.8	Low	163 Å²	163	73 Å²	73	76%	0.762	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-1.1	-174.3	-71.2	-176.9	168.5	0	0	113.9	D744	D744-E747 HydrophobicContact CB-CG 4.1Å; D744-E747 PolarHBondContact O-N 2.92Å; D744-E747 VanDerWaalsContact O-N 3.1Å
748	G	43.5	Very low	53.7	Low	77 Å²	77	77.5 Å²	77.5	79%	0.794	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-9.3	-178.8	0	0	0	0	0	116.6	L746	L746-G748 VanDerWaalsContact C-N 3.26Å; L746-G748 PolarHBondContact O-N 3.38Å
749	T	34.8	Very low	50.9	Low	119 Å²	119	80.4 Å²	80.4	73%	0.73	56%	0.56	S	S	*	*	S	Bend	trans	-93	109.5	170.9	41.6	0	0	0	0	109.4	G751	T749-G751 PolarHBondContact O-N 3.43Å
750	G	28.6	Very low	47.9	Very low	81 Å²	81	87.5 Å²	87.5	84%	0.835	60%	0.603	S	S	*	*			trans	-43.6	132.5	-178.7	0	0	0	0	0	114
751	G	24.8	Very low	44.8	Very low	83 Å²	83	90.4 Å²	90.4	86%	0.856	63%	0.634	S	S	*	*			trans	-64.9	165.4	-174.6	0	0	0	0	0	115.7	T749	T749-G751 PolarHBondContact O-N 3.43Å
752	G	26.2	Very low	41.9	Very low	75 Å²	75	93.9 Å²	93.9	77%	0.773	66%	0.657	S	S	*	*			trans	146.6	94.3	169.6	0	0	0	0	0	113
753	S	26.4	Very low	38.9	Very low	106 Å²	106	99.1 Å²	99.1	74%	0.741	69%	0.689	S	S	*	*			trans	14.3	129	138.9	-165.5	0	0	0	0	118
754	S	26.2	Very low	36.2	Very low	93 Å²	93	105.2 Å²	105.2	65%	0.65	72%	0.716	S	S	*	*			trans	48.9	119.2	145.4	65.7	0	0	0	0	117.6
755	L	27.7	Very low	34	Very low	172 Å²	172	109.2 Å²	109.2	90%	0.901	74%	0.742	S	S	*	*				175.1	113.9	126	-90	151.3	0	0	0	109.7
756	A	27.9	Very low	32.1	Very low	85 Å²	85	111.7 Å²	111.7	70%	0.702	76%	0.758	S	S	*	*			trans	-60.3	154.8	156.2	0	0	0	0	0	110.4
757	S	28.9	Very low	30.4	Very low	119 Å²	119	115.4 Å²	115.4	83%	0.832	78%	0.777	S	S	*	*			trans	78.5	108	162.2	71.6	0	0	0	0	119.3
758	S	29.1	Very low	29.4	Very low	113 Å²	113	111.3 Å²	111.3	79%	0.79	77%	0.766	S	S	*	*				133.5	130.1	128.1	-162.5	0	0	0	0	112.7
759	P	35.6	Very low	28.8	Very low	113 Å²	113	111.6 Å²	111.6	73%	0.734	76%	0.756	S	S	*	*			trans	-85.4	149.6	176.3	36	-31	0	0	0	109.8
760	V	31.7	Very low	28.8	Very low	148 Å²	148	110.2 Å²	110.2	90%	0.897	75%	0.751	S	S	*	*			trans	175.3	136.9	142.9	154.4	0	0	0	0	107.6
761	G	27.2	Very low	29.4	Very low	62 Å²	62	113 Å²	113	64%	0.639	75%	0.746	S	S	*	*			trans	-73.5	164.5	-162.9	0	0	0	0	0	116.2
762	T	29.3	Very low	30.2	Very low	135 Å²	135	114 Å²	114	83%	0.828	73%	0.731	S	S	*	*				-178.4	118.7	116.4	-68.2	0	0	0	0	108.5
763	T	28	Very low	30.7	Very low	116 Å²	116	117.3 Å²	117.3	71%	0.712	73%	0.731	S	S	*	*			trans	-3	120.2	163.1	48	0	0	0	0	119.4
764	M	27.1	Very low	31.2	Very low	172 Å²	172	116.8 Å²	116.8	85%	0.847	73%	0.727	S	S	*	*			trans	-152.5	106.5	141.3	-86.1	-62	120.8	0	0	109.5
765	T	26.1	Very low	31.8	Very low	115 Å²	115	117 Å²	117	71%	0.706	72%	0.72	S	S	*	*			trans	19	122.3	160.4	57.7	0	0	0	0	121.9
766	P	27.2	Very low	32.2	Very low	120 Å²	120	112.2 Å²	112.2	78%	0.779	70%	0.696	S	S	*	*			trans	-85.5	125.6	169.9	33.6	-27.2	0	0	0	110.8
767	I	28.2	Very low	32.7	Very low	156 Å²	156	112 Å²	112	80%	0.8	69%	0.689	S	S	*	*			trans	-92.8	119	168.7	-66.1	174	0	0	0	107.6
768	S	32.1	Very low	33.1	Very low	78 Å²	78	110.5 Å²	110.5	55%	0.545	68%	0.678	S	S	.	*			trans	77.7	59.8	162.8	-52.1	0	0	0	0	118.9	S770	S768-S770 PolarHBondContact O-N 3.12Å
769	S	31.1	Very low	33.5	Very low	83 Å²	83	108.6 Å²	108.6	58%	0.58	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	5.4	157.8	58.1	0	0	0	0	114.1
770	S	36.2	Very low	33.3	Very low	90 Å²	90	113 Å²	113	63%	0.629	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-11.9	-171.5	55.5	0	0	0	0	115.9	S768	S768-S770 PolarHBondContact O-N 3.12Å
771	L	41.6	Very low	33.6	Very low	140 Å²	140	114.3 Å²	114.3	73%	0.733	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-11.2	-178.8	-81.8	159.8	0	0	0	114
772	I	41.3	Very low	34.3	Very low	103 Å²	103	114.8 Å²	114.8	53%	0.528	66%	0.658	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109	-19.9	-172.4	-58.8	176.5	0	0	0	111.5	S774 I775	I772-S774 PolarHBondContact O-N 3.39Å; I772-I775 HydrophobicContact CG2-CD1 4.14Å; I772-I775 WeakPolarHBondContact O-CG1 3.38Å; I772-I775 PolarHBondContact O-N 2.9Å
773	D	35.4	Very low	35.5	Very low	144 Å²	144	114.6 Å²	114.6	77%	0.77	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-5.8	-179.6	-85.5	-15	0	0	0	114.8
774	S	37.3	Very low	36.9	Very low	96 Å²	96	115.1 Å²	115.1	67%	0.671	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	0	173.5	45.9	0	0	0	0	113.7	I772	I772-S774 PolarHBondContact O-N 3.39Å
775	I	38.7	Very low	38.7	Very low	97 Å²	97	110.8 Å²	110.8	50%	0.497	63%	0.63	S	S	.	*	S	Bend	trans	-82	121.1	177.5	-58.3	177.9	0	0	0	109.4	I772	I772-I775 HydrophobicContact CG2-CD1 4.14Å; I772-I775 WeakPolarHBondContact O-CG1 3.38Å; I772-I775 PolarHBondContact O-N 2.9Å
776	D	37.2	Very low	40.8	Very low	72 Å²	72	107.6 Å²	107.6	39%	0.385	61%	0.613	S	S	.	*			trans	-49.1	139	-177.9	-164.5	13.1	0	0	0	112.4	R101 S778	R101-D776 IonicContact CZ-OD1 3.05Å; R101-D776 IonicContact CZ-OD2 3.94Å; R101-D776 IonicContact NH1-OD1 2.79Å; R101-D776 PolarHBondContact NH1-OD1 3.3Å; R101-D776 IonicContact NH1-OD2 3.91Å; R101-D776 PolarHBondContact NH1-OD2 3.31Å; R101-D776 IonicContact NH2-OD1 3.33Å; R101-D776 PolarHBondContact NH2-OD1 2.87Å; R101-D776 IonicContact NH2-OD2 3.69Å; D776-S778 WeakPolarHBondContact CB-OG 3.47Å; D776-S778 PolarHBondContact O-N 2.92Å; D776-S778 PolarHBondContact OD2-OG 3.34Å
777	S	36.5	Very low	42.8	Very low	80 Å²	80	104.5 Å²	104.5	56%	0.559	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	12	-177.6	-66.9	0	0	0	0	114.5	R780	S777-R780 WeakPolarHBondContact O-CG 3.46Å
778	S	38.8	Very low	45	Very low	87 Å²	87	100.5 Å²	100.5	61%	0.608	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-9	-177.7	34.7	0	0	0	0	113.6	D776	D776-S778 WeakPolarHBondContact CB-OG 3.47Å; D776-S778 PolarHBondContact O-N 2.92Å; D776-S778 PolarHBondContact OD2-OG 3.34Å
779	C	37.4	Very low	47	Very low	74 Å²	74	103.2 Å²	103.2	50%	0.5	57%	0.567	S	S	.	*			trans	-95	23.1	177.4	-69.6	0	0	0	0	115.1	L781 V782	C779-L781 PolarHBondContact O-N 3.09Å; C779-V782 PolarHBondContact O-N 3.05Å
780	R	30.3	Very low	49	Very low	204 Å²	204	102.5 Å²	102.5	77%	0.77	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	23.2	-169.1	-76.6	-175.1	-175.2	-168.4	3.2	117.3	S777	S777-R780 WeakPolarHBondContact O-CG 3.46Å
781	L	38.3	Very low	50.8	Low	176 Å²	176	98.5 Å²	98.5	92%	0.921	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.2	11.5	179.1	-68.5	173.6	0	0	0	114.8	C779	C779-L781 PolarHBondContact O-N 3.09Å
782	V	42.7	Very low	52.7	Low	73 Å²	73	92 Å²	92	44%	0.442	49%	0.493	S	S	.	.	S	Bend	trans	-119	126.3	-179.8	-171.1	0	0	0	0	110.1	C779 N784 S786 L787	C779-V782 PolarHBondContact O-N 3.05Å; V782-N784 PolarHBondContact O-N 3.17Å; V782-S786 VanDerWaalsContact CG1-OG 3.29Å; V782-S786 WeakPolarHBondContact CG1-OG 3.43Å; V782-L787 HydrophobicContact CB-CD1 4.2Å; V782-L787 HydrophobicContact CB-CG 4.3Å; V782-L787 HydrophobicContact CG1-CD1 4.18Å; V782-L787 HydrophobicContact CG1-CD2 4.06Å; V782-L787 HydrophobicContact CG1-CG 3.72Å
783	D	53.4	Low	54.4	Low	130 Å²	130	93 Å²	93	70%	0.695	49%	0.493	S	S	*	.			trans	-57.9	122.2	180	-137.9	-11.5	0	0	0	110	D785 S786 L787	D783-D785 PolarHBondContact O-N 3.2Å; D783-S786 WeakPolarHBondContact O-CB 3.35Å; D783-S786 PolarHBondContact O-N 3.37Å; D783-S786 PolarHBondContact O-OG 2.75Å; D783-L787 PolarHBondContact O-N 2.84Å
784	N	57.4	Low	56.5	Low	128 Å²	128	87.1 Å²	87.1	68%	0.684	46%	0.46	S	S	*	.	H	α-helix	trans	-54.2	-32.5	-171.8	-75.1	-25.7	0	0	0	113.2	V782 S786 L787 L788	V782-N784 PolarHBondContact O-N 3.17Å; N784-S786 VanDerWaalsContact C-N 3.35Å; N784-L787 PolarHBondContact O-N 2.65Å; N784-L788 PolarHBondContact O-N 3.09Å; N784-L788 VanDerWaalsContact O-N 3.16Å
785	D	66.2	Low	58.8	Low	80 Å²	80	82.6 Å²	82.6	43%	0.428	43%	0.429	S	S	.	.	H	α-helix	trans	-68.9	-31.4	178.6	-166.8	28.5	0	0	0	112.4	D783 R789	D783-D785 PolarHBondContact O-N 3.2Å; D785-R789 VanDerWaalsContact CG-CZ 3.48Å; D785-R789 VanDerWaalsContact CG-NH2 3.3Å; D785-R789 WeakPolarHBondContact O-CG 3.29Å; D785-R789 PolarHBondContact O-N 3.22Å; D785-R789 VanDerWaalsContact O-N 3.13Å; D785-R789 IonicContact OD1-CZ 3.83Å; D785-R789 IonicContact OD1-NH1 3.71Å; D785-R789 PolarHBondContact OD1-NH1 3.01Å; D785-R789 IonicContact OD1-NH2 2.89Å; D785-R789 IonicContact OD2-CZ 3.04Å; D785-R789 IonicContact OD2-NH1 2.88Å; D785-R789 PolarHBondContact OD2-NH1 3.32Å; D785-R789 IonicContact OD2-NH2 3.29Å; D785-R789 PolarHBondContact OD2-NH2 3.49Å
786	S	69.2	Low	60.9	Low	48 Å²	48	83.1 Å²	83.1	34%	0.336	43%	0.425	S	S	.	.	H	α-helix	trans	-72.1	-39.4	176	71.5	0	0	0	0	112.6	V782 D783 N784 R789 E790	V782-S786 VanDerWaalsContact CG1-OG 3.29Å; V782-S786 WeakPolarHBondContact CG1-OG 3.43Å; D783-S786 WeakPolarHBondContact O-CB 3.35Å; D783-S786 PolarHBondContact O-N 3.37Å; D783-S786 PolarHBondContact O-OG 2.75Å; N784-S786 VanDerWaalsContact C-N 3.35Å; S786-R789 PolarHBondContact O-N 3.21Å; S786-E790 PolarHBondContact O-N 3.33Å; S786-E790 VanDerWaalsContact O-N 3.1Å
787	L	70.6	Confident	62.8	Low	56 Å²	56	84.3 Å²	84.3	29%	0.293	43%	0.426	S	S	.	.	H	α-helix	trans	-65.3	-44.1	175.3	-75.2	172	0	0	0	111.5	V782 D783 N784 E790 S791	V782-L787 HydrophobicContact CB-CD1 4.2Å; V782-L787 HydrophobicContact CB-CG 4.3Å; V782-L787 HydrophobicContact CG1-CD1 4.18Å; V782-L787 HydrophobicContact CG1-CD2 4.06Å; V782-L787 HydrophobicContact CG1-CG 3.72Å; D783-L787 PolarHBondContact O-N 2.84Å; N784-L787 PolarHBondContact O-N 2.65Å; L787-E790 PolarHBondContact O-N 2.96Å; L787-S791 WeakPolarHBondContact O-CB 3.48Å; L787-S791 PolarHBondContact O-N 2.96Å; L787-S791 PolarHBondContact O-OG 2.86Å
788	L	72.7	Confident	64.8	Low	71 Å²	71	83.8 Å²	83.8	37%	0.372	42%	0.415	S	S	.	.	H	α-helix	trans	-59.7	-48.1	176.6	-167.9	92.3	0	0	0	111	L661 L746 N784 E790 S791 V792	L661-L788 HydrophobicContact CD1-CD1 4.37Å; L746-L788 HydrophobicContact CD2-CD2 3.9Å; N784-L788 PolarHBondContact O-N 3.09Å; N784-L788 VanDerWaalsContact O-N 3.16Å; L788-E790 VanDerWaalsContact C-N 3.28Å; L788-E790 PolarHBondContact O-N 2.84Å; L788-S791 PolarHBondContact O-N 2.98Å; L788-V792 VanDerWaalsContact O-CG2 3.31Å; L788-V792 WeakPolarHBondContact O-CG2 3.32Å; L788-V792 PolarHBondContact O-N 3.05Å
789	R	74	Confident	67.1	Low	135 Å²	135	79.9 Å²	79.9	51%	0.509	39%	0.387	S	S	.	.	H	α-helix	trans	-56.3	-42.3	176.9	-81.8	-168.6	-83.9	-94.2	0.2	112.2	D785 S786 V792 K793	D785-R789 VanDerWaalsContact CG-CZ 3.48Å; D785-R789 VanDerWaalsContact CG-NH2 3.3Å; D785-R789 WeakPolarHBondContact O-CG 3.29Å; D785-R789 PolarHBondContact O-N 3.22Å; D785-R789 VanDerWaalsContact O-N 3.13Å; D785-R789 IonicContact OD1-CZ 3.83Å; D785-R789 IonicContact OD1-NH1 3.71Å; D785-R789 PolarHBondContact OD1-NH1 3.01Å; D785-R789 IonicContact OD1-NH2 2.89Å; D785-R789 IonicContact OD2-CZ 3.04Å; D785-R789 IonicContact OD2-NH1 2.88Å; D785-R789 PolarHBondContact OD2-NH1 3.32Å; D785-R789 IonicContact OD2-NH2 3.29Å; D785-R789 PolarHBondContact OD2-NH2 3.49Å; S786-R789 PolarHBondContact O-N 3.21Å; R789-V792 PolarHBondContact O-N 3.39Å; R789-K793 WeakPolarHBondContact O-CG 3.39Å; R789-K793 PolarHBondContact O-N 3.25Å; R789-K793 VanDerWaalsContact O-N 3.08Å
790	E	72.9	Confident	69.5	Low	69 Å²	69	76.7 Å²	76.7	32%	0.322	37%	0.365	S	S	.	.	H	α-helix	trans	-72.5	-40.5	-179.7	-162.1	56.8	-147.5	0	0	112.3	I658 S786 L787 L788 V792 K793 R794	I658-E790 HydrophobicContact CD1-CB 4.02Å; I658-E790 HydrophobicContact CD1-CG 3.39Å; S786-E790 PolarHBondContact O-N 3.33Å; S786-E790 VanDerWaalsContact O-N 3.1Å; L787-E790 PolarHBondContact O-N 2.96Å; L788-E790 VanDerWaalsContact C-N 3.28Å; L788-E790 PolarHBondContact O-N 2.84Å; E790-V792 VanDerWaalsContact C-N 3.3Å; E790-V792 PolarHBondContact O-N 3.48Å; E790-K793 PolarHBondContact O-N 3.45Å; E790-K793 IonicContact OE2-NZ 2.76Å; E790-R794 WeakPolarHBondContact O-CG 3.36Å; E790-R794 PolarHBondContact O-N 2.65Å
791	S	75.3	Confident	71.9	Confident	5 Å²	5	69.4 Å²	69.4	4%	0.035	34%	0.337	C	S	.	.	H	α-helix	trans	-56.8	-42.5	171.5	-78.7	0	0	0	0	112.2	I658 P659 L787 L788 R794 L795	I658-S791 WeakPolarHBondContact CG2-OG 3.36Å; P659-S791 PolarHBondContact O-OG 3.24Å; L787-S791 WeakPolarHBondContact O-CB 3.48Å; L787-S791 PolarHBondContact O-N 2.96Å; L787-S791 PolarHBondContact O-OG 2.86Å; L788-S791 PolarHBondContact O-N 2.98Å; S791-R794 PolarHBondContact O-N 3.4Å; S791-L795 WeakPolarHBondContact O-CB 3.39Å; S791-L795 PolarHBondContact O-N 2.99Å
792	V	80.1	Confident	74.1	Confident	4 Å²	4	62.4 Å²	62.4	2%	0.024	30%	0.302	C	S	.	.	H	α-helix	trans	-68.1	-41.1	178.1	175	0	0	0	0	111.7	P745 L746 L788 R789 E790 R794 L795 R796	P745-V792 HydrophobicContact CG-CG2 3.85Å; L746-V792 HydrophobicContact CD1-CG1 3.93Å; L746-V792 HydrophobicContact CD1-CG2 4.29Å; L746-V792 HydrophobicContact CG-CG1 4.42Å; L746-V792 HydrophobicContact CG-CG2 4.17Å; L788-V792 VanDerWaalsContact O-CG2 3.31Å; L788-V792 WeakPolarHBondContact O-CG2 3.32Å; L788-V792 PolarHBondContact O-N 3.05Å; R789-V792 PolarHBondContact O-N 3.39Å; E790-V792 VanDerWaalsContact C-N 3.3Å; E790-V792 PolarHBondContact O-N 3.48Å; V792-R794 VanDerWaalsContact C-N 3.31Å; V792-R794 PolarHBondContact O-N 2.84Å; V792-L795 PolarHBondContact O-N 3.46Å; V792-R796 WeakPolarHBondContact O-CG 3.48Å; V792-R796 PolarHBondContact O-N 3.09Å
793	K	78.7	Confident	76.4	Confident	123 Å²	123	58.9 Å²	58.9	54%	0.535	28%	0.281	S	S	.	.	H	α-helix	trans	-58.8	-43.9	173.9	-75.9	176.3	-179	179.7	0	111.5	R789 E790 R796 K797	R789-K793 WeakPolarHBondContact O-CG 3.39Å; R789-K793 PolarHBondContact O-N 3.25Å; R789-K793 VanDerWaalsContact O-N 3.08Å; E790-K793 PolarHBondContact O-N 3.45Å; E790-K793 IonicContact OE2-NZ 2.76Å; K793-R796 PolarHBondContact O-N 3.48Å; K793-K797 WeakPolarHBondContact O-CB 3.41Å; K793-K797 PolarHBondContact O-N 3Å
794	R	79.9	Confident	78.1	Confident	21 Å²	21	55.3 Å²	55.3	8%	0.079	26%	0.258	C	S	.	.	H	α-helix	trans	-65.4	-43.7	176.8	-71	-167.1	64.9	-147.6	-14.6	112.5	Q655 K656 I658 L660 E790 S791 V792 R796 K797 E798	Q655-R794 PolarHBondContact O-NH1 3.41Å; K656-R794 PolarHBondContact O-NH1 3.02Å; I658-R794 PolarHBondContact O-NH1 3.36Å; L660-R794 HydrophobicContact CD2-CB 3.82Å; E790-R794 WeakPolarHBondContact O-CG 3.36Å; E790-R794 PolarHBondContact O-N 2.65Å; S791-R794 PolarHBondContact O-N 3.4Å; V792-R794 VanDerWaalsContact C-N 3.31Å; V792-R794 PolarHBondContact O-N 2.84Å; R794-R796 VanDerWaalsContact C-N 3.3Å; R794-R796 PolarHBondContact O-N 3.27Å; R794-K797 PolarHBondContact O-N 3.33Å; R794-E798 IonicContact CZ-OE1 3.42Å; R794-E798 IonicContact CZ-OE2 2.81Å; R794-E798 IonicContact NE-OE1 2.69Å; R794-E798 PolarHBondContact NE-OE1 3.49Å; R794-E798 IonicContact NE-OE2 3.81Å; R794-E798 IonicContact NH2-OE1 2.89Å; R794-E798 PolarHBondContact NH2-OE1 3.2Å; R794-E798 IonicContact NH2-OE2 3.92Å; R794-E798 PolarHBondContact NH2-OE2 3.37Å; R794-E798 WeakPolarHBondContact O-CB 3.43Å; R794-E798 PolarHBondContact O-N 3.35Å
795	L	84	Confident	79.3	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-55.4	-45.6	174.1	-179.6	69.9	0	0	0	111.7	L661 L662 P745 S791 V792 Y799 I800	L661-L795 WeakPolarHBondContact O-CD2 3.45Å; L662-L795 HydrophobicContact CD2-CD1 3.88Å; P745-L795 HydrophobicContact CG-CD2 3.82Å; S791-L795 WeakPolarHBondContact O-CB 3.39Å; S791-L795 PolarHBondContact O-N 2.99Å; V792-L795 PolarHBondContact O-N 3.46Å; L795-Y799 HydrophobicContact CD1-CD1 4.42Å; L795-Y799 HydrophobicContact CD1-CG 4.37Å; L795-Y799 WeakPolarHBondContact O-CB 3.41Å; L795-Y799 PolarHBondContact O-N 3.41Å; L795-Y799 VanDerWaalsContact O-N 3.11Å; L795-I800 HydrophobicContact CD2-CD1 4.18Å; L795-I800 HydrophobicContact CG-CD1 4.02Å; L795-I800 HydrophobicContact CG-CG1 4.22Å; L795-I800 PolarHBondContact O-N 3.39Å
796	R	83	Confident	80.3	Confident	109 Å²	109	46.5 Å²	46.5	41%	0.411	21%	0.211	S	C	.	.	I	π-helix	trans	-63.2	-44.6	178.4	-71.3	177.7	-172.9	148.2	2	112.5	D744 V792 K793 R794 I800 R801	D744-R796 IonicContact OD1-NH2 3.78Å; D744-R796 IonicContact OD2-CZ 3.37Å; D744-R796 IonicContact OD2-NE 2.67Å; D744-R796 PolarHBondContact OD2-NE 3.46Å; D744-R796 VanDerWaalsContact OD2-NE 3.1Å; D744-R796 IonicContact OD2-NH2 3.97Å; D744-R796 PolarHBondContact OD2-NH2 3.35Å; V792-R796 WeakPolarHBondContact O-CG 3.48Å; V792-R796 PolarHBondContact O-N 3.09Å; K793-R796 PolarHBondContact O-N 3.48Å; R794-R796 VanDerWaalsContact C-N 3.3Å; R794-R796 PolarHBondContact O-N 3.27Å; R796-I800 HydrophobicContact CG-CD1 4.11Å; R796-R801 WeakPolarHBondContact O-CB 3.48Å; R796-R801 PolarHBondContact O-N 3.44Å
797	K	76.9	Confident	81.4	Confident	96 Å²	96	44.2 Å²	44.2	42%	0.417	20%	0.195	S	C	.	.	I	π-helix	trans	-76.6	-46.4	-175.3	-174.4	177.7	178.4	175.3	0	113.3	K793 R794 P802	K793-K797 WeakPolarHBondContact O-CB 3.41Å; K793-K797 PolarHBondContact O-N 3Å; R794-K797 PolarHBondContact O-N 3.33Å; K797-P802 WeakPolarHBondContact O-CD 3.02Å
798	E	79.4	Confident	82.3	Confident	70 Å²	70	41.7 Å²	41.7	33%	0.327	18%	0.182	S	C	.	.	I	π-helix	trans	-94.7	-18.7	-169.6	-64.5	174.5	-149.6	0	0	113.4	L660 R794	L660-E798 HydrophobicContact CD2-CB 4.47Å; R794-E798 IonicContact CZ-OE1 3.42Å; R794-E798 IonicContact CZ-OE2 2.81Å; R794-E798 IonicContact NE-OE1 2.69Å; R794-E798 PolarHBondContact NE-OE1 3.49Å; R794-E798 IonicContact NE-OE2 3.81Å; R794-E798 IonicContact NH2-OE1 2.89Å; R794-E798 PolarHBondContact NH2-OE1 3.2Å; R794-E798 IonicContact NH2-OE2 3.92Å; R794-E798 PolarHBondContact NH2-OE2 3.37Å; R794-E798 WeakPolarHBondContact O-CB 3.43Å; R794-E798 PolarHBondContact O-N 3.35Å
799	Y	86.1	Confident	82.9	Confident	4 Å²	4	39.5 Å²	39.5	2%	0.016	17%	0.17	C	C	.	.	I	π-helix	trans	-121.9	-61.5	-178.4	-165.6	-88.5	0	0	0	112.5	L662 Y668 H708 R739 I742 L795 R801 P802 V803	L662-Y799 HydrophobicContact CD2-CD1 4.08Å; L662-Y799 HydrophobicContact CD2-CD2 3.66Å; L662-Y799 HydrophobicContact CD2-CE1 4.09Å; L662-Y799 HydrophobicContact CD2-CE2 3.64Å; L662-Y799 HydrophobicContact CD2-CG 3.89Å; Y668-Y799 HydrophobicContact CE1-CE1 4.12Å; H708-Y799 HydrophobicContact CB-CD2 4.19Å; H708-Y799 AromaticContact CD2-CD2 3.64Å; H708-Y799 AromaticContact CE1-CD2 3.76Å; H708-Y799 AromaticContact CE1-CE2 3.66Å; H708-Y799 AromaticContact CG-CD2 3.58Å; H708-Y799 AromaticContact CG-CE2 3.93Å; H708-Y799 AromaticContact ND1-CD2 3.66Å; H708-Y799 AromaticContact ND1-CE2 3.52Å; H708-Y799 AromaticContact NE2-CD2 3.75Å; R739-Y799 PolarHBondContact NH1-OH 3.33Å; I742-Y799 HydrophobicContact CD1-CD1 4.03Å; I742-Y799 HydrophobicContact CD1-CE1 3.99Å; L795-Y799 HydrophobicContact CD1-CD1 4.42Å; L795-Y799 HydrophobicContact CD1-CG 4.37Å; L795-Y799 WeakPolarHBondContact O-CB 3.41Å; L795-Y799 PolarHBondContact O-N 3.41Å; L795-Y799 VanDerWaalsContact O-N 3.11Å; Y799-R801 PolarHBondContact O-N 3.04Å; Y799-P802 WeakPolarHBondContact O-CD 3.43Å; Y799-V803 HydrophobicContact CD1-CG2 4.31Å; Y799-V803 HydrophobicContact CE1-CG2 4.2Å; Y799-V803 WeakPolarHBondContact O-CB 3.39Å; Y799-V803 WeakPolarHBondContact O-CG2 3.34Å; Y799-V803 PolarHBondContact O-N 3.28Å; Y799-V803 VanDerWaalsContact O-N 3.12Å
800	I	88	Confident	83.7	Confident	8 Å²	8	33.2 Å²	33.2	4%	0.041	15%	0.146	C	C	.	.	I	π-helix	trans	-62.6	-49.8	-171	-62.7	175.4	0	0	0	111.6	I742 L795 R796 R804	I742-I800 HydrophobicContact CB-CG1 4.24Å; I742-I800 HydrophobicContact CD1-CB 4.24Å; I742-I800 HydrophobicContact CD1-CG1 4.07Å; I742-I800 HydrophobicContact CD1-CG2 4.29Å; I742-I800 HydrophobicContact CG2-CD1 4.28Å; I742-I800 HydrophobicContact CG2-CG1 3.96Å; L795-I800 HydrophobicContact CD2-CD1 4.18Å; L795-I800 HydrophobicContact CG-CD1 4.02Å; L795-I800 HydrophobicContact CG-CG1 4.22Å; L795-I800 PolarHBondContact O-N 3.39Å; R796-I800 HydrophobicContact CG-CD1 4.11Å; I800-R804 HydrophobicContact CG2-CG 4.38Å; I800-R804 WeakPolarHBondContact O-CB 3.31Å; I800-R804 VanDerWaalsContact O-CG 3.29Å; I800-R804 WeakPolarHBondContact O-CG 3.25Å; I800-R804 PolarHBondContact O-N 3.31Å
801	R	82.1	Confident	84.6	Confident	51 Å²	51	30 Å²	30	19%	0.192	13%	0.131	C	C	.	.	H	α-helix	trans	-62.3	-52.3	-178.8	169.2	170.6	163.5	-122.6	-13.2	112.7	S284 D288 R796 Y799 V803 R804 I805 M845	S284-R801 VanDerWaalsContact C-NH2 3.29Å; S284-R801 PolarHBondContact O-NH2 3Å; S284-R801 PolarHBondContact OG-NH1 2.87Å; S284-R801 PolarHBondContact OG-NH2 3.33Å; D288-R801 IonicContact OD1-CZ 3.98Å; D288-R801 VanDerWaalsContact OD1-CZ 3.31Å; D288-R801 IonicContact OD1-NE 3.37Å; D288-R801 PolarHBondContact OD1-NE 3.07Å; D288-R801 IonicContact OD1-NH2 2.7Å; D288-R801 PolarHBondContact OD1-NH2 2.86Å; D288-R801 IonicContact OD2-CZ 3.99Å; D288-R801 IonicContact OD2-NE 3.76Å; D288-R801 PolarHBondContact OD2-NE 3.27Å; D288-R801 IonicContact OD2-NH2 3.27Å; D288-R801 PolarHBondContact OD2-NH2 3.47Å; R796-R801 WeakPolarHBondContact O-CB 3.48Å; R796-R801 PolarHBondContact O-N 3.44Å; Y799-R801 PolarHBondContact O-N 3.04Å; R801-V803 VanDerWaalsContact C-N 3.33Å; R801-V803 PolarHBondContact O-N 3.03Å; R801-R804 PolarHBondContact O-N 2.98Å; R801-I805 HydrophobicContact CG-CD1 3.72Å; R801-I805 WeakPolarHBondContact O-CG1 3.37Å; R801-I805 PolarHBondContact O-N 3.04Å; R801-M845 HydrophobicContact CG-CE 4.02Å
802	P	84.1	Confident	85.2	Confident	28 Å²	28	31.6 Å²	31.6	18%	0.182	14%	0.137	C	C	.	.	H	α-helix	trans	-58	-40.5	177.4	-28.4	35.8	0	0	0	114	H708 K797 Y799 S806	H708-P802 HydrophobicContact CB-CB 4.16Å; K797-P802 WeakPolarHBondContact O-CD 3.02Å; Y799-P802 WeakPolarHBondContact O-CD 3.43Å; P802-S806 VanDerWaalsContact O-CB 3.29Å; P802-S806 WeakPolarHBondContact O-CB 3.37Å; P802-S806 PolarHBondContact O-N 2.92Å; P802-S806 PolarHBondContact O-OG 3.27Å
803	V	89.6	Confident	85.5	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.3	-47.5	178.1	174.6	0	0	0	0	110.8	H708 R739 I742 Y799 R801 I805 S806 V807	H708-V803 HydrophobicContact CB-CG2 3.9Å; R739-V803 HydrophobicContact CG-CG1 3.83Å; R739-V803 WeakPolarHBondContact O-CG1 3.49Å; I742-V803 HydrophobicContact CD1-CB 3.98Å; I742-V803 HydrophobicContact CD1-CG1 3.97Å; I742-V803 HydrophobicContact CD1-CG2 4.46Å; Y799-V803 HydrophobicContact CD1-CG2 4.31Å; Y799-V803 HydrophobicContact CE1-CG2 4.2Å; Y799-V803 WeakPolarHBondContact O-CB 3.39Å; Y799-V803 WeakPolarHBondContact O-CG2 3.34Å; Y799-V803 PolarHBondContact O-N 3.28Å; Y799-V803 VanDerWaalsContact O-N 3.12Å; R801-V803 VanDerWaalsContact C-N 3.33Å; R801-V803 PolarHBondContact O-N 3.03Å; V803-I805 PolarHBondContact O-N 3.4Å; V803-S806 WeakPolarHBondContact O-CB 3.4Å; V803-S806 PolarHBondContact O-N 3.32Å; V803-V807 HydrophobicContact CG1-CG2 4.45Å; V803-V807 WeakPolarHBondContact O-CG2 3.4Å; V803-V807 PolarHBondContact O-N 2.67Å
804	R	89.4	Confident	86.2	Confident	54 Å²	54	26.1 Å²	26.1	20%	0.204	11%	0.113	C	C	.	.	H	α-helix	trans	-60.4	-44.7	179.6	-75.2	179.5	174.3	164.5	-2.1	112.3	F740 I800 R801 S806 V807 L808 M845	F740-R804 HydrophobicContact CD1-CG 4.43Å; F740-R804 HydrophobicContact CD2-CB 3.89Å; F740-R804 HydrophobicContact CD2-CG 3.72Å; F740-R804 HydrophobicContact CE1-CG 4.36Å; F740-R804 HydrophobicContact CE2-CB 3.58Å; F740-R804 HydrophobicContact CE2-CG 3.64Å; F740-R804 HydrophobicContact CG-CG 4.12Å; F740-R804 HydrophobicContact CZ-CB 4.22Å; F740-R804 HydrophobicContact CZ-CG 3.97Å; F740-R804 PolarHBondContact O-NE 3.25Å; I800-R804 HydrophobicContact CG2-CG 4.38Å; I800-R804 WeakPolarHBondContact O-CB 3.31Å; I800-R804 VanDerWaalsContact O-CG 3.29Å; I800-R804 WeakPolarHBondContact O-CG 3.25Å; I800-R804 PolarHBondContact O-N 3.31Å; R801-R804 PolarHBondContact O-N 2.98Å; R804-S806 VanDerWaalsContact C-N 3.35Å; R804-V807 PolarHBondContact O-N 3.26Å; R804-L808 WeakPolarHBondContact O-CG 3.29Å; R804-L808 PolarHBondContact O-N 2.72Å; R804-L808 VanDerWaalsContact O-N 3.13Å; R804-M845 HydrophobicContact CB-SD 4.19Å
805	I	83	Confident	86.7	Confident	14 Å²	14	25.1 Å²	25.1	7%	0.072	11%	0.11	C	C	.	.	H	α-helix	trans	-62.4	-44.8	176	-66	161.2	0	0	0	110.6	D288 R801 V803 V807 L808 K809 M845	D288-I805 HydrophobicContact CB-CD1 4.12Å; D288-I805 WeakPolarHBondContact OD1-CD1 3.36Å; R801-I805 HydrophobicContact CG-CD1 3.72Å; R801-I805 WeakPolarHBondContact O-CG1 3.37Å; R801-I805 PolarHBondContact O-N 3.04Å; V803-I805 PolarHBondContact O-N 3.4Å; I805-V807 VanDerWaalsContact C-N 3.34Å; I805-V807 PolarHBondContact O-N 2.94Å; I805-L808 PolarHBondContact O-N 3.1Å; I805-K809 VanDerWaalsContact O-CB 3.31Å; I805-K809 WeakPolarHBondContact O-CB 3.43Å; I805-K809 PolarHBondContact O-N 3.08Å; I805-M845 HydrophobicContact CD1-CE 3.67Å; I805-M845 HydrophobicContact CG1-CE 3.36Å; I805-M845 HydrophobicContact CG1-SD 4.25Å
806	S	87.8	Confident	86.6	Confident	9 Å²	9	28.2 Å²	28.2	6%	0.063	13%	0.126	C	C	.	.	H	α-helix	trans	-60.9	-41.7	179.1	-67.3	0	0	0	0	112.1	P802 V803 R804 K809 V810	P802-S806 VanDerWaalsContact O-CB 3.29Å; P802-S806 WeakPolarHBondContact O-CB 3.37Å; P802-S806 PolarHBondContact O-N 2.92Å; P802-S806 PolarHBondContact O-OG 3.27Å; V803-S806 WeakPolarHBondContact O-CB 3.4Å; V803-S806 PolarHBondContact O-N 3.32Å; R804-S806 VanDerWaalsContact C-N 3.35Å; S806-K809 WeakPolarHBondContact O-CB 3.46Å; S806-K809 PolarHBondContact O-N 3.32Å; S806-V810 VanDerWaalsContact O-CG2 3.25Å; S806-V810 WeakPolarHBondContact O-CG2 3.5Å; S806-V810 PolarHBondContact O-N 3.18Å
807	V	92.3	Very high	86.6	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-58.9	-50.8	174.1	170.1	0	0	0	0	110.7	T706 L736 R739 F740 V803 R804 I805 K809 V810 I811	T706-V807 HydrophobicContact CG2-CB 4.5Å; T706-V807 HydrophobicContact CG2-CG2 3.78Å; L736-V807 HydrophobicContact CB-CG1 4.15Å; L736-V807 HydrophobicContact CD2-CG1 4.45Å; R739-V807 HydrophobicContact CB-CG2 4.23Å; R739-V807 HydrophobicContact CG-CG2 3.9Å; F740-V807 HydrophobicContact CB-CG1 4.29Å; F740-V807 HydrophobicContact CD2-CB 4.25Å; F740-V807 HydrophobicContact CD2-CG1 4.19Å; V803-V807 HydrophobicContact CG1-CG2 4.45Å; V803-V807 WeakPolarHBondContact O-CG2 3.4Å; V803-V807 PolarHBondContact O-N 2.67Å; R804-V807 PolarHBondContact O-N 3.26Å; I805-V807 VanDerWaalsContact C-N 3.34Å; I805-V807 PolarHBondContact O-N 2.94Å; V807-K809 VanDerWaalsContact C-N 3.28Å; V807-K809 PolarHBondContact O-N 3.26Å; V807-V810 PolarHBondContact O-N 3.34Å; V807-I811 HydrophobicContact CG1-CD1 3.9Å; V807-I811 WeakPolarHBondContact O-CG1 3.43Å; V807-I811 PolarHBondContact O-N 2.86Å
808	L	89.1	Confident	87.2	Confident	3 Å²	3	24.3 Å²	24.3	2%	0.016	11%	0.109	C	C	.	.	H	α-helix	trans	-62.6	-35.6	179.9	-65.4	175.1	0	0	0	112.3	F740 R804 I805 I811 K812 F835 L836 I839 C848 L852	F740-L808 HydrophobicContact CE2-CD1 4.18Å; F740-L808 HydrophobicContact CE2-CD2 4.35Å; F740-L808 HydrophobicContact CE2-CG 4.12Å; R804-L808 WeakPolarHBondContact O-CG 3.29Å; R804-L808 PolarHBondContact O-N 2.72Å; R804-L808 VanDerWaalsContact O-N 3.13Å; I805-L808 PolarHBondContact O-N 3.1Å; L808-I811 PolarHBondContact O-N 3.13Å; L808-K812 WeakPolarHBondContact O-CB 3.31Å; L808-K812 PolarHBondContact O-N 3.14Å; L808-F835 HydrophobicContact CD2-CE1 4.46Å; L808-L836 HydrophobicContact CD2-CD2 4.43Å; L808-I839 HydrophobicContact CD2-CD1 3.89Å; L808-C848 HydrophobicContact CD1-CB 4.08Å; L808-L852 HydrophobicContact CB-CD1 4.44Å; L808-L852 HydrophobicContact CD2-CD1 4.16Å
809	K	85.1	Confident	87.6	Confident	26 Å²	26	22.6 Å²	22.6	11%	0.113	10%	0.1	C	C	.	.	H	α-helix	trans	-66.1	-41.3	174.8	178.3	176.5	178.5	166.8	0	112.6	E291 I805 S806 V807 K812 Q813	E291-K809 HydrophobicContact CG-CD 4.37Å; E291-K809 VanDerWaalsContact CG-NZ 3.32Å; E291-K809 WeakPolarHBondContact O-CD 3.44Å; E291-K809 WeakPolarHBondContact O-CE 3.45Å; E291-K809 PolarHBondContact O-NZ 2.95Å; E291-K809 IonicContact OE1-NZ 3.83Å; I805-K809 VanDerWaalsContact O-CB 3.31Å; I805-K809 WeakPolarHBondContact O-CB 3.43Å; I805-K809 PolarHBondContact O-N 3.08Å; S806-K809 WeakPolarHBondContact O-CB 3.46Å; S806-K809 PolarHBondContact O-N 3.32Å; V807-K809 VanDerWaalsContact C-N 3.28Å; V807-K809 PolarHBondContact O-N 3.26Å; K809-K812 PolarHBondContact O-N 3.45Å; K809-Q813 PolarHBondContact O-N 3.34Å; K809-Q813 VanDerWaalsContact O-N 3.08Å
810	V	91.1	Very high	87.6	Confident	2 Å²	2	22.9 Å²	22.9	1%	0.012	10%	0.101	C	C	.	.	H	α-helix	trans	-62	-46.7	173.7	171.7	0	0	0	0	109.8	L705 T706 V716 L720 L736 S806 V807 Q813 W814	L705-V810 HydrophobicContact CD1-CG2 4.32Å; L705-V810 HydrophobicContact CD2-CG1 3.94Å; L705-V810 HydrophobicContact CD2-CG2 4.29Å; L705-V810 HydrophobicContact CG-CG1 4.39Å; L705-V810 HydrophobicContact CG-CG2 3.88Å; T706-V810 HydrophobicContact CG2-CG2 4.18Å; V716-V810 HydrophobicContact CG1-CG1 4.49Å; V716-V810 HydrophobicContact CG1-CG2 3.96Å; V716-V810 HydrophobicContact CG2-CG2 4.24Å; L720-V810 HydrophobicContact CD2-CG1 4.14Å; L736-V810 HydrophobicContact CD1-CG1 4.19Å; L736-V810 HydrophobicContact CD2-CG1 4.39Å; S806-V810 VanDerWaalsContact O-CG2 3.25Å; S806-V810 WeakPolarHBondContact O-CG2 3.5Å; S806-V810 PolarHBondContact O-N 3.18Å; V807-V810 PolarHBondContact O-N 3.34Å; V810-Q813 PolarHBondContact O-N 3.39Å; V810-W814 WeakPolarHBondContact O-CB 3.49Å; V810-W814 PolarHBondContact O-N 3.23Å
811	I	92.3	Very high	87.7	Confident	1 Å²	1	22.6 Å²	22.6	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-59.7	-47.3	176.4	-69.4	170.6	0	0	0	111	L736 V807 L808 Q813 W814 I815 L832 F835 L852	L736-I811 HydrophobicContact CD1-CG1 4.21Å; V807-I811 HydrophobicContact CG1-CD1 3.9Å; V807-I811 WeakPolarHBondContact O-CG1 3.43Å; V807-I811 PolarHBondContact O-N 2.86Å; L808-I811 PolarHBondContact O-N 3.13Å; I811-Q813 VanDerWaalsContact C-N 3.3Å; I811-Q813 PolarHBondContact O-N 2.82Å; I811-W814 WeakPolarHBondContact O-CB 3.24Å; I811-W814 PolarHBondContact O-N 3.13Å; I811-W814 VanDerWaalsContact O-N 3.07Å; I811-I815 HydrophobicContact CG2-CD1 3.82Å; I811-I815 HydrophobicContact CG2-CG1 4.42Å; I811-I815 WeakPolarHBondContact O-CG1 3.4Å; I811-I815 PolarHBondContact O-N 3.42Å; I811-L832 HydrophobicContact CD1-CD1 4.37Å; I811-L832 HydrophobicContact CG2-CD1 3.79Å; I811-L832 HydrophobicContact CG2-CD2 4.36Å; I811-F835 HydrophobicContact CD1-CD1 4.33Å; I811-F835 HydrophobicContact CD1-CE1 3.74Å; I811-L852 HydrophobicContact CG2-CD1 4.47Å
812	K	87.5	Confident	88.1	Confident	39 Å²	39	20.4 Å²	20.4	17%	0.17	9%	0.091	C	C	.	.	H	α-helix	trans	-52.5	-49.1	175.6	-172.8	172.4	174.5	-84.8	0	111.6	M292 L808 K809 W814 I815 D816 L852	M292-K812 HydrophobicContact CG-CD 4.07Å; L808-K812 WeakPolarHBondContact O-CB 3.31Å; L808-K812 PolarHBondContact O-N 3.14Å; K809-K812 PolarHBondContact O-N 3.45Å; K812-W814 VanDerWaalsContact C-N 3.34Å; K812-I815 PolarHBondContact O-N 3.38Å; K812-D816 WeakPolarHBondContact O-CB 3.33Å; K812-D816 PolarHBondContact O-N 2.91Å; K812-L852 HydrophobicContact CB-CD2 3.65Å; K812-L852 HydrophobicContact CD-CD2 4.38Å; K812-L852 HydrophobicContact CG-CD2 3.81Å
813	Q	87.1	Confident	88.1	Confident	11 Å²	11	23.2 Å²	23.2	5%	0.051	11%	0.105	C	C	.	.	H	α-helix	trans	-67.8	-36.4	179.4	-172.5	-170.4	-11.7	0	0	112.1	R294 R717 L720 K809 V810 I811 D816 R817	R294-Q813 VanDerWaalsContact CZ-CD 3.46Å; R717-Q813 VanDerWaalsContact CG-NE2 3.28Å; L720-Q813 HydrophobicContact CD1-CB 3.89Å; L720-Q813 HydrophobicContact CD1-CG 3.81Å; K809-Q813 PolarHBondContact O-N 3.34Å; K809-Q813 VanDerWaalsContact O-N 3.08Å; V810-Q813 PolarHBondContact O-N 3.39Å; I811-Q813 VanDerWaalsContact C-N 3.3Å; I811-Q813 PolarHBondContact O-N 2.82Å; Q813-D816 PolarHBondContact O-N 3.22Å; Q813-R817 HydrophobicContact CG-CG 4.41Å; Q813-R817 PolarHBondContact O-N 3.03Å
814	W	92.1	Very high	87.7	Confident	1 Å²	1	29.8 Å²	29.8	0%	0.004	14%	0.135	C	C	.	.	H	α-helix	trans	-59.2	-50.3	176.5	-166.9	-2.6	0	0	0	110.3	L720 F723 Q729 L732 L733 L736 V810 I811 K812 D816 H818 D821 F822 L828	L720-W814 HydrophobicContact CD1-CB 4.29Å; L720-W814 HydrophobicContact CD2-CB 4.03Å; L720-W814 HydrophobicContact CD2-CD2 4.36Å; L720-W814 HydrophobicContact CD2-CG 3.99Å; F723-W814 AromaticContact CZ-CZ2 3.84Å; F723-W814 HydrophobicContact CZ-CZ2 3.84Å; Q729-W814 HydrophobicContact CB-CH2 4.37Å; Q729-W814 HydrophobicContact CB-CZ2 4.08Å; Q729-W814 HydrophobicContact CG-CZ2 4.23Å; Q729-W814 WeakPolarHBondContact O-CH2 3.42Å; L732-W814 HydrophobicContact CB-CH2 4.14Å; L732-W814 HydrophobicContact CB-CZ3 4.44Å; L732-W814 HydrophobicContact CD2-CD2 4.44Å; L732-W814 HydrophobicContact CD2-CE3 4.13Å; L732-W814 HydrophobicContact CD2-CH2 3.76Å; L732-W814 HydrophobicContact CD2-CZ2 4.06Å; L732-W814 HydrophobicContact CD2-CZ3 3.79Å; L732-W814 HydrophobicContact CG-CH2 4Å; L732-W814 HydrophobicContact CG-CZ3 3.88Å; L733-W814 HydrophobicContact CB-CH2 4.44Å; L733-W814 HydrophobicContact CB-CZ3 4.33Å; L736-W814 HydrophobicContact CD1-CE3 4.33Å; L736-W814 HydrophobicContact CD1-CZ3 4.26Å; V810-W814 WeakPolarHBondContact O-CB 3.49Å; V810-W814 PolarHBondContact O-N 3.23Å; I811-W814 WeakPolarHBondContact O-CB 3.24Å; I811-W814 PolarHBondContact O-N 3.13Å; I811-W814 VanDerWaalsContact O-N 3.07Å; K812-W814 VanDerWaalsContact C-N 3.34Å; W814-D816 PolarHBondContact O-N 3.46Å; W814-H818 CarbonylContact O-C 3.51Å; W814-H818 VanDerWaalsContact O-C 3.31Å; W814-H818 WeakPolarHBondContact O-CA 3.3Å; W814-H818 PolarHBondContact O-N 3.2Å; W814-D821 PolarHBondContact NE1-OD2 2.96Å; W814-F822 AromaticContact CD1-CE2 3.89Å; W814-F822 HydrophobicContact CD2-CE2 4.31Å; W814-F822 AromaticContact CD2-CZ 3.87Å; W814-F822 HydrophobicContact CD2-CZ 3.87Å; W814-F822 AromaticContact CE2-CZ 3.99Å; W814-F822 HydrophobicContact CE3-CZ 4.22Å; W814-F822 HydrophobicContact CG-CE2 4.08Å; W814-F822 HydrophobicContact CG-CZ 4.08Å; W814-F822 HydrophobicContact CZ2-CZ 4.44Å; W814-L828 HydrophobicContact CZ2-CD2 4.43Å
815	I	89.7	Confident	87.6	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.7	-45.4	176.6	-61.7	163.3	0	0	0	111.2	I811 K812 W819 F822 L832 L852 F855 I856 K859	I811-I815 HydrophobicContact CG2-CD1 3.82Å; I811-I815 HydrophobicContact CG2-CG1 4.42Å; I811-I815 WeakPolarHBondContact O-CG1 3.4Å; I811-I815 PolarHBondContact O-N 3.42Å; K812-I815 PolarHBondContact O-N 3.38Å; I815-W819 HydrophobicContact CG2-CE3 3.75Å; I815-W819 HydrophobicContact CG2-CZ3 3.79Å; I815-F822 HydrophobicContact CG1-CE2 3.96Å; I815-F822 HydrophobicContact CG1-CZ 4.19Å; I815-L832 HydrophobicContact CD1-CD2 4Å; I815-L832 HydrophobicContact CG1-CD2 4.15Å; I815-L852 HydrophobicContact CD1-CD2 4.31Å; I815-F855 HydrophobicContact CB-CD1 4.25Å; I815-F855 HydrophobicContact CB-CE1 4.12Å; I815-F855 HydrophobicContact CG2-CD1 3.56Å; I815-F855 HydrophobicContact CG2-CE1 3.58Å; I815-I856 HydrophobicContact CD1-CD1 4.1Å; I815-I856 HydrophobicContact CD1-CG1 3.97Å; I815-I856 HydrophobicContact CG2-CG1 4.38Å; I815-K859 HydrophobicContact CG2-CG 4.48Å
816	D	83.4	Confident	87.9	Confident	67 Å²	67	33.1 Å²	33.1	36%	0.358	16%	0.162	S	C	.	.	H	α-helix	trans	-66.1	-50.5	-174.6	-178.2	38.5	0	0	0	112.5	K812 Q813 W814 F855 K859	K812-D816 WeakPolarHBondContact O-CB 3.33Å; K812-D816 PolarHBondContact O-N 2.91Å; Q813-D816 PolarHBondContact O-N 3.22Å; W814-D816 PolarHBondContact O-N 3.46Å; D816-F855 HydrophobicContact CB-CE1 3.87Å; D816-F855 HydrophobicContact CB-CZ 3.84Å; D816-K859 PolarHBondContact O-NZ 2.72Å; D816-K859 VanDerWaalsContact O-NZ 3.08Å; D816-K859 IonicContact OD1-NZ 2.59Å
817	R	83.4	Confident	88.2	Confident	117 Å²	117	38.4 Å²	38.4	44%	0.442	19%	0.19	S	C	.	.	H	α-helix	trans	-98.3	-22.8	-170	-64	-169.2	175.3	-132.6	-6.2	114.8	Q813	Q813-R817 HydrophobicContact CG-CG 4.41Å; Q813-R817 PolarHBondContact O-N 3.03Å
818	H	88	Confident	88.2	Confident	5 Å²	5	38.6 Å²	38.6	2%	0.023	19%	0.191	C	C	.	.			trans	-129	40.1	-176.8	-44.2	-94.8	0	0	0	112.4	L720 W814 Y820 D821	L720-H818 PolarHBondContact O-CE1 3.4Å; W814-H818 CarbonylContact O-C 3.51Å; W814-H818 VanDerWaalsContact O-C 3.31Å; W814-H818 WeakPolarHBondContact O-CA 3.3Å; W814-H818 PolarHBondContact O-N 3.2Å; H818-Y820 HydrophobicContact CB-CD1 4.36Å; H818-Y820 HydrophobicContact CB-CE1 3.69Å; H818-Y820 HydrophobicContact CB-CE2 4.27Å; H818-Y820 AromaticContact ND1-CE1 3.84Å; H818-Y820 AromaticContact ND1-CZ 3.62Å; H818-Y820 PolarHBondContact ND1-OH 3.31Å; H818-Y820 PolarHBondContact O-N 3.47Å; H818-D821 PolarHBondContact O-N 3.28Å; H818-D821 VanDerWaalsContact O-N 3.14Å
819	W	88.7	Confident	88.3	Confident	35 Å²	35	39.8 Å²	39.8	13%	0.133	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-28.3	176.4	-177.5	-106.9	0	0	0	114.4	I815 D821 F822 D823 L829 I856 K859 V860	I815-W819 HydrophobicContact CG2-CE3 3.75Å; I815-W819 HydrophobicContact CG2-CZ3 3.79Å; W819-D821 PolarHBondContact O-N 2.98Å; W819-D821 VanDerWaalsContact O-N 3.09Å; W819-F822 HydrophobicContact CE3-CB 4.32Å; W819-F822 HydrophobicContact CE3-CD2 4.13Å; W819-F822 HydrophobicContact CH2-CB 4.46Å; W819-F822 HydrophobicContact CZ3-CB 4.23Å; W819-F822 HydrophobicContact CZ3-CD2 4.42Å; W819-F822 PolarHBondContact O-N 3.35Å; W819-D823 PolarHBondContact O-N 2.9Å; W819-L829 HydrophobicContact CH2-CD1 4.43Å; W819-I856 HydrophobicContact CH2-CG2 4.34Å; W819-K859 HydrophobicContact CD2-CB 3.89Å; W819-K859 HydrophobicContact CD2-CD 4.31Å; W819-K859 HydrophobicContact CD2-CG 4.32Å; W819-K859 HydrophobicContact CE3-CB 3.82Å; W819-K859 HydrophobicContact CE3-CD 4.4Å; W819-K859 HydrophobicContact CE3-CG 4.06Å; W819-K859 HydrophobicContact CG-CD 4.45Å; W819-K859 HydrophobicContact CH2-CB 3.7Å; W819-K859 HydrophobicContact CZ2-CB 3.75Å; W819-K859 HydrophobicContact CZ3-CB 3.73Å; W819-K859 HydrophobicContact CZ3-CG 4.27Å; W819-V860 HydrophobicContact CH2-CG2 3.77Å; W819-V860 HydrophobicContact CZ2-CG2 3.85Å
820	Y	86.2	Confident	88.7	Confident	9 Å²	9	42.6 Å²	42.6	4%	0.035	21%	0.213	C	C	.	.	H	α-helix	trans	-59.8	-19	-179.4	56.5	-101.9	0	0	0	114.9	R724 H818 Q824 K931 I933	R724-Y820 PolarHBondContact NH2-OH 3.24Å; R724-Y820 VanDerWaalsContact NH2-OH 3.12Å; H818-Y820 HydrophobicContact CB-CD1 4.36Å; H818-Y820 HydrophobicContact CB-CE1 3.69Å; H818-Y820 HydrophobicContact CB-CE2 4.27Å; H818-Y820 AromaticContact ND1-CE1 3.84Å; H818-Y820 AromaticContact ND1-CZ 3.62Å; H818-Y820 PolarHBondContact ND1-OH 3.31Å; H818-Y820 PolarHBondContact O-N 3.47Å; Y820-Q824 WeakPolarHBondContact O-CB 3.3Å; Y820-Q824 VanDerWaalsContact O-CG 3.23Å; Y820-Q824 WeakPolarHBondContact O-CG 3.38Å; Y820-Q824 PolarHBondContact O-N 3.4Å; Y820-K931 HydrophobicContact CD1-CD 3.83Å; Y820-K931 HydrophobicContact CG-CD 4.18Å; Y820-I933 HydrophobicContact CD2-CB 4.32Å; Y820-I933 HydrophobicContact CD2-CD1 3.98Å; Y820-I933 HydrophobicContact CD2-CG2 4.01Å; Y820-I933 HydrophobicContact CE2-CB 3.63Å; Y820-I933 HydrophobicContact CE2-CD1 3.72Å; Y820-I933 HydrophobicContact CE2-CG1 4.2Å; Y820-I933 HydrophobicContact CE2-CG2 3.76Å
821	D	89.3	Confident	88.8	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.011	23%	0.227	C	C	.	.	H	α-helix	trans	-71.5	-42.2	172	-72.4	-24	0	0	0	111.7	R724 Q729 W814 H818 W819 D825 L828	R724-D821 IonicContact CZ-OD1 3.82Å; R724-D821 IonicContact CZ-OD2 2.67Å; R724-D821 VanDerWaalsContact CZ-OD2 3.28Å; R724-D821 IonicContact NE-OD1 2.79Å; R724-D821 PolarHBondContact NE-OD1 2.77Å; R724-D821 IonicContact NE-OD2 2.71Å; R724-D821 PolarHBondContact NE-OD2 3.24Å; R724-D821 IonicContact NH2-OD1 3.62Å; R724-D821 PolarHBondContact NH2-OD1 2.64Å; R724-D821 IonicContact NH2-OD2 3.78Å; R724-D821 PolarHBondContact NH2-OD2 2.82Å; Q729-D821 HydrophobicContact CG-CB 4.06Å; Q729-D821 PolarHBondContact NE2-OD1 2.96Å; W814-D821 PolarHBondContact NE1-OD2 2.96Å; H818-D821 PolarHBondContact O-N 3.28Å; H818-D821 VanDerWaalsContact O-N 3.14Å; W819-D821 PolarHBondContact O-N 2.98Å; W819-D821 VanDerWaalsContact O-N 3.09Å; D821-D825 WeakPolarHBondContact O-CB 3.29Å; D821-D825 PolarHBondContact O-N 3.2Å; D821-L828 HydrophobicContact CB-CD2 4.12Å
822	F	90.3	Very high	88.8	Confident	6 Å²	6	45.7 Å²	45.7	3%	0.026	23%	0.228	C	C	.	.	H	α-helix	trans	-76.9	-30.4	-179.5	-54.8	-75.9	0	0	0	112	W814 I815 W819 Q824 L828 L829 L832	W814-F822 AromaticContact CD1-CE2 3.89Å; W814-F822 HydrophobicContact CD2-CE2 4.31Å; W814-F822 AromaticContact CD2-CZ 3.87Å; W814-F822 HydrophobicContact CD2-CZ 3.87Å; W814-F822 AromaticContact CE2-CZ 3.99Å; W814-F822 HydrophobicContact CE3-CZ 4.22Å; W814-F822 HydrophobicContact CG-CE2 4.08Å; W814-F822 HydrophobicContact CG-CZ 4.08Å; W814-F822 HydrophobicContact CZ2-CZ 4.44Å; I815-F822 HydrophobicContact CG1-CE2 3.96Å; I815-F822 HydrophobicContact CG1-CZ 4.19Å; W819-F822 HydrophobicContact CE3-CB 4.32Å; W819-F822 HydrophobicContact CE3-CD2 4.13Å; W819-F822 HydrophobicContact CH2-CB 4.46Å; W819-F822 HydrophobicContact CZ3-CB 4.23Å; W819-F822 HydrophobicContact CZ3-CD2 4.42Å; W819-F822 PolarHBondContact O-N 3.35Å; F822-Q824 VanDerWaalsContact C-N 3.33Å; F822-L828 HydrophobicContact CD1-CD2 3.84Å; F822-L828 HydrophobicContact CD1-CG 4.01Å; F822-L828 HydrophobicContact CE1-CD2 3.9Å; F822-L828 HydrophobicContact CE1-CG 4.02Å; F822-L829 HydrophobicContact CB-CB 4.44Å; F822-L829 HydrophobicContact CB-CD1 4.37Å; F822-L829 HydrophobicContact CD1-CD1 4.42Å; F822-L832 HydrophobicContact CD1-CD2 4.21Å; F822-L832 HydrophobicContact CE1-CD2 3.56Å; F822-L832 HydrophobicContact CZ-CD2 3.93Å
823	D	84.7	Confident	89	Confident	87 Å²	87	46.7 Å²	46.7	47%	0.465	23%	0.233	S	C	.	.	H	α-helix	trans	-68.4	-31.5	175.6	-168.6	49.9	0	0	0	112.5	W819	W819-D823 PolarHBondContact O-N 2.9Å
824	Q	81.2	Confident	89.2	Confident	137 Å²	137	51.7 Å²	51.7	64%	0.64	26%	0.256	S	S	*	.	H	α-helix	trans	-90.5	-23.8	-179.2	-69.7	178.1	9.7	0	0	113.5	Y820 F822	Y820-Q824 WeakPolarHBondContact O-CB 3.3Å; Y820-Q824 VanDerWaalsContact O-CG 3.23Å; Y820-Q824 WeakPolarHBondContact O-CG 3.38Å; Y820-Q824 PolarHBondContact O-N 3.4Å; F822-Q824 VanDerWaalsContact C-N 3.33Å
825	D	87.9	Confident	89.2	Confident	45 Å²	45	51.9 Å²	51.9	24%	0.241	26%	0.257	C	S	.	.			trans	-126.8	94.5	-175.4	-171.8	-14	0	0	0	110.7	D821 D827 L828 L829	D821-D825 WeakPolarHBondContact O-CB 3.29Å; D821-D825 PolarHBondContact O-N 3.2Å; D825-D827 VanDerWaalsContact C-N 3.26Å; D825-D827 PolarHBondContact O-N 3.18Å; D825-D827 WeakPolarHBondContact OD1-CB 3.42Å; D825-D827 PolarHBondContact OD1-N 3.16Å; D825-D827 VanDerWaalsContact OD1-N 3.1Å; D825-L828 HydrophobicContact CB-CB 3.86Å; D825-L828 WeakPolarHBondContact O-CB 3.43Å; D825-L828 PolarHBondContact O-N 3.4Å; D825-L828 PolarHBondContact OD1-N 3.2Å; D825-L828 VanDerWaalsContact OD1-N 3.09Å; D825-L829 PolarHBondContact O-N 3.17Å
826	P	89.7	Confident	89.2	Confident	93 Å²	93	51.9 Å²	51.9	60%	0.604	26%	0.257	S	S	*	.	H	α-helix	trans	-67.1	-25.7	179.4	27.3	-34.2	0	0	0	113.1	L829 L830	P826-L829 PolarHBondContact O-N 3.36Å; P826-L830 WeakPolarHBondContact O-CB 3.07Å; P826-L830 PolarHBondContact O-N 3.34Å
827	D	92.3	Very high	89.4	Confident	120 Å²	120	55 Å²	55	64%	0.642	27%	0.267	S	S	*	.	H	α-helix	trans	-71.2	-37.6	178	-66	-39.8	0	0	0	110.5	D825 L830 H831	D825-D827 VanDerWaalsContact C-N 3.26Å; D825-D827 PolarHBondContact O-N 3.18Å; D825-D827 WeakPolarHBondContact OD1-CB 3.42Å; D825-D827 PolarHBondContact OD1-N 3.16Å; D825-D827 VanDerWaalsContact OD1-N 3.1Å; D827-L830 PolarHBondContact O-N 3.39Å; D827-H831 WeakPolarHBondContact O-CB 3.44Å; D827-H831 PolarHBondContact O-N 3.07Å
828	L	92.6	Very high	89.7	Confident	4 Å²	4	54.2 Å²	54.2	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-60.7	-44.1	172.6	-177.4	72	0	0	0	111.8	Q729 L733 W814 D821 F822 D825 H831 L832	Q729-L828 HydrophobicContact CB-CD1 4.19Å; Q729-L828 HydrophobicContact CB-CD2 3.74Å; Q729-L828 HydrophobicContact CG-CD2 4.36Å; L733-L828 HydrophobicContact CB-CD1 4.1Å; L733-L828 HydrophobicContact CD2-CD1 3.75Å; W814-L828 HydrophobicContact CZ2-CD2 4.43Å; D821-L828 HydrophobicContact CB-CD2 4.12Å; F822-L828 HydrophobicContact CD1-CD2 3.84Å; F822-L828 HydrophobicContact CD1-CG 4.01Å; F822-L828 HydrophobicContact CE1-CD2 3.9Å; F822-L828 HydrophobicContact CE1-CG 4.02Å; D825-L828 HydrophobicContact CB-CB 3.86Å; D825-L828 WeakPolarHBondContact O-CB 3.43Å; D825-L828 PolarHBondContact O-N 3.4Å; D825-L828 PolarHBondContact OD1-N 3.2Å; D825-L828 VanDerWaalsContact OD1-N 3.09Å; L828-H831 PolarHBondContact O-N 2.85Å; L828-L832 PolarHBondContact O-N 3Å
829	L	92.4	Very high	89.5	Confident	28 Å²	28	54 Å²	54	15%	0.147	26%	0.263	C	S	.	.	H	α-helix	trans	-63.6	-46.5	177.7	-179.5	60.5	0	0	0	111.1	W819 F822 D825 P826 H831 L832 E833 I856 V860	W819-L829 HydrophobicContact CH2-CD1 4.43Å; F822-L829 HydrophobicContact CB-CB 4.44Å; F822-L829 HydrophobicContact CB-CD1 4.37Å; F822-L829 HydrophobicContact CD1-CD1 4.42Å; D825-L829 PolarHBondContact O-N 3.17Å; P826-L829 PolarHBondContact O-N 3.36Å; L829-H831 VanDerWaalsContact C-N 3.3Å; L829-H831 PolarHBondContact O-N 3.12Å; L829-L832 PolarHBondContact O-N 2.57Å; L829-L832 VanDerWaalsContact O-N 3.17Å; L829-E833 HydrophobicContact CD1-CG 4.47Å; L829-E833 WeakPolarHBondContact O-CG 3.15Å; L829-E833 PolarHBondContact O-N 2.91Å; L829-I856 HydrophobicContact CD1-CG2 3.91Å; L829-V860 HydrophobicContact CD2-CG2 4.38Å
830	L	92.6	Very high	89	Confident	86 Å²	86	56.1 Å²	56.1	45%	0.45	28%	0.275	S	S	.	.	H	α-helix	trans	-59	-42.1	177.3	179.2	63.7	0	0	0	111.8	P826 D827 E833 Q834	P826-L830 WeakPolarHBondContact O-CB 3.07Å; P826-L830 PolarHBondContact O-N 3.34Å; D827-L830 PolarHBondContact O-N 3.39Å; L830-E833 PolarHBondContact O-N 2.95Å; L830-Q834 VanDerWaalsContact O-CG 3.27Å; L830-Q834 WeakPolarHBondContact O-CG 3.41Å; L830-Q834 PolarHBondContact O-N 3.22Å
831	H	93.3	Very high	88.3	Confident	66 Å²	66	61.5 Å²	61.5	31%	0.306	30%	0.304	S	S	.	.	H	α-helix	trans	-64.1	-41.2	177.5	-168.7	177.4	0	0	0	111.6	L733 N734 D827 L828 L829 Q834 F835	L733-H831 HydrophobicContact CD2-CB 3.87Å; N734-H831 PolarHBondContact OD1-CE1 3.34Å; D827-H831 WeakPolarHBondContact O-CB 3.44Å; D827-H831 PolarHBondContact O-N 3.07Å; L828-H831 PolarHBondContact O-N 2.85Å; L829-H831 VanDerWaalsContact C-N 3.3Å; L829-H831 PolarHBondContact O-N 3.12Å; H831-Q834 PolarHBondContact O-N 2.9Å; H831-F835 PolarHBondContact O-N 2.97Å
832	L	92.4	Very high	87.3	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.01	34%	0.335	C	S	.	.	H	α-helix	trans	-63.3	-44	175.5	177.1	61.2	0	0	0	112	L733 I811 I815 F822 L828 L829 Q834 F835 L836 I856	L733-L832 HydrophobicContact CD1-CD1 4.13Å; L733-L832 HydrophobicContact CD2-CB 4.32Å; I811-L832 HydrophobicContact CD1-CD1 4.37Å; I811-L832 HydrophobicContact CG2-CD1 3.79Å; I811-L832 HydrophobicContact CG2-CD2 4.36Å; I815-L832 HydrophobicContact CD1-CD2 4Å; I815-L832 HydrophobicContact CG1-CD2 4.15Å; F822-L832 HydrophobicContact CD1-CD2 4.21Å; F822-L832 HydrophobicContact CE1-CD2 3.56Å; F822-L832 HydrophobicContact CZ-CD2 3.93Å; L828-L832 PolarHBondContact O-N 3Å; L829-L832 PolarHBondContact O-N 2.57Å; L829-L832 VanDerWaalsContact O-N 3.17Å; L832-Q834 PolarHBondContact O-N 3.36Å; L832-F835 HydrophobicContact CD1-CD1 4.33Å; L832-F835 WeakPolarHBondContact O-CB 3.45Å; L832-F835 PolarHBondContact O-N 3.38Å; L832-L836 HydrophobicContact CD1-CD1 4.48Å; L832-L836 HydrophobicContact CD1-CG 4.27Å; L832-L836 HydrophobicContact CG-CD1 4.36Å; L832-L836 WeakPolarHBondContact O-CG 3.38Å; L832-L836 PolarHBondContact O-N 3.08Å; L832-I856 HydrophobicContact CD2-CD1 4.1Å; L832-I856 HydrophobicContact CG-CD1 4.43Å
833	E	91.7	Very high	86	Confident	60 Å²	60	67.8 Å²	67.8	28%	0.28	34%	0.34	S	S	.	.	H	α-helix	trans	-62.7	-40.7	177	-70.5	-177	147	0	0	112.1	L829 L830 F835 L836 K837 Q853	L829-E833 HydrophobicContact CD1-CG 4.47Å; L829-E833 WeakPolarHBondContact O-CG 3.15Å; L829-E833 PolarHBondContact O-N 2.91Å; L830-E833 PolarHBondContact O-N 2.95Å; E833-F835 VanDerWaalsContact C-N 3.33Å; E833-F835 PolarHBondContact O-N 3.34Å; E833-L836 PolarHBondContact O-N 3.14Å; E833-K837 WeakPolarHBondContact O-CB 3.4Å; E833-K837 PolarHBondContact O-N 3.2Å; E833-Q853 PolarHBondContact OE1-NE2 3.12Å
834	Q	92.2	Very high	84.8	Confident	115 Å²	115	68.8 Å²	68.8	54%	0.537	36%	0.361	S	S	.	.	H	α-helix	trans	-61.6	-41.5	174.1	-72.9	172.6	5.3	0	0	111.9	L830 H831 L832 R838	L830-Q834 VanDerWaalsContact O-CG 3.27Å; L830-Q834 WeakPolarHBondContact O-CG 3.41Å; L830-Q834 PolarHBondContact O-N 3.22Å; H831-Q834 PolarHBondContact O-N 2.9Å; L832-Q834 PolarHBondContact O-N 3.36Å; Q834-R838 WeakPolarHBondContact O-CB 3.37Å; Q834-R838 PolarHBondContact O-N 3.42Å
835	F	91.5	Very high	83.9	Confident	5 Å²	5	64.3 Å²	64.3	2%	0.022	34%	0.341	C	S	.	.	H	α-helix	trans	-63.9	-46.4	175.7	170.9	-115.1	0	0	0	112.1	I737 F740 L808 I811 H831 L832 E833 K837 R838 I839	I737-F835 HydrophobicContact CB-CD2 4.4Å; I737-F835 HydrophobicContact CB-CE2 4.31Å; I737-F835 HydrophobicContact CD1-CB 4.08Å; I737-F835 HydrophobicContact CD1-CD2 4.15Å; I737-F835 HydrophobicContact CD1-CG 4.09Å; I737-F835 HydrophobicContact CG1-CB 4.41Å; I737-F835 HydrophobicContact CG1-CD1 4.27Å; I737-F835 HydrophobicContact CG1-CD2 3.67Å; I737-F835 HydrophobicContact CG1-CE1 4.45Å; I737-F835 HydrophobicContact CG1-CE2 3.88Å; I737-F835 HydrophobicContact CG1-CG 3.86Å; I737-F835 HydrophobicContact CG1-CZ 4.25Å; I737-F835 HydrophobicContact CG2-CD2 4.09Å; I737-F835 HydrophobicContact CG2-CE2 4.12Å; F740-F835 HydrophobicContact CB-CE2 4.29Å; F740-F835 HydrophobicContact CB-CZ 3.99Å; F740-F835 AromaticContact CD1-CE2 3.99Å; F740-F835 HydrophobicContact CD1-CE2 3.99Å; F740-F835 HydrophobicContact CD1-CZ 4.04Å; F740-F835 HydrophobicContact CD2-CZ 4.02Å; F740-F835 HydrophobicContact CG-CE2 4.11Å; F740-F835 AromaticContact CG-CZ 3.75Å; F740-F835 HydrophobicContact CG-CZ 3.75Å; L808-F835 HydrophobicContact CD2-CE1 4.46Å; I811-F835 HydrophobicContact CD1-CD1 4.33Å; I811-F835 HydrophobicContact CD1-CE1 3.74Å; H831-F835 PolarHBondContact O-N 2.97Å; L832-F835 HydrophobicContact CD1-CD1 4.33Å; L832-F835 WeakPolarHBondContact O-CB 3.45Å; L832-F835 PolarHBondContact O-N 3.38Å; E833-F835 VanDerWaalsContact C-N 3.33Å; E833-F835 PolarHBondContact O-N 3.34Å; F835-K837 PolarHBondContact O-N 3.33Å; F835-R838 WeakPolarHBondContact O-CB 3.33Å; F835-R838 PolarHBondContact O-N 2.92Å; F835-I839 HydrophobicContact CD1-CD1 3.97Å; F835-I839 HydrophobicContact CD2-CD1 4.21Å; F835-I839 HydrophobicContact CE1-CD1 3.46Å; F835-I839 VanDerWaalsContact CE1-CD1 3.46Å; F835-I839 HydrophobicContact CE2-CD1 3.73Å; F835-I839 HydrophobicContact CE2-CG1 4.16Å; F835-I839 HydrophobicContact CG-CD1 4.33Å; F835-I839 HydrophobicContact CZ-CD1 3.35Å; F835-I839 HydrophobicContact CZ-CG1 4.25Å; F835-I839 WeakPolarHBondContact O-CG1 3.31Å; F835-I839 PolarHBondContact O-N 2.93Å; F835-I839 VanDerWaalsContact O-N 3.09Å
836	L	89.1	Confident	82.9	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-62	-42.1	178.1	-70.3	-179	0	0	0	111.9	L808 L832 E833 R838 I839 E840 S849 L852 I856	L808-L836 HydrophobicContact CD2-CD2 4.43Å; L832-L836 HydrophobicContact CD1-CD1 4.48Å; L832-L836 HydrophobicContact CD1-CG 4.27Å; L832-L836 HydrophobicContact CG-CD1 4.36Å; L832-L836 WeakPolarHBondContact O-CG 3.38Å; L832-L836 PolarHBondContact O-N 3.08Å; E833-L836 PolarHBondContact O-N 3.14Å; L836-R838 PolarHBondContact O-N 3.15Å; L836-I839 WeakPolarHBondContact O-CB 3.39Å; L836-I839 PolarHBondContact O-N 2.7Å; L836-E840 PolarHBondContact O-N 3.18Å; L836-E840 VanDerWaalsContact O-N 3.09Å; L836-S849 VanDerWaalsContact C-OG 3.25Å; L836-S849 WeakPolarHBondContact CA-OG 3.44Å; L836-S849 WeakPolarHBondContact CB-OG 3.38Å; L836-S849 PolarHBondContact O-OG 3.42Å; L836-L852 HydrophobicContact CD1-CB 3.96Å; L836-L852 HydrophobicContact CD2-CB 4.32Å; L836-L852 HydrophobicContact CD2-CD1 3.95Å; L836-I856 HydrophobicContact CD1-CD1 3.62Å
837	K	87.9	Confident	81.8	Confident	134 Å²	134	62.3 Å²	62.3	58%	0.583	32%	0.324	S	S	*	.	H	α-helix	trans	-61.6	-43.5	175	-172.5	175.5	-179.1	178.5	0	112.2	E833 F835 I839 E840 D841	E833-K837 WeakPolarHBondContact O-CB 3.4Å; E833-K837 PolarHBondContact O-N 3.2Å; F835-K837 PolarHBondContact O-N 3.33Å; K837-I839 VanDerWaalsContact C-N 3.26Å; K837-I839 PolarHBondContact O-N 3.44Å; K837-E840 WeakPolarHBondContact O-CB 3.21Å; K837-E840 PolarHBondContact O-N 3.02Å; K837-E840 VanDerWaalsContact O-N 3.12Å; K837-D841 PolarHBondContact O-N 3.43Å; K837-D841 VanDerWaalsContact O-N 3.16Å
838	R	89.2	Confident	80.7	Confident	99 Å²	99	57.9 Å²	57.9	37%	0.374	30%	0.301	S	S	.	.	H	α-helix	trans	-58.9	-36.5	175.2	-172.4	-178.2	71.1	170.9	11.4	112.4	D741 Q834 F835 L836 V842	D741-R838 IonicContact OD1-CZ 2.64Å; D741-R838 IonicContact OD1-NH2 2.64Å; D741-R838 PolarHBondContact OD1-NH2 3.49Å; D741-R838 IonicContact OD2-CZ 3.31Å; D741-R838 IonicContact OD2-NH1 3.31Å; D741-R838 PolarHBondContact OD2-NH1 3.44Å; D741-R838 IonicContact OD2-NH2 3.23Å; D741-R838 PolarHBondContact OD2-NH2 3.21Å; Q834-R838 WeakPolarHBondContact O-CB 3.37Å; Q834-R838 PolarHBondContact O-N 3.42Å; F835-R838 WeakPolarHBondContact O-CB 3.33Å; F835-R838 PolarHBondContact O-N 2.92Å; L836-R838 PolarHBondContact O-N 3.15Å; R838-V842 WeakPolarHBondContact O-CB 3.38Å; R838-V842 WeakPolarHBondContact O-CG2 3.47Å; R838-V842 PolarHBondContact O-N 2.98Å
839	I	84.5	Confident	79.9	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-67.8	-42.2	175.9	-67.3	164.4	0	0	0	111.1	F740 L808 F835 L836 K837 D841 V842 H843	F740-I839 HydrophobicContact CE1-CD1 4.08Å; F740-I839 HydrophobicContact CE1-CG1 3.77Å; F740-I839 HydrophobicContact CE2-CD1 4.04Å; F740-I839 HydrophobicContact CZ-CD1 3.75Å; F740-I839 HydrophobicContact CZ-CG1 3.73Å; F740-I839 HydrophobicContact CZ-CG2 4.22Å; L808-I839 HydrophobicContact CD2-CD1 3.89Å; F835-I839 HydrophobicContact CD1-CD1 3.97Å; F835-I839 HydrophobicContact CD2-CD1 4.21Å; F835-I839 HydrophobicContact CE1-CD1 3.46Å; F835-I839 VanDerWaalsContact CE1-CD1 3.46Å; F835-I839 HydrophobicContact CE2-CD1 3.73Å; F835-I839 HydrophobicContact CE2-CG1 4.16Å; F835-I839 HydrophobicContact CG-CD1 4.33Å; F835-I839 HydrophobicContact CZ-CD1 3.35Å; F835-I839 HydrophobicContact CZ-CG1 4.25Å; F835-I839 WeakPolarHBondContact O-CG1 3.31Å; F835-I839 PolarHBondContact O-N 2.93Å; F835-I839 VanDerWaalsContact O-N 3.09Å; L836-I839 WeakPolarHBondContact O-CB 3.39Å; L836-I839 PolarHBondContact O-N 2.7Å; K837-I839 VanDerWaalsContact C-N 3.26Å; K837-I839 PolarHBondContact O-N 3.44Å; I839-D841 VanDerWaalsContact C-N 3.26Å; I839-D841 PolarHBondContact O-N 3.43Å; I839-V842 PolarHBondContact O-N 3.45Å; I839-H843 HydrophobicContact CG2-CB 4.1Å; I839-H843 WeakPolarHBondContact O-CB 3.37Å; I839-H843 PolarHBondContact O-N 2.81Å
840	E	77.3	Confident	79.1	Confident	81 Å²	81	61.5 Å²	61.5	38%	0.379	31%	0.313	S	S	.	.	H	α-helix	trans	-59.1	-38.2	179	-173.9	170.9	-163.1	0	0	112.1	L836 K837 R850	L836-E840 PolarHBondContact O-N 3.18Å; L836-E840 VanDerWaalsContact O-N 3.09Å; K837-E840 WeakPolarHBondContact O-CB 3.21Å; K837-E840 PolarHBondContact O-N 3.02Å; K837-E840 VanDerWaalsContact O-N 3.12Å; E840-R850 VanDerWaalsContact OE1-CD 3.23Å; E840-R850 WeakPolarHBondContact OE1-CD 3.45Å; E840-R850 WeakPolarHBondContact OE1-CG 3.34Å; E840-R850 IonicContact OE1-NE 3.09Å
841	D	71.2	Confident	78.3	Confident	122 Å²	122	59.6 Å²	59.6	65%	0.652	31%	0.307	S	S	*	.	H	α-helix	trans	-77.3	-35	-178.5	-66.1	-29.5	0	0	0	113.6	K837 I839	K837-D841 PolarHBondContact O-N 3.43Å; K837-D841 VanDerWaalsContact O-N 3.16Å; I839-D841 VanDerWaalsContact C-N 3.26Å; I839-D841 PolarHBondContact O-N 3.43Å
842	V	68.9	Low	77.7	Confident	107 Å²	107	56.6 Å²	56.6	65%	0.648	29%	0.293	S	S	*	.	H	α-helix	trans	-107.9	-26.8	-165.5	179.6	0	0	0	0	113.5	R838 I839	R838-V842 WeakPolarHBondContact O-CB 3.38Å; R838-V842 WeakPolarHBondContact O-CG2 3.47Å; R838-V842 PolarHBondContact O-N 2.98Å; I839-V842 PolarHBondContact O-N 3.45Å
843	H	64	Low	77.4	Confident	32 Å²	32	58.6 Å²	58.6	15%	0.148	30%	0.302	C	S	.	.			trans	-116.4	145	-166.8	-61.7	70.5	0	0	0	112.1	F740 I839 M845 S846	F740-H843 AromaticContact CE1-CD2 3.88Å; F740-H843 AromaticContact CE1-CE1 3.94Å; F740-H843 AromaticContact CE1-NE2 3.62Å; I839-H843 HydrophobicContact CG2-CB 4.1Å; I839-H843 WeakPolarHBondContact O-CB 3.37Å; I839-H843 PolarHBondContact O-N 2.81Å; H843-M845 PolarHBondContact O-N 2.8Å; H843-S846 PolarHBondContact O-N 3.03Å
844	A	58.7	Low	76.8	Confident	109 Å²	109	60.9 Å²	60.9	90%	0.901	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-14.8	172.5	0	0	0	0	0	113.7	S846	A844-S846 VanDerWaalsContact C-N 3.26Å; A844-S846 PolarHBondContact O-N 3.35Å
845	M	62.9	Low	76.2	Confident	43 Å²	43	57.8 Å²	57.8	21%	0.212	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	23.8	-178.7	-61.1	-170.1	137.3	0	0	114.8	R801 R804 I805 H843 K847 C848	R801-M845 HydrophobicContact CG-CE 4.02Å; R804-M845 HydrophobicContact CB-SD 4.19Å; I805-M845 HydrophobicContact CD1-CE 3.67Å; I805-M845 HydrophobicContact CG1-CE 3.36Å; I805-M845 HydrophobicContact CG1-SD 4.25Å; H843-M845 PolarHBondContact O-N 2.8Å; M845-K847 PolarHBondContact O-N 3.44Å; M845-C848 PolarHBondContact O-N 3.2Å
846	S	66.6	Low	75.9	Confident	25 Å²	25	57.6 Å²	57.6	18%	0.175	30%	0.295	C	S	.	.	H	α-helix	trans	-54.2	-27.3	-175.5	65.1	0	0	0	0	114.8	H843 A844 R850	H843-S846 PolarHBondContact O-N 3.03Å; A844-S846 VanDerWaalsContact C-N 3.26Å; A844-S846 PolarHBondContact O-N 3.35Å; S846-R850 WeakPolarHBondContact O-CG 3.32Å; S846-R850 PolarHBondContact O-N 2.82Å; S846-R850 PolarHBondContact O-NE 3.37Å; S846-R850 PolarHBondContact OG-NH2 3.39Å
847	K	65.7	Low	75.7	Confident	71 Å²	71	61.2 Å²	61.2	31%	0.309	32%	0.315	S	S	.	.	H	α-helix	trans	-75	-37.9	-177.4	-66.9	-162.8	-170.8	-174.2	0	114.1	E307 M845 S849 R850 S851	E307-K847 VanDerWaalsContact CD-CE 3.47Å; E307-K847 WeakPolarHBondContact OE1-CD 3.32Å; E307-K847 WeakPolarHBondContact OE1-CE 3.35Å; E307-K847 IonicContact OE1-NZ 2.88Å; E307-K847 PolarHBondContact OE1-NZ 3.12Å; M845-K847 PolarHBondContact O-N 3.44Å; K847-S849 VanDerWaalsContact C-N 3.28Å; K847-S849 PolarHBondContact O-N 2.93Å; K847-R850 PolarHBondContact O-N 2.92Å; K847-S851 WeakPolarHBondContact O-CB 3.44Å; K847-S851 PolarHBondContact O-N 3.27Å
848	C	69.1	Low	75.4	Confident	26 Å²	26	62 Å²	62	18%	0.176	31%	0.314	C	S	.	.	H	α-helix	trans	-61.8	-43.2	173.9	-175.4	0	0	0	0	109.8	M292 L808 M845 S851 L852	M292-C848 HydrophobicContact SD-CB 4.32Å; M292-C848 PolarHBondContact SD-SG 3.24Å; L808-C848 HydrophobicContact CD1-CB 4.08Å; M845-C848 PolarHBondContact O-N 3.2Å; C848-S851 PolarHBondContact O-N 3.12Å; C848-L852 WeakPolarHBondContact O-CG 3.49Å; C848-L852 PolarHBondContact O-N 3.36Å
849	S	76.8	Confident	74.9	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.007	31%	0.307	C	S	.	.	H	α-helix	trans	-58	-50.8	173.4	-174.9	0	0	0	0	112.1	L836 K847 S851 L852 Q853	L836-S849 VanDerWaalsContact C-OG 3.25Å; L836-S849 WeakPolarHBondContact CA-OG 3.44Å; L836-S849 WeakPolarHBondContact CB-OG 3.38Å; L836-S849 PolarHBondContact O-OG 3.42Å; K847-S849 VanDerWaalsContact C-N 3.28Å; K847-S849 PolarHBondContact O-N 2.93Å; S849-S851 VanDerWaalsContact C-N 3.32Å; S849-S851 PolarHBondContact O-N 3.45Å; S849-L852 PolarHBondContact O-N 2.87Å; S849-L852 VanDerWaalsContact O-N 3.09Å; S849-Q853 PolarHBondContact O-N 3.2Å
850	R	75.8	Confident	74.8	Confident	108 Å²	108	61.8 Å²	61.8	41%	0.408	32%	0.319	S	S	.	.	H	α-helix	trans	-59	-38.9	176	-76.1	-177.5	-80.5	-176	-8.8	113.4	E840 S846 K847 Q853 K854	E840-R850 VanDerWaalsContact OE1-CD 3.23Å; E840-R850 WeakPolarHBondContact OE1-CD 3.45Å; E840-R850 WeakPolarHBondContact OE1-CG 3.34Å; E840-R850 IonicContact OE1-NE 3.09Å; S846-R850 WeakPolarHBondContact O-CG 3.32Å; S846-R850 PolarHBondContact O-N 2.82Å; S846-R850 PolarHBondContact O-NE 3.37Å; S846-R850 PolarHBondContact OG-NH2 3.39Å; K847-R850 PolarHBondContact O-N 2.92Å; R850-Q853 PolarHBondContact O-N 3.15Å; R850-K854 WeakPolarHBondContact O-CG 3.34Å; R850-K854 PolarHBondContact O-N 3.26Å
851	S	75.2	Confident	74.7	Confident	45 Å²	45	61.4 Å²	61.4	32%	0.315	33%	0.325	S	S	.	.	H	α-helix	trans	-66.2	-39.6	175.5	-175.8	0	0	0	0	111.9	K847 C848 S849 F855	K847-S851 WeakPolarHBondContact O-CB 3.44Å; K847-S851 PolarHBondContact O-N 3.27Å; C848-S851 PolarHBondContact O-N 3.12Å; S849-S851 VanDerWaalsContact C-N 3.32Å; S849-S851 PolarHBondContact O-N 3.45Å; S851-F855 WeakPolarHBondContact O-CB 3.24Å; S851-F855 PolarHBondContact O-N 2.99Å
852	L	81	Confident	74.4	Confident	3 Å²	3	58.2 Å²	58.2	2%	0.016	31%	0.313	C	S	.	.	H	α-helix	trans	-68	-40.6	175.6	-71.7	173.9	0	0	0	111.4	L808 I811 K812 I815 L836 C848 S849 F855 I856	L808-L852 HydrophobicContact CB-CD1 4.44Å; L808-L852 HydrophobicContact CD2-CD1 4.16Å; I811-L852 HydrophobicContact CG2-CD1 4.47Å; K812-L852 HydrophobicContact CB-CD2 3.65Å; K812-L852 HydrophobicContact CD-CD2 4.38Å; K812-L852 HydrophobicContact CG-CD2 3.81Å; I815-L852 HydrophobicContact CD1-CD2 4.31Å; L836-L852 HydrophobicContact CD1-CB 3.96Å; L836-L852 HydrophobicContact CD2-CB 4.32Å; L836-L852 HydrophobicContact CD2-CD1 3.95Å; C848-L852 WeakPolarHBondContact O-CG 3.49Å; C848-L852 PolarHBondContact O-N 3.36Å; S849-L852 PolarHBondContact O-N 2.87Å; S849-L852 VanDerWaalsContact O-N 3.09Å; L852-F855 CarbonylContact O-C 3.53Å; L852-F855 WeakPolarHBondContact O-CA 3.48Å; L852-F855 WeakPolarHBondContact O-CB 3.48Å; L852-F855 PolarHBondContact O-N 3.06Å; L852-F855 VanDerWaalsContact O-N 3.11Å; L852-I856 WeakPolarHBondContact O-CG1 3.26Å; L852-I856 PolarHBondContact O-N 3.41Å
853	Q	85.1	Confident	73.9	Confident	45 Å²	45	56 Å²	56	21%	0.21	30%	0.3	C	S	.	.	H	α-helix	trans	-61.1	-50.3	175.2	-168.6	62	54.8	0	0	111.1	E833 S849 R850 F855 I856 D857	E833-Q853 PolarHBondContact OE1-NE2 3.12Å; S849-Q853 PolarHBondContact O-N 3.2Å; R850-Q853 PolarHBondContact O-N 3.15Å; Q853-F855 PolarHBondContact O-N 3.48Å; Q853-F855 VanDerWaalsContact O-N 3.15Å; Q853-I856 WeakPolarHBondContact O-CB 3.5Å; Q853-I856 PolarHBondContact O-N 2.77Å; Q853-I856 VanDerWaalsContact O-N 3.08Å; Q853-D857 PolarHBondContact NE2-OD1 3.05Å; Q853-D857 PolarHBondContact O-N 3.39Å
854	K	81.2	Confident	73.2	Confident	107 Å²	107	64 Å²	64	47%	0.465	33%	0.33	S	S	.	.	H	α-helix	trans	-55.4	-35.1	173	-74.8	-178.9	178.9	-174.8	0	112.4	R850 R858	R850-K854 WeakPolarHBondContact O-CG 3.34Å; R850-K854 PolarHBondContact O-N 3.26Å; K854-R858 VanDerWaalsContact O-CG 3.25Å; K854-R858 WeakPolarHBondContact O-CG 3.43Å; K854-R858 PolarHBondContact O-N 3.48Å; K854-R858 VanDerWaalsContact O-N 3.13Å
855	F	79.5	Confident	72.6	Confident	51 Å²	51	63.7 Å²	63.7	22%	0.224	32%	0.321	C	S	.	.	H	α-helix	trans	-71.7	-40.7	178.9	-171.6	-118.4	0	0	0	112.2	I815 D816 S851 L852 Q853 R858 K859	I815-F855 HydrophobicContact CB-CD1 4.25Å; I815-F855 HydrophobicContact CB-CE1 4.12Å; I815-F855 HydrophobicContact CG2-CD1 3.56Å; I815-F855 HydrophobicContact CG2-CE1 3.58Å; D816-F855 HydrophobicContact CB-CE1 3.87Å; D816-F855 HydrophobicContact CB-CZ 3.84Å; S851-F855 WeakPolarHBondContact O-CB 3.24Å; S851-F855 PolarHBondContact O-N 2.99Å; L852-F855 CarbonylContact O-C 3.53Å; L852-F855 WeakPolarHBondContact O-CA 3.48Å; L852-F855 WeakPolarHBondContact O-CB 3.48Å; L852-F855 PolarHBondContact O-N 3.06Å; L852-F855 VanDerWaalsContact O-N 3.11Å; Q853-F855 PolarHBondContact O-N 3.48Å; Q853-F855 VanDerWaalsContact O-N 3.15Å; F855-R858 PolarHBondContact O-N 3.23Å; F855-K859 WeakPolarHBondContact O-CG 3.37Å; F855-K859 PolarHBondContact O-N 3.42Å
856	I	85.3	Confident	71.3	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-59.7	-50.2	170.9	-69.1	167.5	0	0	0	109.6	I815 W819 L829 L832 L836 L852 Q853 R858 K859 V860	I815-I856 HydrophobicContact CD1-CD1 4.1Å; I815-I856 HydrophobicContact CD1-CG1 3.97Å; I815-I856 HydrophobicContact CG2-CG1 4.38Å; W819-I856 HydrophobicContact CH2-CG2 4.34Å; L829-I856 HydrophobicContact CD1-CG2 3.91Å; L832-I856 HydrophobicContact CD2-CD1 4.1Å; L832-I856 HydrophobicContact CG-CD1 4.43Å; L836-I856 HydrophobicContact CD1-CD1 3.62Å; L852-I856 WeakPolarHBondContact O-CG1 3.26Å; L852-I856 PolarHBondContact O-N 3.41Å; Q853-I856 WeakPolarHBondContact O-CB 3.5Å; Q853-I856 PolarHBondContact O-N 2.77Å; Q853-I856 VanDerWaalsContact O-N 3.08Å; I856-R858 VanDerWaalsContact C-N 3.27Å; I856-R858 PolarHBondContact O-N 3.42Å; I856-K859 PolarHBondContact O-N 2.88Å; I856-V860 HydrophobicContact CG2-CG2 4.1Å; I856-V860 WeakPolarHBondContact O-CG2 3.17Å; I856-V860 PolarHBondContact O-N 2.68Å
857	D	84.9	Confident	69.7	Low	77 Å²	77	70 Å²	70	41%	0.412	36%	0.363	S	S	.	.	H	α-helix	trans	-56.9	-40.4	-179.4	-59.1	-21.8	0	0	0	112	Q853 S861	Q853-D857 PolarHBondContact NE2-OD1 3.05Å; Q853-D857 PolarHBondContact O-N 3.39Å; D857-S861 VanDerWaalsContact O-CB 3.32Å; D857-S861 WeakPolarHBondContact O-CB 3.03Å; D857-S861 PolarHBondContact O-N 3.28Å; D857-S861 PolarHBondContact O-OG 2.96Å
858	R	80.2	Confident	68	Low	150 Å²	150	71 Å²	71	57%	0.566	38%	0.375	S	S	*	.	H	α-helix	trans	-65.3	-44.1	174.9	-73.3	172.2	-172.8	178.7	3.6	112.2	E408 K854 F855 I856 S861 S862	E408-R858 IonicContact OE1-NH2 2.83Å; K854-R858 VanDerWaalsContact O-CG 3.25Å; K854-R858 WeakPolarHBondContact O-CG 3.43Å; K854-R858 PolarHBondContact O-N 3.48Å; K854-R858 VanDerWaalsContact O-N 3.13Å; F855-R858 PolarHBondContact O-N 3.23Å; I856-R858 VanDerWaalsContact C-N 3.27Å; I856-R858 PolarHBondContact O-N 3.42Å; R858-S861 PolarHBondContact O-N 2.68Å; R858-S862 PolarHBondContact O-N 3.49Å
859	K	79.7	Confident	66.3	Low	54 Å²	54	73.5 Å²	73.5	24%	0.235	40%	0.397	C	S	.	.	H	α-helix	trans	-65	-44.5	178.3	-72.9	-82.2	-177	170.2	0	111.1	I815 D816 W819 F855 I856 S862 V863	I815-K859 HydrophobicContact CG2-CG 4.48Å; D816-K859 PolarHBondContact O-NZ 2.72Å; D816-K859 VanDerWaalsContact O-NZ 3.08Å; D816-K859 IonicContact OD1-NZ 2.59Å; W819-K859 HydrophobicContact CD2-CB 3.89Å; W819-K859 HydrophobicContact CD2-CD 4.31Å; W819-K859 HydrophobicContact CD2-CG 4.32Å; W819-K859 HydrophobicContact CE3-CB 3.82Å; W819-K859 HydrophobicContact CE3-CD 4.4Å; W819-K859 HydrophobicContact CE3-CG 4.06Å; W819-K859 HydrophobicContact CG-CD 4.45Å; W819-K859 HydrophobicContact CH2-CB 3.7Å; W819-K859 HydrophobicContact CZ2-CB 3.75Å; W819-K859 HydrophobicContact CZ3-CB 3.73Å; W819-K859 HydrophobicContact CZ3-CG 4.27Å; F855-K859 WeakPolarHBondContact O-CG 3.37Å; F855-K859 PolarHBondContact O-N 3.42Å; I856-K859 PolarHBondContact O-N 2.88Å; K859-S862 WeakPolarHBondContact O-CB 3.48Å; K859-S862 PolarHBondContact O-N 3.31Å; K859-V863 WeakPolarHBondContact O-CG2 3.46Å; K859-V863 PolarHBondContact O-N 3.06Å
860	V	82.7	Confident	64.4	Low	40 Å²	40	78.1 Å²	78.1	24%	0.242	43%	0.427	C	S	.	.	H	α-helix	trans	-60.2	-46.7	175.5	175.3	0	0	0	0	110.7	W819 L829 I856 S862 V863 Y864	W819-V860 HydrophobicContact CH2-CG2 3.77Å; W819-V860 HydrophobicContact CZ2-CG2 3.85Å; L829-V860 HydrophobicContact CD2-CG2 4.38Å; I856-V860 HydrophobicContact CG2-CG2 4.1Å; I856-V860 WeakPolarHBondContact O-CG2 3.17Å; I856-V860 PolarHBondContact O-N 2.68Å; V860-S862 VanDerWaalsContact C-N 3.31Å; V860-S862 PolarHBondContact O-N 3.46Å; V860-V863 PolarHBondContact O-N 3.28Å; V860-V863 VanDerWaalsContact O-N 3.14Å; V860-Y864 HydrophobicContact CG1-CD2 3.99Å; V860-Y864 HydrophobicContact CG1-CE2 3.53Å; V860-Y864 WeakPolarHBondContact O-CD2 3.25Å; V860-Y864 PolarHBondContact O-N 3.25Å
861	S	74.7	Confident	62.5	Low	73 Å²	73	79.7 Å²	79.7	51%	0.51	44%	0.443	S	S	.	.	H	α-helix	trans	-61.6	-36.5	178.1	-60.2	0	0	0	0	113.1	D857 R858 V863 Y864 S865	D857-S861 VanDerWaalsContact O-CB 3.32Å; D857-S861 WeakPolarHBondContact O-CB 3.03Å; D857-S861 PolarHBondContact O-N 3.28Å; D857-S861 PolarHBondContact O-OG 2.96Å; R858-S861 PolarHBondContact O-N 2.68Å; S861-V863 VanDerWaalsContact C-N 3.3Å; S861-V863 PolarHBondContact O-N 2.97Å; S861-Y864 PolarHBondContact O-N 2.99Å; S861-S865 PolarHBondContact O-N 3.43Å
862	S	64.7	Low	60.9	Low	56 Å²	56	80 Å²	80	39%	0.392	44%	0.444	S	S	.	.	H	α-helix	trans	-64.8	-32.8	176.7	-174.3	0	0	0	0	112.5	R858 K859 V860 S866	R858-S862 PolarHBondContact O-N 3.49Å; K859-S862 WeakPolarHBondContact O-CB 3.48Å; K859-S862 PolarHBondContact O-N 3.31Å; V860-S862 VanDerWaalsContact C-N 3.31Å; V860-S862 PolarHBondContact O-N 3.46Å; S862-S866 WeakPolarHBondContact O-CB 3.39Å; S862-S866 PolarHBondContact O-OG 2.88Å
863	V	57.8	Low	59	Low	61 Å²	61	85.4 Å²	85.4	37%	0.37	48%	0.48	S	S	.	.	H	α-helix	trans	-70.9	-41.9	179.5	177.4	0	0	0	0	110.8	K859 V860 S861 S865 S866	K859-V863 WeakPolarHBondContact O-CG2 3.46Å; K859-V863 PolarHBondContact O-N 3.06Å; V860-V863 PolarHBondContact O-N 3.28Å; V860-V863 VanDerWaalsContact O-N 3.14Å; S861-V863 VanDerWaalsContact C-N 3.3Å; S861-V863 PolarHBondContact O-N 2.97Å; V863-S865 VanDerWaalsContact C-N 3.33Å; V863-S865 PolarHBondContact O-N 3.37Å; V863-S866 PolarHBondContact O-N 3.38Å
864	Y	49.3	Very low	56.9	Low	200 Å²	200	88.8 Å²	88.8	78%	0.784	51%	0.506	S	S	*	.	H	α-helix	trans	-71	-23.1	-178.9	-69.9	-68.4	0	0	0	114.5	V860 S861	V860-Y864 HydrophobicContact CG1-CD2 3.99Å; V860-Y864 HydrophobicContact CG1-CE2 3.53Å; V860-Y864 WeakPolarHBondContact O-CD2 3.25Å; V860-Y864 PolarHBondContact O-N 3.25Å; S861-Y864 PolarHBondContact O-N 2.99Å
865	S	46.3	Very low	55	Low	102 Å²	102	87.1 Å²	87.1	71%	0.713	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-4.3	175.9	-63.5	0	0	0	0	114	S861 V863	S861-S865 PolarHBondContact O-N 3.43Å; V863-S865 VanDerWaalsContact C-N 3.33Å; V863-S865 PolarHBondContact O-N 3.37Å
866	S	35.4	Very low	53.1	Low	47 Å²	47	89.9 Å²	89.9	33%	0.329	52%	0.515	S	S	.	.			trans	-111.2	73.6	-166.4	-60	0	0	0	0	113.5	S862 V863 V868	S862-S866 WeakPolarHBondContact O-CB 3.39Å; S862-S866 PolarHBondContact O-OG 2.88Å; V863-S866 PolarHBondContact O-N 3.38Å; S866-V868 VanDerWaalsContact CA-O 3.3Å; S866-V868 WeakPolarHBondContact CA-O 3.23Å; S866-V868 WeakPolarHBondContact CB-O 3.22Å; S866-V868 PolarHBondContact OG-O 3.05Å
867	T	33	Very low	50.6	Low	152 Å²	152	95.1 Å²	95.1	93%	0.933	55%	0.551	S	S	*	*	S	Bend	trans	-77.8	1.8	142.1	41.2	0	0	0	0	111.5
868	V	31.2	Very low	48.4	Very low	94 Å²	94	99.1 Å²	99.1	57%	0.57	56%	0.561	S	S	*	*	S	Bend	trans	-126.5	122.4	175.7	-176.8	0	0	0	0	105.3	S866	S866-V868 VanDerWaalsContact CA-O 3.3Å; S866-V868 WeakPolarHBondContact CA-O 3.23Å; S866-V868 WeakPolarHBondContact CB-O 3.22Å; S866-V868 PolarHBondContact OG-O 3.05Å
869	A	33.1	Very low	46.4	Very low	78 Å²	78	96.5 Å²	96.5	65%	0.645	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-48.5	145.4	176.6	0	0	0	0	0	110.2	D871	A869-D871 PolarHBondContact O-N 3.48Å
870	P	37.3	Very low	44.6	Very low	97 Å²	97	95 Å²	95	63%	0.63	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-54.8	116.7	178.1	22.9	-31.1	0	0	0	107.8
871	D	34.7	Very low	42.8	Very low	141 Å²	141	97.1 Å²	97.1	75%	0.754	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-52.2	129	-179.9	-83.2	-39.6	0	0	0	107.6	A869	A869-D871 PolarHBondContact O-N 3.48Å
872	P	42.3	Very low	41.3	Very low	51 Å²	51	99.2 Å²	99.2	33%	0.331	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-53.5	151.5	169.6	23.5	-30.7	0	0	0	108.3
873	P	41.4	Very low	40.3	Very low	117 Å²	117	99.8 Å²	99.8	76%	0.76	58%	0.576	S	S	*	*	S	Bend	trans	-45.3	127.1	172.6	20.6	-32.1	0	0	0	107.2	L875	P873-L875 PolarHBondContact O-N 2.92Å
874	P	39.7	Very low	39.6	Very low	116 Å²	116	101.3 Å²	101.3	75%	0.753	58%	0.579	S	S	*	*			trans	-51.1	118.8	-167.6	17.1	-29.3	0	0	0	106.9	E876	P874-E876 VanDerWaalsContact C-N 3.32Å; P874-E876 PolarHBondContact O-N 3.17Å
875	L	40.9	Very low	39.2	Very low	73 Å²	73	100.4 Å²	100.4	38%	0.382	58%	0.581	S	S	.	*			trans	-47.9	112.3	164.1	-98.3	128	0	0	0	103.7	P873 C877 C1128	P873-L875 PolarHBondContact O-N 2.92Å; L875-C877 WeakPolarHBondContact O-CA 3.42Å; L875-C877 PolarHBondContact O-N 3.25Å; L875-C1128 HydrophobicContact CD2-CB 4.05Å; L875-C1128 WeakPolarHBondContact CD2-SG 3.44Å
876	E	40.8	Very low	39.2	Very low	109 Å²	109	97 Å²	97	51%	0.509	55%	0.553	S	S	.	*			trans	-53.3	115.1	-179.2	-59	-171.2	-125.5	0	0	104.5	P874 Y878 L879	P874-E876 VanDerWaalsContact C-N 3.32Å; P874-E876 PolarHBondContact O-N 3.17Å; E876-Y878 HydrophobicContact CB-CD1 3.64Å; E876-Y878 HydrophobicContact CB-CE1 3.19Å; E876-Y878 HydrophobicContact CB-CE2 4.13Å; E876-Y878 HydrophobicContact CB-CG 4.3Å; E876-Y878 VanDerWaalsContact CB-CZ 3.44Å; E876-Y878 VanDerWaalsContact CD-CZ 3.44Å; E876-Y878 HydrophobicContact CG-CE1 3.97Å; E876-Y878 PolarHBondContact O-N 3.01Å; E876-Y878 PolarHBondContact OE1-OH 2.83Å; E876-Y878 VanDerWaalsContact OE1-OH 3.09Å; E876-Y878 WeakPolarHBondContact OE2-CE1 3.36Å; E876-Y878 PolarHBondContact OE2-OH 2.78Å; E876-L879 PolarHBondContact O-N 3.39Å
877	C	32.2	Very low	39.7	Very low	110 Å²	110	99.4 Å²	99.4	74%	0.743	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.8	-11.6	-158	33.7	0	0	0	0	113	L875	L875-C877 WeakPolarHBondContact O-CA 3.42Å; L875-C877 PolarHBondContact O-N 3.25Å
878	Y	39.7	Very low	40.7	Very low	160 Å²	160	95 Å²	95	63%	0.627	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-17.3	171.3	64.7	-106.6	0	0	0	115.6	E876	E876-Y878 HydrophobicContact CB-CD1 3.64Å; E876-Y878 HydrophobicContact CB-CE1 3.19Å; E876-Y878 HydrophobicContact CB-CE2 4.13Å; E876-Y878 HydrophobicContact CB-CG 4.3Å; E876-Y878 VanDerWaalsContact CB-CZ 3.44Å; E876-Y878 VanDerWaalsContact CD-CZ 3.44Å; E876-Y878 HydrophobicContact CG-CE1 3.97Å; E876-Y878 PolarHBondContact O-N 3.01Å; E876-Y878 PolarHBondContact OE1-OH 2.83Å; E876-Y878 VanDerWaalsContact OE1-OH 3.09Å; E876-Y878 WeakPolarHBondContact OE2-CE1 3.36Å; E876-Y878 PolarHBondContact OE2-OH 2.78Å
879	L	37.8	Very low	41.5	Very low	96 Å²	96	92.2 Å²	92.2	50%	0.503	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-31.5	173.7	-67.2	176	0	0	0	111.5	E876 V881 C1128	E876-L879 PolarHBondContact O-N 3.39Å; L879-V881 PolarHBondContact O-N 2.96Å; L879-C1128 PolarHBondContact O-SG 3.01Å
880	A	41.7	Very low	42.3	Very low	23 Å²	23	90.6 Å²	90.6	19%	0.19	50%	0.496	C	S	.	.	S	Bend	trans	-56.4	121.5	176.8	0	0	0	0	0	110	L882 C1128	A880-L882 VanDerWaalsContact C-N 3.25Å; A880-L882 PolarHBondContact O-N 2.99Å; A880-C1128 WeakPolarHBondContact CA-SG 3.48Å
881	V	45.9	Very low	42.7	Very low	83 Å²	83	87.8 Å²	87.8	50%	0.503	48%	0.477	S	S	.	.			trans	-65.4	96.8	164.8	-179.5	0	0	0	0	105.6	L879	L879-V881 PolarHBondContact O-N 2.96Å
882	L	42	Very low	43.1	Very low	117 Å²	117	90.3 Å²	90.3	61%	0.613	48%	0.476	S	S	*	.			trans	-50.8	141.7	171.2	-71.4	170.9	0	0	0	107.5	A880 E884	A880-L882 VanDerWaalsContact C-N 3.25Å; A880-L882 PolarHBondContact O-N 2.99Å; L882-E884 PolarHBondContact O-N 3.01Å
883	P	44	Very low	43	Very low	69 Å²	69	97.1 Å²	97.1	45%	0.448	50%	0.503	S	S	.	.			trans	-71.3	86.3	176.3	-0.9	22.3	0	0	0	105.1	E885 I1130	P883-E885 PolarHBondContact O-N 3.47Å; P883-I1130 HydrophobicContact CG-CB 4.23Å; P883-I1130 HydrophobicContact CG-CD1 3.58Å; P883-I1130 HydrophobicContact CG-CG1 4.5Å; P883-I1130 HydrophobicContact CG-CG2 4.3Å
884	E	43.7	Very low	42.8	Very low	93 Å²	93	96.6 Å²	96.6	44%	0.435	50%	0.503	S	S	.	.			trans	-60.2	97.3	176.3	-71.5	-178.5	167.5	0	0	107.2	L882 Y886	L882-E884 PolarHBondContact O-N 3.01Å; E884-Y886 WeakPolarHBondContact O-CD2 3.44Å; E884-Y886 PolarHBondContact O-N 2.87Å
885	E	40.1	Very low	42.9	Very low	180 Å²	180	92.7 Å²	92.7	84%	0.841	48%	0.48	S	S	*	.			trans	16.9	58.1	174.4	-72.1	-175.8	161.2	0	0	114.3	P883 D887	P883-E885 PolarHBondContact O-N 3.47Å; E885-D887 PolarHBondContact O-N 2.94Å
886	Y	46.4	Very low	43	Very low	32 Å²	32	94 Å²	94	13%	0.125	49%	0.487	C	S	.	.			trans	-69.6	126.9	165	-68.3	-87.9	0	0	0	103.7	E884 L888 R917 P1209	E884-Y886 WeakPolarHBondContact O-CD2 3.44Å; E884-Y886 PolarHBondContact O-N 2.87Å; Y886-L888 PolarHBondContact O-N 2.82Å; Y886-R917 PolarHBondContact OH-NH2 3.17Å; Y886-P1209 HydrophobicContact CE1-CB 4.3Å; Y886-P1209 VanDerWaalsContact OH-CB 3.29Å; Y886-P1209 WeakPolarHBondContact OH-CB 3.36Å
887	D	46.8	Very low	43.3	Very low	96 Å²	96	91.9 Å²	91.9	51%	0.513	48%	0.478	S	S	.	.			trans	-58.4	87.3	156.8	-116.9	-28	0	0	0	104	E885 M889 R892	E885-D887 PolarHBondContact O-N 2.94Å; D887-M889 CarbonylContact O-C 3.54Å; D887-M889 PolarHBondContact O-N 2.76Å; D887-R892 IonicContact OD2-NE 3.28Å
888	L	52.1	Low	43.8	Very low	59 Å²	59	90.2 Å²	90.2	31%	0.309	47%	0.468	S	S	.	.	S	Bend	trans	-55.3	-15.2	-172.2	-80.6	160.9	0	0	0	111.8	Y886 E914	Y886-L888 PolarHBondContact O-N 2.82Å; L888-E914 HydrophobicContact CD2-CG 3.91Å
889	M	48.2	Very low	43.8	Very low	36 Å²	36	87.5 Å²	87.5	18%	0.177	46%	0.457	C	S	.	.	B	Isolated β-bridge	trans	-121	135.2	179.3	-60.8	-83.8	-83.2	0	0	107.6	D887 V891 F905 Q909 L910	D887-M889 CarbonylContact O-C 3.54Å; D887-M889 PolarHBondContact O-N 2.76Å; M889-V891 WeakPolarHBondContact CB-O 3.48Å; M889-V891 PolarHBondContact O-N 2.78Å; M889-F905 HydrophobicContact CE-CD1 4.46Å; M889-F905 HydrophobicContact CE-CE1 4Å; M889-F905 HydrophobicContact SD-CD1 4.18Å; M889-F905 HydrophobicContact SD-CE1 3.71Å; M889-Q909 WeakPolarHBondContact CA-O 3.43Å; M889-L910 HydrophobicContact SD-CD2 4.05Å
890	T	50.3	Low	43.9	Very low	45 Å²	45	90 Å²	90	28%	0.276	47%	0.471	S	S	.	.	S	Bend	trans	-59.7	-7.2	165.5	-25.4	0	0	0	0	111.7	F908 Q909	T890-F908 WeakPolarHBondContact CB-O 3.49Å; T890-F908 PolarHBondContact OG1-O 2.96Å; T890-Q909 PolarHBondContact N-O 3.34Å; T890-Q909 PolarHBondContact OG1-O 2.97Å
891	V	46.8	Very low	44.2	Very low	37 Å²	37	91.9 Å²	91.9	22%	0.224	49%	0.493	C	S	.	.	S	Bend	trans	-132.6	110.6	-176	-174	0	0	0	0	108.8	M889 Q893 Y1200	M889-V891 WeakPolarHBondContact CB-O 3.48Å; M889-V891 PolarHBondContact O-N 2.78Å; V891-Q893 PolarHBondContact O-N 3.28Å; V891-Y1200 HydrophobicContact CB-CD1 4.5Å; V891-Y1200 HydrophobicContact CB-CE1 4.31Å; V891-Y1200 HydrophobicContact CG1-CD1 4.38Å; V891-Y1200 HydrophobicContact CG1-CE1 3.92Å; V891-Y1200 HydrophobicContact CG2-CD1 3.37Å; V891-Y1200 HydrophobicContact CG2-CE1 3.56Å; V891-Y1200 HydrophobicContact CG2-CG 4.47Å
892	R	42.6	Very low	44.4	Very low	195 Å²	195	94.5 Å²	94.5	74%	0.736	50%	0.498	S	S	*	.			trans	-47.7	111.4	173.7	-80.1	-179.4	169.3	169.5	-6.5	112	D887 S894	D887-R892 IonicContact OD2-NE 3.28Å; R892-S894 PolarHBondContact O-N 2.89Å
893	Q	39.7	Very low	44.9	Very low	193 Å²	193	91 Å²	91	90%	0.902	48%	0.484	S	S	*	.	S	Bend	trans	23.5	4	156.1	-121.7	164.8	9.1	0	0	123.5	V891	V891-Q893 PolarHBondContact O-N 3.28Å
894	S	38.3	Very low	45.6	Very low	107 Å²	107	91.4 Å²	91.4	75%	0.748	48%	0.484	S	S	*	.	S	Bend	trans	-112.2	19.7	-173.2	82.6	0	0	0	0	114.9	R892	R892-S894 PolarHBondContact O-N 2.89Å
895	A	39.9	Very low	46.8	Very low	34 Å²	34	87.4 Å²	87.4	28%	0.281	47%	0.465	S	S	.	.			trans	-147.1	33.2	-173.3	0	0	0	0	0	115.7	I897	A895-I897 PolarHBondContact O-N 2.73Å
896	L	44.5	Very low	48.2	Very low	101 Å²	101	80.5 Å²	80.5	53%	0.529	44%	0.436	S	S	.	.			trans	-68.5	97.3	161.6	-82.9	166.1	0	0	0	108.3	S898 F905	L896-S898 PolarHBondContact O-N 3.29Å; L896-S898 VanDerWaalsContact O-N 3.1Å; L896-F905 HydrophobicContact CD2-CE1 3.76Å; L896-F905 HydrophobicContact CD2-CZ 3.88Å
897	I	46.5	Very low	49.8	Very low	63 Å²	63	79.2 Å²	79.2	32%	0.323	43%	0.431	S	S	.	.			trans	-74.8	98.9	164.3	-56.7	-172.1	0	0	0	106.3	A895 Y899 A1195 L1197	A895-I897 PolarHBondContact O-N 2.73Å; I897-Y899 PolarHBondContact O-N 2.92Å; I897-A1195 HydrophobicContact CD1-CB 4.05Å; I897-L1197 HydrophobicContact CD1-CD2 3.39Å; I897-L1197 HydrophobicContact CD1-CG 3.74Å; I897-L1197 HydrophobicContact CG1-CD2 4.14Å
898	S	43.4	Very low	51.3	Low	75 Å²	75	75.5 Å²	75.5	52%	0.524	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	110.4	158.8	168.6	0	0	0	0	107.4	L896 G901	L896-S898 PolarHBondContact O-N 3.29Å; L896-S898 VanDerWaalsContact O-N 3.1Å; S898-G901 VanDerWaalsContact OG-CA 3.24Å; S898-G901 WeakPolarHBondContact OG-CA 3.46Å; S898-G901 PolarHBondContact OG-N 3.18Å; S898-G901 VanDerWaalsContact OG-N 3.08Å
899	Y	39.9	Very low	52.3	Low	103 Å²	103	73.3 Å²	73.3	40%	0.404	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	113.8	163	-147.1	-90.4	0	0	0	106.4	I897 G901 K902	I897-Y899 PolarHBondContact O-N 2.92Å; Y899-G901 VanDerWaalsContact C-N 3.3Å; Y899-G901 PolarHBondContact O-N 3.13Å; Y899-K902 PolarHBondContact N-O 3Å; Y899-K902 PolarHBondContact O-N 3.23Å
900	N	40	Very low	53.9	Low	148 Å²	148	71.7 Å²	71.7	79%	0.791	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	34.8	-174.3	-64.6	-10.2	0	0	0	115.2	K902	N900-K902 VanDerWaalsContact C-N 3.26Å; N900-K902 PolarHBondContact O-N 3.13Å
901	G	46.3	Very low	55.4	Low	64 Å²	64	70.8 Å²	70.8	66%	0.66	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	7.2	179.7	0	0	0	0	0	114.4	S898 Y899	S898-G901 VanDerWaalsContact OG-CA 3.24Å; S898-G901 WeakPolarHBondContact OG-CA 3.46Å; S898-G901 PolarHBondContact OG-N 3.18Å; S898-G901 VanDerWaalsContact OG-N 3.08Å; Y899-G901 VanDerWaalsContact C-N 3.3Å; Y899-G901 PolarHBondContact O-N 3.13Å
902	K	51.6	Low	57.3	Low	138 Å²	138	69 Å²	69	60%	0.6	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.3	125	177.1	-64.5	-175.1	178	-175.1	0	110.4	Y899 N900 V904	Y899-K902 PolarHBondContact N-O 3Å; Y899-K902 PolarHBondContact O-N 3.23Å; N900-K902 VanDerWaalsContact C-N 3.26Å; N900-K902 PolarHBondContact O-N 3.13Å; K902-V904 PolarHBondContact O-N 3.01Å
903	S	51.7	Low	59.4	Low	44 Å²	44	60.1 Å²	60.1	31%	0.308	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	108.7	172.7	-61.8	0	0	0	0	109.3
904	V	58.8	Low	61.5	Low	76 Å²	76	51.5 Å²	51.5	46%	0.461	30%	0.299	S	S	.	.			trans	-93.1	107.3	176.2	-177	0	0	0	0	108.3	K902 Q909	K902-V904 PolarHBondContact O-N 3.01Å; V904-Q909 PolarHBondContact O-OE1 3.13Å
905	F	69	Low	64	Low	9 Å²	9	46.5 Å²	46.5	4%	0.039	26%	0.264	C	S	.	.			trans	-91.8	145.2	171.6	-61.2	-76.1	0	0	0	110.9	M889 L896 Q909 L910 F1138	M889-F905 HydrophobicContact CE-CD1 4.46Å; M889-F905 HydrophobicContact CE-CE1 4Å; M889-F905 HydrophobicContact SD-CD1 4.18Å; M889-F905 HydrophobicContact SD-CE1 3.71Å; L896-F905 HydrophobicContact CD2-CE1 3.76Å; L896-F905 HydrophobicContact CD2-CZ 3.88Å; F905-Q909 VanDerWaalsContact CA-OE1 3.28Å; F905-L910 HydrophobicContact CB-CD1 3.93Å; F905-L910 HydrophobicContact CB-CG 4.08Å; F905-L910 HydrophobicContact CD1-CD2 3.7Å; F905-L910 HydrophobicContact CD1-CG 4.15Å; F905-L910 HydrophobicContact CE1-CD2 4.01Å; F905-L910 HydrophobicContact CG-CD1 4.13Å; F905-L910 HydrophobicContact CG-CD2 4.08Å; F905-L910 HydrophobicContact CG-CG 4.18Å; F905-F1138 HydrophobicContact CB-CD1 4.28Å; F905-F1138 HydrophobicContact CB-CD2 4.09Å; F905-F1138 HydrophobicContact CB-CE1 4.22Å; F905-F1138 HydrophobicContact CB-CE2 4.03Å; F905-F1138 HydrophobicContact CB-CG 4.22Å; F905-F1138 HydrophobicContact CB-CZ 4.1Å; F905-F1138 HydrophobicContact CD2-CB 3.63Å; F905-F1138 HydrophobicContact CD2-CD1 4.26Å; F905-F1138 AromaticContact CD2-CD2 3.89Å; F905-F1138 HydrophobicContact CD2-CD2 3.89Å; F905-F1138 AromaticContact CD2-CG 3.66Å; F905-F1138 HydrophobicContact CD2-CG 3.66Å; F905-F1138 HydrophobicContact CE2-CB 4.09Å; F905-F1138 HydrophobicContact CG-CG 4.44Å; F905-F1138 VanDerWaalsContact O-CE2 3.29Å; F905-F1138 WeakPolarHBondContact O-CE2 3.47Å; F905-F1138 WeakPolarHBondContact O-CZ 3.42Å
906	T	69.3	Low	66.6	Low	35 Å²	35	44.9 Å²	44.9	22%	0.215	25%	0.25	C	S	.	.			trans	-104.7	157.9	167	67	0	0	0	0	110.5	F908 Q909 F1190	T906-F908 PolarHBondContact O-N 3.23Å; T906-Q909 PolarHBondContact O-N 3.44Å; T906-Q909 WeakPolarHBondContact OG1-CG 3.33Å; T906-F1190 HydrophobicContact CG2-CD2 4.39Å
907	L	80.6	Confident	68.8	Low	6 Å²	6	41.9 Å²	41.9	3%	0.031	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-29.1	-178.4	-174.2	70.5	0	0	0	113.7	I915 W965 L966 V982 R985 I986 I989	L907-I915 HydrophobicContact CD1-CD1 4.05Å; L907-W965 HydrophobicContact CB-CH2 4.3Å; L907-W965 HydrophobicContact CD1-CH2 3.66Å; L907-W965 HydrophobicContact CD1-CZ3 4.05Å; L907-L966 HydrophobicContact CD1-CD2 4.41Å; L907-V982 HydrophobicContact CD2-CG1 3.8Å; L907-R985 HydrophobicContact CD1-CG 4.26Å; L907-R985 HydrophobicContact CD2-CB 4.26Å; L907-R985 HydrophobicContact CD2-CG 3.96Å; L907-R985 HydrophobicContact CG-CG 3.83Å; L907-R985 PolarHBondContact O-NH1 3.48Å; L907-I986 HydrophobicContact CD2-CG1 4.35Å; L907-I989 HydrophobicContact CD1-CD1 4.01Å
908	F	77.5	Confident	70.9	Confident	17 Å²	17	39 Å²	39	8%	0.075	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-14.7	179.3	-70.2	-84.6	0	0	0	114.9	T890 T906 A981 V982 L1187 L1202	T890-F908 WeakPolarHBondContact CB-O 3.49Å; T890-F908 PolarHBondContact OG1-O 2.96Å; T906-F908 PolarHBondContact O-N 3.23Å; F908-A981 HydrophobicContact CE1-CB 4.06Å; F908-A981 HydrophobicContact CZ-CB 3.74Å; F908-V982 HydrophobicContact CE2-CG2 3.52Å; F908-V982 HydrophobicContact CZ-CG2 3.92Å; F908-L1187 HydrophobicContact CD2-CD1 3.87Å; F908-L1187 HydrophobicContact CE2-CD1 3.75Å; F908-L1202 HydrophobicContact CE1-CD2 4.32Å; F908-L1202 HydrophobicContact CE2-CD2 4.29Å; F908-L1202 HydrophobicContact CZ-CD2 4.17Å
909	Q	74.6	Confident	73.4	Confident	14 Å²	14	35.4 Å²	35.4	7%	0.065	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-30.4	178	-77.9	170.9	-21.1	0	0	112.3	M889 T890 V904 F905 T906 Y1200	M889-Q909 WeakPolarHBondContact CA-O 3.43Å; T890-Q909 PolarHBondContact N-O 3.34Å; T890-Q909 PolarHBondContact OG1-O 2.97Å; V904-Q909 PolarHBondContact O-OE1 3.13Å; F905-Q909 VanDerWaalsContact CA-OE1 3.28Å; T906-Q909 PolarHBondContact O-N 3.44Å; T906-Q909 WeakPolarHBondContact OG1-CG 3.33Å; Q909-Y1200 PolarHBondContact NE2-OH 3.28Å
910	L	80.1	Confident	76	Confident	2 Å²	2	30.5 Å²	30.5	1%	0.01	17%	0.173	C	C	.	.	B	Isolated β-bridge	trans	-94.9	150.1	178	-60.7	176.4	0	0	0	111.3	M889 F905 I915 R985 I1135 F1139	M889-L910 HydrophobicContact SD-CD2 4.05Å; F905-L910 HydrophobicContact CB-CD1 3.93Å; F905-L910 HydrophobicContact CB-CG 4.08Å; F905-L910 HydrophobicContact CD1-CD2 3.7Å; F905-L910 HydrophobicContact CD1-CG 4.15Å; F905-L910 HydrophobicContact CE1-CD2 4.01Å; F905-L910 HydrophobicContact CG-CD1 4.13Å; F905-L910 HydrophobicContact CG-CD2 4.08Å; F905-L910 HydrophobicContact CG-CG 4.18Å; L910-I915 HydrophobicContact CB-CD1 3.9Å; L910-I915 HydrophobicContact CB-CG1 3.64Å; L910-I915 HydrophobicContact CD1-CG1 4.17Å; L910-R985 PolarHBondContact O-NH1 3.47Å; L910-R985 VanDerWaalsContact O-NH1 3.14Å; L910-I1135 HydrophobicContact CD1-CG1 4.46Å; L910-I1135 HydrophobicContact CD1-CG2 4.05Å; L910-I1135 HydrophobicContact CD2-CD1 3.9Å; L910-I1135 HydrophobicContact CD2-CG1 3.89Å; L910-F1139 HydrophobicContact CD1-CE2 4.36Å; L910-F1139 HydrophobicContact CD1-CZ 4.28Å
911	H	82.7	Confident	78.6	Confident	25 Å²	25	24 Å²	24	12%	0.116	14%	0.138	C	C	.	.			trans	-70.2	135.9	173.6	-165.3	-74.3	0	0	0	110.4	I913 E914 I915 P1205 G1206	H911-I913 VanDerWaalsContact C-N 3.31Å; H911-I913 VanDerWaalsContact CE1-CD1 3.49Å; H911-I913 WeakPolarHBondContact CE1-CD1 3.29Å; H911-I913 WeakPolarHBondContact ND1-CB 3.42Å; H911-I913 PolarHBondContact ND1-N 3.16Å; H911-I913 VanDerWaalsContact ND1-N 3.2Å; H911-I913 PolarHBondContact O-N 3.37Å; H911-E914 HydrophobicContact CB-CB 4.15Å; H911-E914 PolarHBondContact O-N 3.07Å; H911-I915 WeakPolarHBondContact O-CG1 3.02Å; H911-I915 PolarHBondContact O-N 3.26Å; H911-P1205 VanDerWaalsContact CD2-CG 3.45Å; H911-P1205 WeakPolarHBondContact CD2-CG 3.3Å; H911-P1205 WeakPolarHBondContact NE2-CG 3.3Å; H911-G1206 PolarHBondContact CE1-O 3.42Å; H911-G1206 VanDerWaalsContact CE1-O 3.31Å
912	P	86.7	Confident	80.9	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-55.1	-42.7	-179.7	18.5	-30.7	0	0	0	113.5	E914 I915 A916 E988 I989 I992 P1205	P912-E914 VanDerWaalsContact C-N 3.3Å; P912-E914 PolarHBondContact O-N 3.08Å; P912-I915 PolarHBondContact O-N 3.11Å; P912-A916 PolarHBondContact O-N 3.09Å; P912-E988 HydrophobicContact CB-CB 4.37Å; P912-I989 HydrophobicContact CB-CG1 4.18Å; P912-I992 HydrophobicContact CB-CD1 4.09Å; P912-P1205 HydrophobicContact CG-CG 4.15Å
913	I	86.9	Confident	83	Confident	8 Å²	8	14.6 Å²	14.6	4%	0.041	8%	0.079	C	C	.	.	H	α-helix	trans	-57.4	-42.5	174.5	-58.7	174.3	0	0	0	111.6	H911 A916 R917 I992	H911-I913 VanDerWaalsContact C-N 3.31Å; H911-I913 VanDerWaalsContact CE1-CD1 3.49Å; H911-I913 WeakPolarHBondContact CE1-CD1 3.29Å; H911-I913 WeakPolarHBondContact ND1-CB 3.42Å; H911-I913 PolarHBondContact ND1-N 3.16Å; H911-I913 VanDerWaalsContact ND1-N 3.2Å; H911-I913 PolarHBondContact O-N 3.37Å; I913-A916 PolarHBondContact O-N 2.95Å; I913-R917 HydrophobicContact CG2-CG 4.29Å; I913-R917 WeakPolarHBondContact O-CB 3.45Å; I913-R917 VanDerWaalsContact O-CG 3.31Å; I913-R917 WeakPolarHBondContact O-CG 3.5Å; I913-R917 PolarHBondContact O-N 3.01Å; I913-I992 HydrophobicContact CB-CD1 4.27Å; I913-I992 HydrophobicContact CG1-CD1 3.79Å; I913-I992 HydrophobicContact CG1-CG1 4.34Å
914	E	84.2	Confident	85	Confident	13 Å²	13	12.7 Å²	12.7	6%	0.061	7%	0.066	C	C	.	.	H	α-helix	trans	-75.4	-36	-175.9	-161.4	56.5	-148	0	0	111.8	L888 H911 P912 A916 R917 Q918 I1135	L888-E914 HydrophobicContact CD2-CG 3.91Å; H911-E914 HydrophobicContact CB-CB 4.15Å; H911-E914 PolarHBondContact O-N 3.07Å; P912-E914 VanDerWaalsContact C-N 3.3Å; P912-E914 PolarHBondContact O-N 3.08Å; E914-A916 VanDerWaalsContact C-N 3.32Å; E914-A916 PolarHBondContact O-N 2.68Å; E914-R917 PolarHBondContact O-N 2.98Å; E914-R917 IonicContact OE2-NH1 2.86Å; E914-Q918 HydrophobicContact CG-CG 4.28Å; E914-Q918 WeakPolarHBondContact O-CB 3.48Å; E914-Q918 VanDerWaalsContact O-CG 3.29Å; E914-Q918 WeakPolarHBondContact O-CG 3.35Å; E914-Q918 PolarHBondContact O-N 2.86Å; E914-Q918 WeakPolarHBondContact OE1-CG 3.33Å; E914-Q918 PolarHBondContact OE1-NE2 3.15Å; E914-I1135 HydrophobicContact CB-CD1 4.47Å; E914-I1135 HydrophobicContact CG-CD1 3.47Å; E914-I1135 VanDerWaalsContact CG-CD1 3.47Å
915	I	90.5	Very high	86.7	Confident	1 Å²	1	11.3 Å²	11.3	1%	0.005	6%	0.055	C	C	.	.	H	α-helix	trans	-55.1	-52	168.5	-63.9	169.6	0	0	0	109.5	L907 L910 H911 P912 R917 Q918 I919 I989 F1139	L907-I915 HydrophobicContact CD1-CD1 4.05Å; L910-I915 HydrophobicContact CB-CD1 3.9Å; L910-I915 HydrophobicContact CB-CG1 3.64Å; L910-I915 HydrophobicContact CD1-CG1 4.17Å; H911-I915 WeakPolarHBondContact O-CG1 3.02Å; H911-I915 PolarHBondContact O-N 3.26Å; P912-I915 PolarHBondContact O-N 3.11Å; I915-R917 PolarHBondContact O-N 3.47Å; I915-Q918 PolarHBondContact O-N 2.88Å; I915-I919 HydrophobicContact CG2-CG1 4.36Å; I915-I919 WeakPolarHBondContact O-CB 3.35Å; I915-I919 VanDerWaalsContact O-CG1 3.23Å; I915-I919 WeakPolarHBondContact O-CG1 3.41Å; I915-I919 PolarHBondContact O-N 2.83Å; I915-I989 HydrophobicContact CB-CD1 4.31Å; I915-I989 HydrophobicContact CD1-CD1 4.09Å; I915-I989 HydrophobicContact CG2-CD1 3.82Å; I915-I989 HydrophobicContact CG2-CG1 4.39Å; I915-F1139 HydrophobicContact CB-CZ 4.31Å; I915-F1139 HydrophobicContact CG1-CZ 4.2Å; I915-F1139 HydrophobicContact CG2-CE1 4.47Å; I915-F1139 HydrophobicContact CG2-CE2 4.36Å; I915-F1139 HydrophobicContact CG2-CZ 3.72Å
916	A	93	Very high	87.9	Confident	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-63.5	-41.6	-178.2	0	0	0	0	0	112.9	P912 I913 E914 T920 I989 I992 F993	P912-A916 PolarHBondContact O-N 3.09Å; I913-A916 PolarHBondContact O-N 2.95Å; E914-A916 VanDerWaalsContact C-N 3.32Å; E914-A916 PolarHBondContact O-N 2.68Å; A916-T920 VanDerWaalsContact O-CB 3.24Å; A916-T920 WeakPolarHBondContact O-CB 3.44Å; A916-T920 PolarHBondContact O-N 3.1Å; A916-T920 PolarHBondContact O-OG1 3.09Å; A916-I989 HydrophobicContact CB-CG2 4.17Å; A916-I992 HydrophobicContact CB-CB 3.71Å; A916-I992 HydrophobicContact CB-CD1 4.29Å; A916-I992 HydrophobicContact CB-CG2 3.41Å; A916-I992 VanDerWaalsContact CB-CG2 3.41Å; A916-F993 HydrophobicContact CB-CD1 4.01Å; A916-F993 HydrophobicContact CB-CE1 3.92Å; A916-F993 WeakPolarHBondContact O-CE1 3.4Å
917	R	90.8	Very high	89.1	Confident	39 Å²	39	10.4 Å²	10.4	15%	0.147	5%	0.05	C	C	.	.	H	α-helix	trans	-63.7	-49.4	177.6	-75.7	174	178	158.7	-1.2	112.1	Y886 I913 E914 I915 T920 L921 L996 L1129	Y886-R917 PolarHBondContact OH-NH2 3.17Å; I913-R917 HydrophobicContact CG2-CG 4.29Å; I913-R917 WeakPolarHBondContact O-CB 3.45Å; I913-R917 VanDerWaalsContact O-CG 3.31Å; I913-R917 WeakPolarHBondContact O-CG 3.5Å; I913-R917 PolarHBondContact O-N 3.01Å; E914-R917 PolarHBondContact O-N 2.98Å; E914-R917 IonicContact OE2-NH1 2.86Å; I915-R917 PolarHBondContact O-N 3.47Å; R917-T920 PolarHBondContact O-N 2.89Å; R917-L921 WeakPolarHBondContact O-CG 3.4Å; R917-L921 PolarHBondContact O-N 3.08Å; R917-L996 HydrophobicContact CG-CD1 4.33Å; R917-L1129 HydrophobicContact CB-CD1 4.18Å; R917-L1129 HydrophobicContact CG-CD1 4.05Å; R917-L1129 HydrophobicContact CG-CD2 4.09Å
918	Q	92.2	Very high	89.7	Confident	1 Å²	1	14.8 Å²	14.8	1%	0.005	7%	0.066	C	C	.	.	H	α-helix	trans	-69.3	-37	-176.7	-63.8	-55.8	-40.4	0	0	112.1	E914 I915 L922 I1130 E1132 I1135 F1139	E914-Q918 HydrophobicContact CG-CG 4.28Å; E914-Q918 WeakPolarHBondContact O-CB 3.48Å; E914-Q918 VanDerWaalsContact O-CG 3.29Å; E914-Q918 WeakPolarHBondContact O-CG 3.35Å; E914-Q918 PolarHBondContact O-N 2.86Å; E914-Q918 WeakPolarHBondContact OE1-CG 3.33Å; E914-Q918 PolarHBondContact OE1-NE2 3.15Å; I915-Q918 PolarHBondContact O-N 2.88Å; Q918-L922 WeakPolarHBondContact O-CB 3.46Å; Q918-L922 PolarHBondContact O-N 3.33Å; Q918-I1130 PolarHBondContact NE2-O 3.18Å; Q918-E1132 VanDerWaalsContact CD-N 3.34Å; Q918-E1132 HydrophobicContact CG-CB 4.35Å; Q918-I1135 HydrophobicContact CB-CG2 3.75Å; Q918-I1135 HydrophobicContact CG-CB 4.02Å; Q918-I1135 HydrophobicContact CG-CG2 3.65Å; Q918-F1139 HydrophobicContact CB-CD2 4.49Å
919	I	94.9	Very high	90.4	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-64.4	-45	171.1	-69.1	-66.6	0	0	0	111.1	I915 L921 L922 E923 F962 F993 F1139	I915-I919 HydrophobicContact CG2-CG1 4.36Å; I915-I919 WeakPolarHBondContact O-CB 3.35Å; I915-I919 VanDerWaalsContact O-CG1 3.23Å; I915-I919 WeakPolarHBondContact O-CG1 3.41Å; I915-I919 PolarHBondContact O-N 2.83Å; I919-L921 VanDerWaalsContact C-N 3.33Å; I919-L921 PolarHBondContact O-N 2.71Å; I919-L922 PolarHBondContact O-N 2.79Å; I919-L922 VanDerWaalsContact O-N 3.1Å; I919-E923 HydrophobicContact CG2-CG 4.28Å; I919-E923 WeakPolarHBondContact CG2-OE1 3.5Å; I919-E923 PolarHBondContact O-N 2.88Å; I919-F962 HydrophobicContact CD1-CD2 3.72Å; I919-F962 HydrophobicContact CD1-CE2 3.58Å; I919-F962 HydrophobicContact CD1-CG 4.48Å; I919-F962 HydrophobicContact CD1-CZ 4.22Å; I919-F962 HydrophobicContact CG1-CD2 4.43Å; I919-F962 HydrophobicContact CG1-CE2 3.81Å; I919-F962 HydrophobicContact CG1-CZ 4.04Å; I919-F962 HydrophobicContact CG2-CZ 4.45Å; I919-F993 HydrophobicContact CB-CE1 4.14Å; I919-F993 HydrophobicContact CB-CZ 4.07Å; I919-F993 HydrophobicContact CG2-CE1 3.91Å; I919-F993 HydrophobicContact CG2-CZ 3.61Å; I919-F1139 HydrophobicContact CD1-CB 3.83Å; I919-F1139 HydrophobicContact CD1-CD1 3.47Å; I919-F1139 VanDerWaalsContact CD1-CD1 3.47Å; I919-F1139 HydrophobicContact CD1-CD2 3.82Å; I919-F1139 HydrophobicContact CD1-CE1 3.93Å; I919-F1139 HydrophobicContact CD1-CE2 4.23Å; I919-F1139 HydrophobicContact CD1-CG 3.43Å; I919-F1139 VanDerWaalsContact CD1-CG 3.43Å; I919-F1139 HydrophobicContact CD1-CZ 4.3Å; I919-F1139 HydrophobicContact CG1-CD1 4.3Å; I919-F1139 HydrophobicContact CG1-CD2 4.17Å; I919-F1139 HydrophobicContact CG1-CE1 4.31Å; I919-F1139 HydrophobicContact CG1-CE2 4.16Å; I919-F1139 HydrophobicContact CG1-CG 4.25Å; I919-F1139 HydrophobicContact CG1-CZ 4.26Å
920	T	95	Very high	91.3	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-60.7	-42.1	178.2	-60.5	0	0	0	0	111.8	A916 R917 F924 L996 N998 V1059 Y1127	A916-T920 VanDerWaalsContact O-CB 3.24Å; A916-T920 WeakPolarHBondContact O-CB 3.44Å; A916-T920 PolarHBondContact O-N 3.1Å; A916-T920 PolarHBondContact O-OG1 3.09Å; R917-T920 PolarHBondContact O-N 2.89Å; T920-F924 WeakPolarHBondContact O-CB 3.44Å; T920-F924 PolarHBondContact O-N 2.99Å; T920-L996 HydrophobicContact CG2-CB 4.36Å; T920-L996 HydrophobicContact CG2-CD1 4.34Å; T920-N998 HydrophobicContact CG2-CB 4.13Å; T920-N998 PolarHBondContact OG1-ND2 2.85Å; T920-V1059 HydrophobicContact CG2-CG2 4.23Å; T920-Y1127 HydrophobicContact CG2-CD1 4.11Å; T920-Y1127 HydrophobicContact CG2-CD2 4.23Å; T920-Y1127 HydrophobicContact CG2-CE1 3.6Å; T920-Y1127 HydrophobicContact CG2-CE2 3.74Å; T920-Y1127 HydrophobicContact CG2-CG 4.38Å
921	L	93.2	Very high	91.8	Very high	11 Å²	11	19.5 Å²	19.5	6%	0.058	9%	0.093	C	C	.	.	H	α-helix	trans	-61.9	-42.3	173.6	-77.9	169.9	0	0	0	112	R917 I919 F924 D925 L1129 I1130 V1131 R1136	R917-L921 WeakPolarHBondContact O-CG 3.4Å; R917-L921 PolarHBondContact O-N 3.08Å; I919-L921 VanDerWaalsContact C-N 3.33Å; I919-L921 PolarHBondContact O-N 2.71Å; L921-F924 PolarHBondContact O-N 2.87Å; L921-D925 VanDerWaalsContact O-CG 3.31Å; L921-D925 PolarHBondContact O-N 3.05Å; L921-L1129 HydrophobicContact CD1-CB 3.8Å; L921-L1129 HydrophobicContact CD2-CB 3.99Å; L921-L1129 HydrophobicContact CG-CB 3.99Å; L921-L1129 HydrophobicContact CG-CD1 4.35Å; L921-I1130 WeakPolarHBondContact CD1-O 3.36Å; L921-V1131 HydrophobicContact CD1-CG2 4.02Å; L921-R1136 VanDerWaalsContact C-NH1 3.25Å; L921-R1136 PolarHBondContact O-NH1 3.08Å
922	L	94.9	Very high	92.1	Very high	6 Å²	6	18.8 Å²	18.8	3%	0.031	9%	0.091	C	C	.	.	H	α-helix	trans	-67.2	-46.8	-179.8	175.9	55.1	0	0	0	112.4	Q918 I919 F924 D925 L926 H958 R1136 F1139 E1140	Q918-L922 WeakPolarHBondContact O-CB 3.46Å; Q918-L922 PolarHBondContact O-N 3.33Å; I919-L922 PolarHBondContact O-N 2.79Å; I919-L922 VanDerWaalsContact O-N 3.1Å; L922-F924 VanDerWaalsContact C-N 3.33Å; L922-F924 PolarHBondContact O-N 3.47Å; L922-D925 PolarHBondContact O-N 3.49Å; L922-L926 HydrophobicContact CD1-CD1 4.06Å; L922-L926 HydrophobicContact CD1-CG 4.31Å; L922-L926 HydrophobicContact CG-CD1 4.31Å; L922-L926 WeakPolarHBondContact O-CB 3.47Å; L922-L926 VanDerWaalsContact O-CG 3.3Å; L922-L926 WeakPolarHBondContact O-CG 3.23Å; L922-L926 PolarHBondContact O-N 2.98Å; L922-H958 WeakPolarHBondContact CD2-NE2 3.34Å; L922-R1136 VanDerWaalsContact CD1-CZ 3.47Å; L922-F1139 HydrophobicContact CD2-CB 3.94Å; L922-E1140 HydrophobicContact CD1-CG 3.92Å; L922-E1140 HydrophobicContact CD2-CG 4.02Å
923	E	95.6	Very high	92.2	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-64.9	-38	175.3	-73.4	168.9	-164.1	0	0	112.1	I919 L926 Y927 H958 N998 T1000 G1001 E1004 V1059	I919-E923 HydrophobicContact CG2-CG 4.28Å; I919-E923 WeakPolarHBondContact CG2-OE1 3.5Å; I919-E923 PolarHBondContact O-N 2.88Å; E923-L926 PolarHBondContact O-N 2.98Å; E923-Y927 WeakPolarHBondContact O-CB 3.17Å; E923-Y927 PolarHBondContact O-N 3.39Å; E923-H958 IonicContact OE1-CE1 3.66Å; E923-N998 VanDerWaalsContact OE2-CG 3.3Å; E923-N998 PolarHBondContact OE2-ND2 3.03Å; E923-N998 PolarHBondContact OE2-OD1 3.35Å; E923-T1000 HydrophobicContact CG-CG2 4.47Å; E923-G1001 PolarHBondContact OE2-N 2.99Å; E923-E1004 VanDerWaalsContact OE1-OE2 3.08Å; E923-V1059 HydrophobicContact CB-CG1 4.23Å
924	F	94.7	Very high	92.4	Very high	4 Å²	4	20 Å²	20	2%	0.018	10%	0.097	C	C	.	.	H	α-helix	trans	-66.1	-42	176.1	-175.7	-101.3	0	0	0	112.2	T920 L921 L922 L926 Y927 R928 V1059 V1125 A1126 Y1127	T920-F924 WeakPolarHBondContact O-CB 3.44Å; T920-F924 PolarHBondContact O-N 2.99Å; L921-F924 PolarHBondContact O-N 2.87Å; L922-F924 VanDerWaalsContact C-N 3.33Å; L922-F924 PolarHBondContact O-N 3.47Å; F924-L926 VanDerWaalsContact C-N 3.34Å; F924-L926 PolarHBondContact O-N 3.39Å; F924-Y927 PolarHBondContact O-N 3.01Å; F924-R928 VanDerWaalsContact O-CB 3.27Å; F924-R928 WeakPolarHBondContact O-CB 3.43Å; F924-R928 PolarHBondContact O-N 3.01Å; F924-V1059 HydrophobicContact CB-CG2 3.92Å; F924-V1059 HydrophobicContact CD2-CG2 4.19Å; F924-V1125 WeakPolarHBondContact CZ-O 3.36Å; F924-A1126 HydrophobicContact CE1-CB 4.09Å; F924-Y1127 HydrophobicContact CB-CD2 3.8Å; F924-Y1127 HydrophobicContact CB-CE2 3.84Å; F924-Y1127 AromaticContact CD1-CD2 4Å; F924-Y1127 HydrophobicContact CD1-CD2 4Å; F924-Y1127 AromaticContact CD2-CD2 3.77Å; F924-Y1127 HydrophobicContact CD2-CD2 3.77Å; F924-Y1127 AromaticContact CD2-CE2 3.57Å; F924-Y1127 HydrophobicContact CD2-CE2 3.57Å; F924-Y1127 HydrophobicContact CE2-CD2 4.35Å; F924-Y1127 HydrophobicContact CE2-CE2 4.29Å; F924-Y1127 AromaticContact CG-CD2 3.55Å; F924-Y1127 HydrophobicContact CG-CD2 3.55Å; F924-Y1127 AromaticContact CG-CE2 3.74Å; F924-Y1127 HydrophobicContact CG-CE2 3.74Å
925	D	93.9	Very high	92.7	Very high	46 Å²	46	19.5 Å²	19.5	25%	0.246	10%	0.095	C	C	.	.	H	α-helix	trans	-62.8	-42.4	175.1	-74.8	-36	0	0	0	111.8	L921 L922 R928 A929 R1136	L921-D925 VanDerWaalsContact O-CG 3.31Å; L921-D925 PolarHBondContact O-N 3.05Å; L922-D925 PolarHBondContact O-N 3.49Å; D925-R928 PolarHBondContact O-N 2.97Å; D925-R928 IonicContact OD1-CZ 3.78Å; D925-R928 IonicContact OD1-NH2 3.2Å; D925-R928 PolarHBondContact OD1-NH2 2.97Å; D925-A929 VanDerWaalsContact O-CB 3.27Å; D925-A929 WeakPolarHBondContact O-CB 3.39Å; D925-A929 PolarHBondContact O-N 2.94Å; D925-R1136 IonicContact OD2-CZ 2.83Å; D925-R1136 IonicContact OD2-NH1 2.91Å; D925-R1136 PolarHBondContact OD2-NH1 3.07Å; D925-R1136 IonicContact OD2-NH2 3.07Å; D925-R1136 PolarHBondContact OD2-NH2 2.87Å
926	L	94.8	Very high	92.6	Very high	26 Å²	26	19.7 Å²	19.7	14%	0.136	10%	0.096	C	C	.	.	H	α-helix	trans	-64.9	-41.1	175.2	-70.3	171.3	0	0	0	111.4	L922 E923 F924 A929 V930 K954 L955 H958	L922-L926 HydrophobicContact CD1-CD1 4.06Å; L922-L926 HydrophobicContact CD1-CG 4.31Å; L922-L926 HydrophobicContact CG-CD1 4.31Å; L922-L926 WeakPolarHBondContact O-CB 3.47Å; L922-L926 VanDerWaalsContact O-CG 3.3Å; L922-L926 WeakPolarHBondContact O-CG 3.23Å; L922-L926 PolarHBondContact O-N 2.98Å; E923-L926 PolarHBondContact O-N 2.98Å; F924-L926 VanDerWaalsContact C-N 3.34Å; F924-L926 PolarHBondContact O-N 3.39Å; L926-A929 PolarHBondContact O-N 3.02Å; L926-V930 WeakPolarHBondContact O-CG2 3.46Å; L926-K954 HydrophobicContact CD2-CB 4.02Å; L926-L955 HydrophobicContact CB-CB 4.14Å; L926-L955 HydrophobicContact CB-CD1 3.57Å; L926-L955 HydrophobicContact CB-CG 4.45Å; L926-L955 HydrophobicContact CD1-CD1 4.49Å; L926-H958 HydrophobicContact CD1-CB 3.64Å
927	Y	94.6	Very high	92.2	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.3	-47	175.9	-177.8	-91.2	0	0	0	111.6	E923 F924 A929 V930 P1060 F1062 I1119 Q1123	E923-Y927 WeakPolarHBondContact O-CB 3.17Å; E923-Y927 PolarHBondContact O-N 3.39Å; F924-Y927 PolarHBondContact O-N 3.01Å; Y927-A929 VanDerWaalsContact C-N 3.31Å; Y927-A929 PolarHBondContact O-N 3.38Å; Y927-V930 PolarHBondContact O-N 3Å; Y927-P1060 HydrophobicContact CE2-CB 4.23Å; Y927-P1060 HydrophobicContact CE2-CG 4.33Å; Y927-F1062 AromaticContact CD2-CD2 3.53Å; Y927-F1062 HydrophobicContact CD2-CD2 3.53Å; Y927-F1062 AromaticContact CD2-CE2 3.99Å; Y927-F1062 HydrophobicContact CD2-CE2 3.99Å; Y927-F1062 AromaticContact CE2-CD2 3.48Å; Y927-F1062 HydrophobicContact CE2-CD2 3.48Å; Y927-F1062 VanDerWaalsContact CE2-CD2 3.48Å; Y927-F1062 AromaticContact CE2-CE2 3.83Å; Y927-F1062 HydrophobicContact CE2-CE2 3.83Å; Y927-F1062 HydrophobicContact CE2-CG 4.5Å; Y927-I1119 HydrophobicContact CE1-CG2 4.34Å; Y927-Q1123 HydrophobicContact CD1-CG 3.75Å; Y927-Q1123 HydrophobicContact CE1-CG 3.54Å; Y927-Q1123 PolarHBondContact O-NE2 2.85Å
928	R	93	Very high	92.1	Very high	97 Å²	97	19 Å²	19	37%	0.366	10%	0.1	S	C	.	.	H	α-helix	trans	-67	-29.6	178	-175.7	172.9	61.2	149	-2.2	112.9	F924 D925 V930 Q1123	F924-R928 VanDerWaalsContact O-CB 3.27Å; F924-R928 WeakPolarHBondContact O-CB 3.43Å; F924-R928 PolarHBondContact O-N 3.01Å; D925-R928 PolarHBondContact O-N 2.97Å; D925-R928 IonicContact OD1-CZ 3.78Å; D925-R928 IonicContact OD1-NH2 3.2Å; D925-R928 PolarHBondContact OD1-NH2 2.97Å; R928-V930 VanDerWaalsContact C-N 3.29Å; R928-V930 PolarHBondContact O-N 3.4Å; R928-Q1123 HydrophobicContact CG-CB 4.36Å
929	A	92.7	Very high	91.9	Very high	37 Å²	37	18.9 Å²	18.9	31%	0.306	10%	0.1	S	C	.	.	H	α-helix	trans	-72.1	-19.5	177.7	0	0	0	0	0	113.8	D925 L926 Y927 K931 Q951	D925-A929 VanDerWaalsContact O-CB 3.27Å; D925-A929 WeakPolarHBondContact O-CB 3.39Å; D925-A929 PolarHBondContact O-N 2.94Å; L926-A929 PolarHBondContact O-N 3.02Å; Y927-A929 VanDerWaalsContact C-N 3.31Å; Y927-A929 PolarHBondContact O-N 3.38Å; A929-K931 PolarHBondContact O-N 2.74Å; A929-Q951 HydrophobicContact CB-CB 4.19Å; A929-Q951 HydrophobicContact CB-CG 4.26Å
930	V	92.9	Very high	91.7	Very high	4 Å²	4	20.1 Å²	20.1	2%	0.024	10%	0.104	C	C	.	.			trans	-68	116.2	179.7	-175.3	0	0	0	0	110.4	L926 Y927 R928 E934 L935 L952 L955 F1062 Q1123	L926-V930 WeakPolarHBondContact O-CG2 3.46Å; Y927-V930 PolarHBondContact O-N 3Å; R928-V930 VanDerWaalsContact C-N 3.29Å; R928-V930 PolarHBondContact O-N 3.4Å; V930-E934 HydrophobicContact CG1-CB 4.36Å; V930-L935 HydrophobicContact CG1-CD2 4.22Å; V930-L935 HydrophobicContact CG1-CG 4.37Å; V930-L952 HydrophobicContact CG1-CB 4.17Å; V930-L952 HydrophobicContact CG2-CB 4.38Å; V930-L955 HydrophobicContact CG2-CD2 4.4Å; V930-F1062 HydrophobicContact CB-CE2 4.07Å; V930-F1062 HydrophobicContact CB-CZ 4.21Å; V930-F1062 HydrophobicContact CG1-CE2 4.1Å; V930-F1062 HydrophobicContact CG1-CZ 3.72Å; V930-F1062 HydrophobicContact CG2-CE2 4Å; V930-F1062 HydrophobicContact CG2-CZ 4.39Å; V930-Q1123 PolarHBondContact O-NE2 3.37Å
931	K	90.1	Very high	91.6	Very high	91 Å²	91	23.7 Å²	23.7	40%	0.396	13%	0.126	S	C	.	.			trans	-89.4	152.3	179	-64	179.4	180	179.7	0	111.6	Y820 A929 I933 E934	Y820-K931 HydrophobicContact CD1-CD 3.83Å; Y820-K931 HydrophobicContact CG-CD 4.18Å; A929-K931 PolarHBondContact O-N 2.74Å; K931-I933 VanDerWaalsContact C-N 3.25Å; K931-I933 HydrophobicContact CB-CG2 3.96Å; K931-I933 PolarHBondContact O-N 2.99Å; K931-I933 VanDerWaalsContact O-N 3.16Å; K931-E934 HydrophobicContact CB-CG 4.41Å; K931-E934 PolarHBondContact N-OE1 3.41Å; K931-E934 WeakPolarHBondContact O-CB 3.27Å; K931-E934 PolarHBondContact O-N 3.14Å
932	P	88.9	Confident	91.4	Very high	11 Å²	11	28.3 Å²	28.3	7%	0.071	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-52.7	-36.9	176.4	-31.5	37.6	0	0	0	115.3	T721 E934 L935 V936 I1116	T721-P932 HydrophobicContact CG2-CB 4.03Å; P932-E934 PolarHBondContact O-N 3.49Å; P932-E934 VanDerWaalsContact O-N 3.16Å; P932-L935 PolarHBondContact O-N 3.46Å; P932-V936 PolarHBondContact O-N 3.04Å; P932-I1116 HydrophobicContact CB-CD1 4.49Å; P932-I1116 HydrophobicContact CB-CG2 3.84Å; P932-I1116 HydrophobicContact CG-CG2 3.83Å
933	I	88.4	Confident	91.1	Very high	27 Å²	27	38 Å²	38	14%	0.138	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-58.3	-27.1	178.4	-171.7	170.5	0	0	0	113.1	Y820 K931 L935	Y820-I933 HydrophobicContact CD2-CB 4.32Å; Y820-I933 HydrophobicContact CD2-CD1 3.98Å; Y820-I933 HydrophobicContact CD2-CG2 4.01Å; Y820-I933 HydrophobicContact CE2-CB 3.63Å; Y820-I933 HydrophobicContact CE2-CD1 3.72Å; Y820-I933 HydrophobicContact CE2-CG1 4.2Å; Y820-I933 HydrophobicContact CE2-CG2 3.76Å; K931-I933 VanDerWaalsContact C-N 3.25Å; K931-I933 HydrophobicContact CB-CG2 3.96Å; K931-I933 PolarHBondContact O-N 2.99Å; K931-I933 VanDerWaalsContact O-N 3.16Å; I933-L935 PolarHBondContact O-N 3Å
934	E	91.2	Very high	90.8	Very high	6 Å²	6	41.4 Å²	41.4	3%	0.028	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-73.8	-16	179	-56.3	-173.4	-122.6	0	0	112.5	V930 K931 P932 R948 S949 Q951 L952	V930-E934 HydrophobicContact CG1-CB 4.36Å; K931-E934 HydrophobicContact CB-CG 4.41Å; K931-E934 PolarHBondContact N-OE1 3.41Å; K931-E934 WeakPolarHBondContact O-CB 3.27Å; K931-E934 PolarHBondContact O-N 3.14Å; P932-E934 PolarHBondContact O-N 3.49Å; P932-E934 VanDerWaalsContact O-N 3.16Å; E934-R948 WeakPolarHBondContact CG-O 3.21Å; E934-S949 PolarHBondContact O-OG 3.5Å; E934-S949 WeakPolarHBondContact OE2-CA 3.33Å; E934-Q951 WeakPolarHBondContact OE1-CB 3.43Å; E934-Q951 WeakPolarHBondContact OE1-CG 3.44Å; E934-Q951 WeakPolarHBondContact OE2-CA 3.42Å; E934-Q951 PolarHBondContact OE2-N 3.48Å; E934-L952 PolarHBondContact OE2-N 2.85Å
935	L	92.3	Very high	90.7	Very high	3 Å²	3	45.4 Å²	45.4	2%	0.016	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-31.7	-174.4	-54.5	178.2	0	0	0	113.1	V930 P932 I933 A938 W940 L952 F1062 L1066 I1069 I1116 I1119	V930-L935 HydrophobicContact CG1-CD2 4.22Å; V930-L935 HydrophobicContact CG1-CG 4.37Å; P932-L935 PolarHBondContact O-N 3.46Å; I933-L935 PolarHBondContact O-N 3Å; L935-A938 PolarHBondContact O-N 2.96Å; L935-W940 HydrophobicContact CB-CZ3 4.31Å; L935-W940 HydrophobicContact CD2-CE3 4.37Å; L935-W940 HydrophobicContact CD2-CZ3 4.22Å; L935-W940 VanDerWaalsContact O-CZ3 3.22Å; L935-W940 WeakPolarHBondContact O-CZ3 3.22Å; L935-L952 HydrophobicContact CD2-CD2 3.89Å; L935-F1062 HydrophobicContact CD1-CE1 4.25Å; L935-F1062 HydrophobicContact CD1-CZ 3.99Å; L935-F1062 HydrophobicContact CD2-CE1 3.59Å; L935-F1062 HydrophobicContact CD2-CZ 3.9Å; L935-L1066 HydrophobicContact CD2-CD2 4Å; L935-I1069 HydrophobicContact CB-CD1 4.19Å; L935-I1069 HydrophobicContact CD1-CD1 4.47Å; L935-I1116 HydrophobicContact CB-CD1 4.32Å; L935-I1116 HydrophobicContact CD1-CG1 4.12Å; L935-I1119 HydrophobicContact CD1-CD1 3.76Å
936	V	87.8	Confident	90.4	Very high	4 Å²	4	48 Å²	48	2%	0.024	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-69.9	135.5	-176.4	174.7	0	0	0	0	111.2	T722 P932 A938 I1116	T722-V936 HydrophobicContact CG2-CG2 4.44Å; P932-V936 PolarHBondContact O-N 3.04Å; V936-A938 VanDerWaalsContact C-N 3.28Å; V936-A938 PolarHBondContact O-N 3.28Å; V936-I1116 HydrophobicContact CG2-CD1 3.76Å
937	G	85	Confident	90.1	Very high	18 Å²	18	55.5 Å²	55.5	19%	0.186	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	75.5	16.3	-178.3	0	0	0	0	0	113.9	A939 K942 E1073	G937-A939 PolarHBondContact O-N 3.03Å; G937-K942 WeakPolarHBondContact O-CE 3.31Å; G937-E1073 WeakPolarHBondContact CA-OE1 3.47Å; G937-E1073 PolarHBondContact N-OE1 2.93Å
938	A	88.3	Confident	89.7	Confident	6 Å²	6	59.9 Å²	59.9	5%	0.05	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	47.9	43	-170.3	0	0	0	0	0	112.1	L935 V936 W940 T941 E1073	L935-A938 PolarHBondContact O-N 2.96Å; V936-A938 VanDerWaalsContact C-N 3.28Å; V936-A938 PolarHBondContact O-N 3.28Å; A938-W940 HydrophobicContact CB-CH2 4.26Å; A938-W940 HydrophobicContact CB-CZ3 4.38Å; A938-W940 PolarHBondContact O-N 2.84Å; A938-T941 HydrophobicContact CB-CG2 4.17Å; A938-T941 WeakPolarHBondContact O-CB 3.5Å; A938-T941 PolarHBondContact O-N 3.1Å; A938-T941 PolarHBondContact O-OG1 2.95Å; A938-E1073 HydrophobicContact CB-CG 4.28Å
939	A	88	Confident	89.6	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-53	-33.5	-170	0	0	0	0	0	113.9	G937 T941 K942 R948	G937-A939 PolarHBondContact O-N 3.03Å; A939-T941 PolarHBondContact O-N 2.93Å; A939-K942 WeakPolarHBondContact O-CB 3.31Å; A939-K942 PolarHBondContact O-N 2.67Å; A939-K942 VanDerWaalsContact O-N 3.15Å; A939-R948 HydrophobicContact CB-CB 3.95Å
940	W	91.1	Very high	89.7	Confident	26 Å²	26	55.8 Å²	55.8	10%	0.098	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-68.3	-15.1	179.4	73.5	89.6	0	0	0	114.5	L935 A938 K945 S949 L952 L1066 I1069 I1070	L935-W940 HydrophobicContact CB-CZ3 4.31Å; L935-W940 HydrophobicContact CD2-CE3 4.37Å; L935-W940 HydrophobicContact CD2-CZ3 4.22Å; L935-W940 VanDerWaalsContact O-CZ3 3.22Å; L935-W940 WeakPolarHBondContact O-CZ3 3.22Å; A938-W940 HydrophobicContact CB-CH2 4.26Å; A938-W940 HydrophobicContact CB-CZ3 4.38Å; A938-W940 PolarHBondContact O-N 2.84Å; W940-K945 VanDerWaalsContact O-CB 3.26Å; W940-K945 WeakPolarHBondContact O-CB 3.36Å; W940-K945 WeakPolarHBondContact O-CD 2.98Å; W940-S949 WeakPolarHBondContact CA-OG 3.4Å; W940-S949 PolarHBondContact N-OG 3.45Å; W940-L952 HydrophobicContact CB-CD2 3.73Å; W940-L952 HydrophobicContact CD2-CD2 3.97Å; W940-L952 HydrophobicContact CE3-CD2 4.08Å; W940-L952 HydrophobicContact CG-CD2 3.82Å; W940-L1066 HydrophobicContact CD2-CD2 4.15Å; W940-L1066 HydrophobicContact CE3-CD2 4.24Å; W940-L1066 HydrophobicContact CH2-CB 4.4Å; W940-L1066 HydrophobicContact CH2-CD2 3.81Å; W940-L1066 HydrophobicContact CZ2-CB 3.76Å; W940-L1066 HydrophobicContact CZ2-CD2 3.68Å; W940-L1066 HydrophobicContact CZ2-CG 4.21Å; W940-L1066 HydrophobicContact CZ3-CD2 4.06Å; W940-I1069 HydrophobicContact CH2-CB 3.88Å; W940-I1069 HydrophobicContact CH2-CD1 4.48Å; W940-I1069 HydrophobicContact CH2-CG2 3.6Å; W940-I1069 HydrophobicContact CZ3-CG2 4.06Å; W940-I1070 HydrophobicContact CH2-CG1 4.31Å; W940-I1070 HydrophobicContact CZ2-CD1 3.75Å; W940-I1070 HydrophobicContact CZ2-CG1 3.63Å
941	T	91.3	Very high	89.7	Confident	75 Å²	75	58.3 Å²	58.3	46%	0.46	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-89.1	-13.5	176.2	68.5	0	0	0	0	113	A938 A939 I1070	A938-T941 HydrophobicContact CB-CG2 4.17Å; A938-T941 WeakPolarHBondContact O-CB 3.5Å; A938-T941 PolarHBondContact O-N 3.1Å; A938-T941 PolarHBondContact O-OG1 2.95Å; A939-T941 PolarHBondContact O-N 2.93Å; T941-I1070 HydrophobicContact CG2-CD1 4.21Å; T941-I1070 HydrophobicContact CG2-CG1 4.47Å
942	K	89.4	Confident	89.9	Confident	107 Å²	107	54 Å²	54	47%	0.465	26%	0.261	S	S	.	.	S	Bend	trans	-83.4	169.4	-175.1	-54.4	-59.7	-178.7	-175	0	111.3	G937 A939 D944 K945	G937-K942 WeakPolarHBondContact O-CE 3.31Å; A939-K942 WeakPolarHBondContact O-CB 3.31Å; A939-K942 PolarHBondContact O-N 2.67Å; A939-K942 VanDerWaalsContact O-N 3.15Å; K942-D944 WeakPolarHBondContact CB-OD1 3.42Å; K942-D944 PolarHBondContact O-N 3.48Å; K942-K945 WeakPolarHBondContact O-CB 3.5Å; K942-K945 PolarHBondContact O-N 3.39Å
943	K	89.4	Confident	90.2	Very high	211 Å²	211	54.5 Å²	54.5	92%	0.917	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-28.2	-178.3	-68.2	-176.3	178.8	179.3	0	112.7
944	D	89.7	Confident	90.5	Very high	71 Å²	71	58 Å²	58	38%	0.38	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	18.6	-177.7	59.5	-36.9	0	0	0	113.4	K942 D946 K947 R948	K942-D944 WeakPolarHBondContact CB-OD1 3.42Å; K942-D944 PolarHBondContact O-N 3.48Å; D944-D946 PolarHBondContact O-N 2.91Å; D944-D946 VanDerWaalsContact O-N 3.1Å; D944-K947 PolarHBondContact O-N 3.29Å; D944-R948 PolarHBondContact O-N 3.4Å; D944-R948 WeakPolarHBondContact OD2-CD 3.45Å; D944-R948 WeakPolarHBondContact OD2-CG 3.47Å
945	K	91	Very high	90.6	Very high	87 Å²	87	58 Å²	58	38%	0.378	28%	0.278	S	S	.	.	H	α-helix	trans	-50.9	-34.5	-179.8	63.1	-179.1	-175.4	-179.2	0	114.2	W940 K942 K947 R948 S949 L953	W940-K945 VanDerWaalsContact O-CB 3.26Å; W940-K945 WeakPolarHBondContact O-CB 3.36Å; W940-K945 WeakPolarHBondContact O-CD 2.98Å; K942-K945 WeakPolarHBondContact O-CB 3.5Å; K942-K945 PolarHBondContact O-N 3.39Å; K945-K947 VanDerWaalsContact C-N 3.26Å; K945-K947 PolarHBondContact O-N 2.79Å; K945-R948 PolarHBondContact O-N 3.49Å; K945-S949 WeakPolarHBondContact O-CA 3.4Å; K945-S949 PolarHBondContact O-N 2.82Å; K945-L953 HydrophobicContact CB-CD1 4.15Å; K945-L953 HydrophobicContact CD-CD1 4.44Å; K945-L953 HydrophobicContact CG-CD1 4.04Å; K945-L953 WeakPolarHBondContact O-CD1 3.36Å
946	D	89.1	Confident	90.7	Very high	101 Å²	101	61 Å²	61	54%	0.54	29%	0.293	S	S	.	.	H	α-helix	trans	-68.3	-26.9	-178.7	-57.1	-70.6	0	0	0	112.5	D944	D944-D946 PolarHBondContact O-N 2.91Å; D944-D946 VanDerWaalsContact O-N 3.1Å
947	K	88.3	Confident	90.9	Very high	184 Å²	184	65.2 Å²	65.2	80%	0.8	31%	0.312	S	S	*	.	H	α-helix	trans	-88.6	-41.6	174.7	-65.4	-175.4	178.5	-176.2	0	111.7	D944 K945	D944-K947 PolarHBondContact O-N 3.29Å; K945-K947 VanDerWaalsContact C-N 3.26Å; K945-K947 PolarHBondContact O-N 2.79Å
948	R	85.9	Confident	91.3	Very high	91 Å²	91	65.3 Å²	65.3	34%	0.343	31%	0.308	S	S	.	.	H	α-helix	trans	-85.5	-28.3	-172.3	-70.7	-169.9	62.4	171.7	-0.6	115.3	E934 A939 D944 K945	E934-R948 WeakPolarHBondContact CG-O 3.21Å; A939-R948 HydrophobicContact CB-CB 3.95Å; D944-R948 PolarHBondContact O-N 3.4Å; D944-R948 WeakPolarHBondContact OD2-CD 3.45Å; D944-R948 WeakPolarHBondContact OD2-CG 3.47Å; K945-R948 PolarHBondContact O-N 3.49Å
949	S	91.7	Very high	91.6	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	31%	0.314	C	S	.	.	S	Bend	trans	-131.1	48.1	-175.8	-51.5	0	0	0	0	113	E934 W940 K945 Q951 L953	E934-S949 PolarHBondContact O-OG 3.5Å; E934-S949 WeakPolarHBondContact OE2-CA 3.33Å; W940-S949 WeakPolarHBondContact CA-OG 3.4Å; W940-S949 PolarHBondContact N-OG 3.45Å; K945-S949 WeakPolarHBondContact O-CA 3.4Å; K945-S949 PolarHBondContact O-N 2.82Å; S949-Q951 PolarHBondContact O-N 3.48Å; S949-L953 WeakPolarHBondContact O-CB 3.28Å; S949-L953 WeakPolarHBondContact O-CG 3.31Å; S949-L953 PolarHBondContact O-N 3.42Å
950	P	93.4	Very high	91.8	Very high	49 Å²	49	68.6 Å²	68.6	32%	0.318	33%	0.328	S	S	.	.	H	α-helix	trans	-66.3	-36.7	-171.2	27.4	-35.5	0	0	0	113.8	K954	P950-K954 WeakPolarHBondContact O-CG 3.36Å; P950-K954 PolarHBondContact O-N 3.02Å
951	Q	93.7	Very high	91.9	Very high	56 Å²	56	70.7 Å²	70.7	26%	0.262	34%	0.338	S	S	.	.	H	α-helix	trans	-79	-38.4	-177.2	-49.3	-61.7	-7	0	0	110.7	A929 E934 S949 L953 K954 L955	A929-Q951 HydrophobicContact CB-CB 4.19Å; A929-Q951 HydrophobicContact CB-CG 4.26Å; E934-Q951 WeakPolarHBondContact OE1-CB 3.43Å; E934-Q951 WeakPolarHBondContact OE1-CG 3.44Å; E934-Q951 WeakPolarHBondContact OE2-CA 3.42Å; E934-Q951 PolarHBondContact OE2-N 3.48Å; S949-Q951 PolarHBondContact O-N 3.48Å; Q951-L953 VanDerWaalsContact C-N 3.31Å; Q951-L953 PolarHBondContact O-N 3.19Å; Q951-K954 WeakPolarHBondContact O-CB 3.42Å; Q951-K954 PolarHBondContact O-N 2.95Å; Q951-L955 PolarHBondContact O-N 3.4Å
952	L	94.2	Very high	92.1	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-58.8	-44.3	171.2	177.2	63.3	0	0	0	111.2	V930 E934 L935 W940 K954 L955 I956 F1062 L1066	V930-L952 HydrophobicContact CG1-CB 4.17Å; V930-L952 HydrophobicContact CG2-CB 4.38Å; E934-L952 PolarHBondContact OE2-N 2.85Å; L935-L952 HydrophobicContact CD2-CD2 3.89Å; W940-L952 HydrophobicContact CB-CD2 3.73Å; W940-L952 HydrophobicContact CD2-CD2 3.97Å; W940-L952 HydrophobicContact CE3-CD2 4.08Å; W940-L952 HydrophobicContact CG-CD2 3.82Å; L952-K954 PolarHBondContact O-N 3.24Å; L952-L955 WeakPolarHBondContact O-CB 3.38Å; L952-L955 PolarHBondContact O-N 2.81Å; L952-I956 HydrophobicContact CD1-CD1 4.11Å; L952-I956 HydrophobicContact CD1-CG1 4.43Å; L952-I956 HydrophobicContact CG-CD1 3.98Å; L952-I956 WeakPolarHBondContact O-CG1 3.4Å; L952-I956 PolarHBondContact O-N 3.12Å; L952-F1062 HydrophobicContact CD1-CD1 3.68Å; L952-F1062 HydrophobicContact CD1-CE1 3.72Å; L952-F1062 HydrophobicContact CD1-CG 4.14Å; L952-F1062 HydrophobicContact CD1-CZ 4.19Å; L952-L1066 HydrophobicContact CD1-CD1 4.4Å; L952-L1066 HydrophobicContact CD1-CD2 4.25Å; L952-L1066 HydrophobicContact CD2-CD2 3.87Å
953	L	94.4	Very high	92.3	Very high	23 Å²	23	63.1 Å²	63.1	12%	0.12	30%	0.301	C	S	.	.	H	α-helix	trans	-65.4	-37.8	177.2	-71.1	174.3	0	0	0	112	K945 S949 Q951 I956 Q957	K945-L953 HydrophobicContact CB-CD1 4.15Å; K945-L953 HydrophobicContact CD-CD1 4.44Å; K945-L953 HydrophobicContact CG-CD1 4.04Å; K945-L953 WeakPolarHBondContact O-CD1 3.36Å; S949-L953 WeakPolarHBondContact O-CB 3.28Å; S949-L953 WeakPolarHBondContact O-CG 3.31Å; S949-L953 PolarHBondContact O-N 3.42Å; Q951-L953 VanDerWaalsContact C-N 3.31Å; Q951-L953 PolarHBondContact O-N 3.19Å; L953-I956 PolarHBondContact O-N 3.39Å; L953-Q957 VanDerWaalsContact O-CB 3.25Å; L953-Q957 WeakPolarHBondContact O-CB 3.47Å; L953-Q957 WeakPolarHBondContact O-CG 3.41Å; L953-Q957 PolarHBondContact O-N 2.91Å
954	K	94.3	Very high	92.6	Very high	101 Å²	101	53.7 Å²	53.7	44%	0.439	26%	0.259	S	S	.	.	H	α-helix	trans	-61.4	-43.1	173	-76.1	174.3	-170	170.4	0	112.2	L926 P950 Q951 L952 Q957 H958	L926-K954 HydrophobicContact CD2-CB 4.02Å; P950-K954 WeakPolarHBondContact O-CG 3.36Å; P950-K954 PolarHBondContact O-N 3.02Å; Q951-K954 WeakPolarHBondContact O-CB 3.42Å; Q951-K954 PolarHBondContact O-N 2.95Å; L952-K954 PolarHBondContact O-N 3.24Å; K954-Q957 PolarHBondContact O-N 2.75Å; K954-H958 WeakPolarHBondContact O-CB 3.37Å; K954-H958 PolarHBondContact O-N 2.92Å
955	L	94.4	Very high	92.7	Very high	6 Å²	6	51.7 Å²	51.7	3%	0.031	25%	0.247	C	C	.	.	H	α-helix	trans	-58.4	-51.3	175.4	179.3	69.5	0	0	0	111	L926 V930 Q951 L952 Q957 H958 S959 F1062	L926-L955 HydrophobicContact CB-CB 4.14Å; L926-L955 HydrophobicContact CB-CD1 3.57Å; L926-L955 HydrophobicContact CB-CG 4.45Å; L926-L955 HydrophobicContact CD1-CD1 4.49Å; V930-L955 HydrophobicContact CG2-CD2 4.4Å; Q951-L955 PolarHBondContact O-N 3.4Å; L952-L955 WeakPolarHBondContact O-CB 3.38Å; L952-L955 PolarHBondContact O-N 2.81Å; L955-Q957 VanDerWaalsContact C-N 3.35Å; L955-Q957 PolarHBondContact O-N 3.02Å; L955-H958 PolarHBondContact O-N 3.06Å; L955-S959 WeakPolarHBondContact O-CB 3.47Å; L955-S959 PolarHBondContact O-N 3.09Å; L955-F1062 HydrophobicContact CD2-CB 4Å; L955-F1062 HydrophobicContact CD2-CD2 3.6Å; L955-F1062 HydrophobicContact CD2-CE2 4.41Å; L955-F1062 HydrophobicContact CD2-CG 3.99Å
956	I	93.9	Very high	92.8	Very high	65 Å²	65	47.6 Å²	47.6	33%	0.333	23%	0.229	S	C	.	.	H	α-helix	trans	-62.4	-42.1	179.4	-65.4	167.8	0	0	0	111.2	L952 L953 S959 T960 L1066	L952-I956 HydrophobicContact CD1-CD1 4.11Å; L952-I956 HydrophobicContact CD1-CG1 4.43Å; L952-I956 HydrophobicContact CG-CD1 3.98Å; L952-I956 WeakPolarHBondContact O-CG1 3.4Å; L952-I956 PolarHBondContact O-N 3.12Å; L953-I956 PolarHBondContact O-N 3.39Å; I956-S959 PolarHBondContact O-N 3.42Å; I956-T960 WeakPolarHBondContact O-CB 3.41Å; I956-T960 PolarHBondContact O-N 3.3Å; I956-T960 PolarHBondContact O-OG1 3.03Å; I956-L1066 HydrophobicContact CD1-CD1 4.16Å
957	Q	92.8	Very high	93	Very high	93 Å²	93	43.6 Å²	43.6	44%	0.435	21%	0.207	S	C	.	.	H	α-helix	trans	-66.4	-41.7	178.3	-75.5	173.7	10.8	0	0	112.1	L953 K954 L955 T960 K961	L953-Q957 VanDerWaalsContact O-CB 3.25Å; L953-Q957 WeakPolarHBondContact O-CB 3.47Å; L953-Q957 WeakPolarHBondContact O-CG 3.41Å; L953-Q957 PolarHBondContact O-N 2.91Å; K954-Q957 PolarHBondContact O-N 2.75Å; L955-Q957 VanDerWaalsContact C-N 3.35Å; L955-Q957 PolarHBondContact O-N 3.02Å; Q957-T960 PolarHBondContact O-N 3.24Å; Q957-K961 WeakPolarHBondContact O-CB 3.44Å; Q957-K961 WeakPolarHBondContact O-CG 3.41Å; Q957-K961 PolarHBondContact O-N 3.19Å
958	H	93.9	Very high	93.2	Very high	19 Å²	19	36.8 Å²	36.8	9%	0.088	18%	0.177	C	C	.	.	H	α-helix	trans	-57.9	-52.4	174.7	172.8	-89.9	0	0	0	110.1	L922 E923 L926 K954 L955 T960 K961 F962	L922-H958 WeakPolarHBondContact CD2-NE2 3.34Å; E923-H958 IonicContact OE1-CE1 3.66Å; L926-H958 HydrophobicContact CD1-CB 3.64Å; K954-H958 WeakPolarHBondContact O-CB 3.37Å; K954-H958 PolarHBondContact O-N 2.92Å; L955-H958 PolarHBondContact O-N 3.06Å; H958-T960 VanDerWaalsContact C-N 3.3Å; H958-T960 PolarHBondContact O-N 3.02Å; H958-K961 PolarHBondContact O-N 2.85Å; H958-K961 VanDerWaalsContact O-N 3.08Å; H958-F962 PolarHBondContact O-N 2.96Å
959	S	93.5	Very high	93.4	Very high	25 Å²	25	32.6 Å²	32.6	18%	0.175	16%	0.162	C	C	.	.	H	α-helix	trans	-55.8	-44.7	179.7	-175.5	0	0	0	0	112.5	L955 I956 F962 T963 E1004	L955-S959 WeakPolarHBondContact O-CB 3.47Å; L955-S959 PolarHBondContact O-N 3.09Å; I956-S959 PolarHBondContact O-N 3.42Å; S959-F962 PolarHBondContact O-N 3.28Å; S959-T963 WeakPolarHBondContact O-CB 3.48Å; S959-T963 PolarHBondContact O-N 2.94Å; S959-T963 PolarHBondContact O-OG1 3.38Å; S959-E1004 WeakPolarHBondContact CA-OE1 3.46Å; S959-E1004 WeakPolarHBondContact CB-OE1 3.39Å; S959-E1004 VanDerWaalsContact OG-CD 3.31Å; S959-E1004 VanDerWaalsContact OG-CG 3.24Å; S959-E1004 WeakPolarHBondContact OG-CG 3.41Å; S959-E1004 PolarHBondContact OG-OE1 3.04Å
960	T	92.9	Very high	93.4	Very high	50 Å²	50	32.6 Å²	32.6	31%	0.307	16%	0.162	S	C	.	.	H	α-helix	trans	-64.7	-43	176.5	-56.9	0	0	0	0	112.4	I956 Q957 H958 Y964	I956-T960 WeakPolarHBondContact O-CB 3.41Å; I956-T960 PolarHBondContact O-N 3.3Å; I956-T960 PolarHBondContact O-OG1 3.03Å; Q957-T960 PolarHBondContact O-N 3.24Å; H958-T960 VanDerWaalsContact C-N 3.3Å; H958-T960 PolarHBondContact O-N 3.02Å; T960-Y964 HydrophobicContact CG2-CD2 3.76Å; T960-Y964 HydrophobicContact CG2-CE2 3.34Å; T960-Y964 WeakPolarHBondContact O-CD2 3.39Å; T960-Y964 PolarHBondContact O-N 2.97Å; T960-Y964 VanDerWaalsContact O-N 3.08Å
961	K	93.3	Very high	93.3	Very high	70 Å²	70	30.3 Å²	30.3	30%	0.304	15%	0.147	S	C	.	.	H	α-helix	trans	-66.7	-41.3	179.2	-74.3	168.5	175.9	-177.9	0	111.8	Q957 H958 W965 P1144	Q957-K961 WeakPolarHBondContact O-CB 3.44Å; Q957-K961 WeakPolarHBondContact O-CG 3.41Å; Q957-K961 PolarHBondContact O-N 3.19Å; H958-K961 PolarHBondContact O-N 2.85Å; H958-K961 VanDerWaalsContact O-N 3.08Å; K961-W965 WeakPolarHBondContact O-CB 3.43Å; K961-W965 PolarHBondContact O-N 3.29Å; K961-P1144 HydrophobicContact CB-CG 4.2Å; K961-P1144 HydrophobicContact CG-CG 4.36Å; K961-P1144 WeakPolarHBondContact O-CG 3.32Å
962	F	94.6	Very high	92.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.2	-45	178.1	-176.7	-108.2	0	0	0	111.2	I919 H958 S959 Y964 W965 L966 F993 E1004 F1139 L1142	I919-F962 HydrophobicContact CD1-CD2 3.72Å; I919-F962 HydrophobicContact CD1-CE2 3.58Å; I919-F962 HydrophobicContact CD1-CG 4.48Å; I919-F962 HydrophobicContact CD1-CZ 4.22Å; I919-F962 HydrophobicContact CG1-CD2 4.43Å; I919-F962 HydrophobicContact CG1-CE2 3.81Å; I919-F962 HydrophobicContact CG1-CZ 4.04Å; I919-F962 HydrophobicContact CG2-CZ 4.45Å; H958-F962 PolarHBondContact O-N 2.96Å; S959-F962 PolarHBondContact O-N 3.28Å; F962-Y964 PolarHBondContact O-N 3.15Å; F962-W965 HydrophobicContact CD2-CE3 4.05Å; F962-W965 HydrophobicContact CD2-CZ3 4.42Å; F962-W965 AromaticContact CE2-CE3 3.93Å; F962-W965 HydrophobicContact CE2-CE3 3.93Å; F962-W965 AromaticContact CE2-CZ3 3.85Å; F962-W965 HydrophobicContact CE2-CZ3 3.85Å; F962-W965 WeakPolarHBondContact O-CB 3.26Å; F962-W965 PolarHBondContact O-N 2.99Å; F962-L966 HydrophobicContact CD1-CD1 4.08Å; F962-L966 HydrophobicContact CE1-CD1 3.59Å; F962-L966 HydrophobicContact CE1-CG 4.29Å; F962-L966 HydrophobicContact CZ-CD1 3.9Å; F962-L966 HydrophobicContact CZ-CD2 4.42Å; F962-L966 HydrophobicContact CZ-CG 4.27Å; F962-L966 PolarHBondContact O-N 2.94Å; F962-F993 HydrophobicContact CE1-CE2 4.39Å; F962-F993 HydrophobicContact CE1-CZ 4.42Å; F962-E1004 HydrophobicContact CD1-CB 4.38Å; F962-E1004 WeakPolarHBondContact CD1-OE2 3.09Å; F962-F1139 HydrophobicContact CD2-CD1 4.48Å; F962-F1139 HydrophobicContact CE2-CD1 4.41Å; F962-F1139 HydrophobicContact CE2-CE1 4.11Å; F962-L1142 HydrophobicContact CD2-CD1 4.21Å
963	T	94.8	Very high	92.5	Very high	23 Å²	23	29.6 Å²	29.6	14%	0.141	14%	0.144	C	C	.	.	H	α-helix	trans	-53.3	-55.4	173	-57.2	0	0	0	0	111.3	S959 W965 L966 E967 V1008	S959-T963 WeakPolarHBondContact O-CB 3.48Å; S959-T963 PolarHBondContact O-N 2.94Å; S959-T963 PolarHBondContact O-OG1 3.38Å; T963-W965 VanDerWaalsContact C-N 3.31Å; T963-W965 PolarHBondContact O-N 3.49Å; T963-L966 PolarHBondContact O-N 3.23Å; T963-E967 PolarHBondContact O-N 3.05Å; T963-V1008 HydrophobicContact CG2-CG2 3.67Å; T963-V1008 WeakPolarHBondContact O-CG2 3.32Å
964	Y	93.7	Very high	91.8	Very high	13 Å²	13	29.4 Å²	29.4	5%	0.051	15%	0.148	C	C	.	.	H	α-helix	trans	-65.2	-31.4	179.5	-71.7	-48.2	0	0	0	114.1	T960 F962 E967 K968 K1151 L1154 E1155 L1158	T960-Y964 HydrophobicContact CG2-CD2 3.76Å; T960-Y964 HydrophobicContact CG2-CE2 3.34Å; T960-Y964 WeakPolarHBondContact O-CD2 3.39Å; T960-Y964 PolarHBondContact O-N 2.97Å; T960-Y964 VanDerWaalsContact O-N 3.08Å; F962-Y964 PolarHBondContact O-N 3.15Å; Y964-E967 PolarHBondContact O-N 2.98Å; Y964-K968 VanDerWaalsContact O-CB 3.24Å; Y964-K968 WeakPolarHBondContact O-CB 3.45Å; Y964-K968 PolarHBondContact O-N 3.1Å; Y964-K1151 HydrophobicContact CE2-CD 4.19Å; Y964-K1151 HydrophobicContact CE2-CG 4.23Å; Y964-K1151 WeakPolarHBondContact OH-CD 3.01Å; Y964-K1151 WeakPolarHBondContact OH-CE 3.38Å; Y964-K1151 WeakPolarHBondContact OH-CG 3.49Å; Y964-K1151 PolarHBondContact OH-NZ 3.12Å; Y964-L1154 HydrophobicContact CD1-CD2 4.13Å; Y964-L1154 HydrophobicContact CD2-CD2 3.99Å; Y964-L1154 HydrophobicContact CE2-CD2 4.49Å; Y964-L1154 HydrophobicContact CG-CD2 3.8Å; Y964-E1155 HydrophobicContact CE1-CG 3.99Å; Y964-E1155 PolarHBondContact OH-OE1 3.42Å; Y964-L1158 HydrophobicContact CD1-CD1 3.96Å; Y964-L1158 HydrophobicContact CE1-CD1 4.47Å
965	W	92.8	Very high	91.3	Very high	30 Å²	30	25.6 Å²	25.6	11%	0.114	13%	0.133	C	C	.	.	H	α-helix	trans	-63.9	-43	174.9	174.2	75.4	0	0	0	111.2	L907 K961 F962 T963 K968 C969 F1138 F1139 L1142	L907-W965 HydrophobicContact CB-CH2 4.3Å; L907-W965 HydrophobicContact CD1-CH2 3.66Å; L907-W965 HydrophobicContact CD1-CZ3 4.05Å; K961-W965 WeakPolarHBondContact O-CB 3.43Å; K961-W965 PolarHBondContact O-N 3.29Å; F962-W965 HydrophobicContact CD2-CE3 4.05Å; F962-W965 HydrophobicContact CD2-CZ3 4.42Å; F962-W965 AromaticContact CE2-CE3 3.93Å; F962-W965 HydrophobicContact CE2-CE3 3.93Å; F962-W965 AromaticContact CE2-CZ3 3.85Å; F962-W965 HydrophobicContact CE2-CZ3 3.85Å; F962-W965 WeakPolarHBondContact O-CB 3.26Å; F962-W965 PolarHBondContact O-N 2.99Å; T963-W965 VanDerWaalsContact C-N 3.31Å; T963-W965 PolarHBondContact O-N 3.49Å; W965-K968 PolarHBondContact O-N 2.98Å; W965-C969 PolarHBondContact O-N 2.87Å; W965-C969 PolarHBondContact O-SG 2.92Å; W965-F1138 HydrophobicContact CZ2-CE1 4.2Å; W965-F1138 HydrophobicContact CZ2-CZ 4.07Å; W965-F1139 HydrophobicContact CH2-CE1 4.16Å; W965-F1139 HydrophobicContact CZ3-CE1 4.12Å; W965-L1142 HydrophobicContact CB-CD1 4.31Å; W965-L1142 HydrophobicContact CB-CD2 4.42Å; W965-L1142 HydrophobicContact CD2-CD1 4.27Å; W965-L1142 HydrophobicContact CD2-CD2 4.14Å; W965-L1142 HydrophobicContact CE3-CD1 4.5Å; W965-L1142 HydrophobicContact CG-CD1 4.18Å; W965-L1142 HydrophobicContact CG-CD2 3.79Å
966	L	93.9	Very high	90.9	Very high	1 Å²	1	26 Å²	26	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-64.6	-43.9	173.8	-69.1	-179.1	0	0	0	112	L907 F962 T963 K968 C969 V970 I986 I1005 V1008	L907-L966 HydrophobicContact CD1-CD2 4.41Å; F962-L966 HydrophobicContact CD1-CD1 4.08Å; F962-L966 HydrophobicContact CE1-CD1 3.59Å; F962-L966 HydrophobicContact CE1-CG 4.29Å; F962-L966 HydrophobicContact CZ-CD1 3.9Å; F962-L966 HydrophobicContact CZ-CD2 4.42Å; F962-L966 HydrophobicContact CZ-CG 4.27Å; F962-L966 PolarHBondContact O-N 2.94Å; T963-L966 PolarHBondContact O-N 3.23Å; L966-K968 VanDerWaalsContact C-N 3.33Å; L966-K968 PolarHBondContact O-N 3.28Å; L966-C969 WeakPolarHBondContact O-CB 3.17Å; L966-C969 PolarHBondContact O-N 3.22Å; L966-V970 PolarHBondContact O-N 3.48Å; L966-I986 HydrophobicContact CB-CD1 4.33Å; L966-I986 HydrophobicContact CD2-CD1 4.23Å; L966-I986 HydrophobicContact CD2-CG1 4.1Å; L966-I1005 HydrophobicContact CD1-CG1 4.02Å; L966-V1008 HydrophobicContact CB-CG1 4.04Å; L966-V1008 HydrophobicContact CB-CG2 3.74Å; L966-V1008 HydrophobicContact CD1-CG2 4.09Å
967	E	93.3	Very high	90.6	Very high	17 Å²	17	26.4 Å²	26.4	8%	0.079	14%	0.137	C	C	.	.	H	α-helix	trans	-58.2	-46.8	176.7	-73	-169.4	-125.7	0	0	112	T963 Y964 C969 V970 V971 V1008 S1011 I1014 L1158	T963-E967 PolarHBondContact O-N 3.05Å; Y964-E967 PolarHBondContact O-N 2.98Å; E967-C969 VanDerWaalsContact C-N 3.33Å; E967-C969 PolarHBondContact O-N 3.29Å; E967-V970 PolarHBondContact O-N 3.21Å; E967-V970 VanDerWaalsContact O-N 3.09Å; E967-V971 PolarHBondContact O-N 3.42Å; E967-V1008 HydrophobicContact CG-CB 4.25Å; E967-V1008 HydrophobicContact CG-CG1 3.89Å; E967-V1008 HydrophobicContact CG-CG2 4.15Å; E967-S1011 WeakPolarHBondContact OE2-CB 3.38Å; E967-S1011 PolarHBondContact OE2-OG 3.12Å; E967-I1014 HydrophobicContact CB-CD1 4.28Å; E967-I1014 HydrophobicContact CG-CD1 4.01Å; E967-L1158 HydrophobicContact CB-CD1 4.09Å; E967-L1158 HydrophobicContact CB-CD2 4.41Å
968	K	90.9	Very high	90.2	Very high	40 Å²	40	22.5 Å²	22.5	17%	0.174	12%	0.119	C	C	.	.	H	α-helix	trans	-60.6	-41.4	177.1	-169.5	173.8	-175.9	176	0	111.7	Y964 W965 L966 V970 V971 E972 L1158	Y964-K968 VanDerWaalsContact O-CB 3.24Å; Y964-K968 WeakPolarHBondContact O-CB 3.45Å; Y964-K968 PolarHBondContact O-N 3.1Å; W965-K968 PolarHBondContact O-N 2.98Å; L966-K968 VanDerWaalsContact C-N 3.33Å; L966-K968 PolarHBondContact O-N 3.28Å; K968-V970 PolarHBondContact O-N 3.11Å; K968-V971 PolarHBondContact O-N 3.16Å; K968-E972 WeakPolarHBondContact CE-OE1 3.4Å; K968-E972 WeakPolarHBondContact CE-OE2 3.3Å; K968-E972 HydrophobicContact CG-CG 3.86Å; K968-E972 WeakPolarHBondContact CG-OE2 3.14Å; K968-E972 VanDerWaalsContact O-CB 3.26Å; K968-E972 WeakPolarHBondContact O-CB 3.31Å; K968-E972 VanDerWaalsContact O-CG 3.29Å; K968-E972 WeakPolarHBondContact O-CG 3.32Å; K968-E972 PolarHBondContact O-N 3.17Å; K968-L1158 HydrophobicContact CB-CD2 4.13Å
969	C	90.6	Very high	90	Very high	4 Å²	4	21.7 Å²	21.7	3%	0.027	12%	0.115	C	C	.	.	H	α-helix	trans	-58.7	-34.1	175.2	-71.1	0	0	0	0	112.6	W965 L966 E967 C973 V982	W965-C969 PolarHBondContact O-N 2.87Å; W965-C969 PolarHBondContact O-SG 2.92Å; L966-C969 WeakPolarHBondContact O-CB 3.17Å; L966-C969 PolarHBondContact O-N 3.22Å; E967-C969 VanDerWaalsContact C-N 3.33Å; E967-C969 PolarHBondContact O-N 3.29Å; C969-C973 PolarHBondContact O-SG 3.49Å; C969-V982 HydrophobicContact CB-CG1 4.15Å
970	V	91.9	Very high	89.9	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-77.6	-52.2	178.8	177.8	0	0	0	0	111.4	L966 E967 K968 C973 R979 V982 M983 I986 I1014 L1017	L966-V970 PolarHBondContact O-N 3.48Å; E967-V970 PolarHBondContact O-N 3.21Å; E967-V970 VanDerWaalsContact O-N 3.09Å; K968-V970 PolarHBondContact O-N 3.11Å; V970-C973 WeakPolarHBondContact O-CB 3.41Å; V970-C973 PolarHBondContact O-N 3.16Å; V970-R979 HydrophobicContact CG1-CG 3.97Å; V970-R979 WeakPolarHBondContact O-CD 3.38Å; V970-V982 HydrophobicContact CG2-CG1 3.78Å; V970-M983 HydrophobicContact CG1-CG 4.01Å; V970-M983 HydrophobicContact CG1-SD 4.2Å; V970-M983 HydrophobicContact CG2-CG 4.02Å; V970-I986 HydrophobicContact CG2-CD1 3.62Å; V970-I1014 HydrophobicContact CB-CD1 3.8Å; V970-I1014 HydrophobicContact CB-CG1 4.27Å; V970-I1014 HydrophobicContact CG1-CD1 4.01Å; V970-I1014 HydrophobicContact CG1-CG1 4.01Å; V970-I1014 HydrophobicContact CG2-CD1 3.91Å; V970-L1017 HydrophobicContact CG1-CD1 4Å
971	V	90.8	Very high	89.8	Confident	1 Å²	1	19.7 Å²	19.7	1%	0.006	10%	0.104	C	C	.	.	H	α-helix	trans	-76.8	-22.7	-172.2	-57.5	0	0	0	0	114	E967 K968 C973 A1013 I1014 L1158 R1161 I1165	E967-V971 PolarHBondContact O-N 3.42Å; K968-V971 PolarHBondContact O-N 3.16Å; V971-C973 VanDerWaalsContact C-N 3.26Å; V971-C973 PolarHBondContact O-N 3.25Å; V971-A1013 HydrophobicContact CG1-CB 4.17Å; V971-I1014 HydrophobicContact CG1-CG1 4.43Å; V971-L1158 HydrophobicContact CG2-CD2 3.51Å; V971-R1161 HydrophobicContact CB-CB 4.1Å; V971-R1161 HydrophobicContact CG2-CB 4.13Å; V971-I1165 HydrophobicContact CB-CD1 4.47Å
972	E	86.8	Confident	89.7	Confident	34 Å²	34	16.6 Å²	16.6	16%	0.159	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-12.7	174.1	-66.2	-169.7	153	0	0	112.7	K968 G974 Y1157	K968-E972 WeakPolarHBondContact CE-OE1 3.4Å; K968-E972 WeakPolarHBondContact CE-OE2 3.3Å; K968-E972 HydrophobicContact CG-CG 3.86Å; K968-E972 WeakPolarHBondContact CG-OE2 3.14Å; K968-E972 VanDerWaalsContact O-CB 3.26Å; K968-E972 WeakPolarHBondContact O-CB 3.31Å; K968-E972 VanDerWaalsContact O-CG 3.29Å; K968-E972 WeakPolarHBondContact O-CG 3.32Å; K968-E972 PolarHBondContact O-N 3.17Å; E972-G974 PolarHBondContact O-N 3.36Å; E972-G974 VanDerWaalsContact O-N 3.15Å; E972-Y1157 PolarHBondContact OE1-OH 3.32Å
973	C	84.3	Confident	89.6	Confident	6 Å²	6	16.6 Å²	16.6	4%	0.041	9%	0.091	C	C	.	.			trans	-80.4	91.2	172.6	-70.1	0	0	0	0	111.2	C969 V970 V971 N975 R979	C969-C973 PolarHBondContact O-SG 3.49Å; V970-C973 WeakPolarHBondContact O-CB 3.41Å; V970-C973 PolarHBondContact O-N 3.16Å; V971-C973 VanDerWaalsContact C-N 3.26Å; V971-C973 PolarHBondContact O-N 3.25Å; C973-N975 VanDerWaalsContact C-N 3.35Å; C973-N975 PolarHBondContact O-N 3.25Å; C973-R979 HydrophobicContact CB-CB 3.87Å; C973-R979 HydrophobicContact CB-CG 4.28Å; C973-R979 PolarHBondContact O-NH1 2.94Å
974	G	80.1	Confident	89.5	Confident	20 Å²	20	17 Å²	17	21%	0.206	9%	0.092	C	C	.	.			trans	-61.7	-38.9	177.4	0	0	0	0	0	113.5	E972 R979 F1176	E972-G974 PolarHBondContact O-N 3.36Å; E972-G974 VanDerWaalsContact O-N 3.15Å; G974-R979 PolarHBondContact O-NH1 3Å; G974-F1176 WeakPolarHBondContact O-CD2 3.46Å
975	N	84.1	Confident	89.3	Confident	20 Å²	20	16.4 Å²	16.4	11%	0.107	9%	0.09	C	C	.	.	S	Bend	trans	-76.1	128.6	179.3	-169.2	-74	0	0	0	111.6	C973 N977 E978 R979 F1176	C973-N975 VanDerWaalsContact C-N 3.35Å; C973-N975 PolarHBondContact O-N 3.25Å; N975-N977 VanDerWaalsContact C-N 3.35Å; N975-N977 PolarHBondContact O-N 3Å; N975-N977 WeakPolarHBondContact OD1-CB 3.32Å; N975-N977 PolarHBondContact OD1-N 3.44Å; N975-E978 HydrophobicContact CB-CB 4.22Å; N975-E978 HydrophobicContact CB-CG 4.09Å; N975-E978 PolarHBondContact O-N 2.83Å; N975-R979 WeakPolarHBondContact O-CB 3.47Å; N975-R979 PolarHBondContact O-N 3.29Å; N975-F1176 PolarHBondContact ND2-O 3.46Å; N975-F1176 VanDerWaalsContact ND2-O 3.08Å
976	I	86.9	Confident	89.4	Confident	15 Å²	15	15 Å²	15	8%	0.077	8%	0.084	C	C	.	.	H	α-helix	trans	-60.9	-37.6	-178.9	-173	159.3	0	0	0	113.8	E978 R979 V980 H1019 R1023 P1173	I976-E978 PolarHBondContact O-N 3.37Å; I976-R979 PolarHBondContact O-N 3.33Å; I976-V980 HydrophobicContact CG1-CG2 4.24Å; I976-V980 WeakPolarHBondContact O-CB 3.4Å; I976-V980 WeakPolarHBondContact O-CG2 3.46Å; I976-V980 PolarHBondContact O-N 3.41Å; I976-H1019 HydrophobicContact CD1-CB 3.82Å; I976-R1023 VanDerWaalsContact CD1-CZ 3.47Å; I976-P1173 HydrophobicContact CD1-CG 3.75Å
977	N	86.5	Confident	89.4	Confident	73 Å²	73	15 Å²	15	39%	0.39	9%	0.085	S	C	.	.	H	α-helix	trans	-69.8	-36.6	-178.8	-62.2	-34.7	0	0	0	111.4	N975 A981 L1185	N975-N977 VanDerWaalsContact C-N 3.35Å; N975-N977 PolarHBondContact O-N 3Å; N975-N977 WeakPolarHBondContact OD1-CB 3.32Å; N975-N977 PolarHBondContact OD1-N 3.44Å; N977-A981 PolarHBondContact O-N 2.94Å; N977-A981 VanDerWaalsContact O-N 3.13Å; N977-L1185 HydrophobicContact CB-CD1 4Å; N977-L1185 HydrophobicContact CB-CD2 4.37Å
978	E	84.7	Confident	89.4	Confident	12 Å²	12	15.4 Å²	15.4	6%	0.056	9%	0.086	C	C	.	.	H	α-helix	trans	-68.4	-43.3	174.7	-66.8	173.5	172.7	0	0	110.8	N975 I976 A981 V982 L1187 L1202	N975-E978 HydrophobicContact CB-CB 4.22Å; N975-E978 HydrophobicContact CB-CG 4.09Å; N975-E978 PolarHBondContact O-N 2.83Å; I976-E978 PolarHBondContact O-N 3.37Å; E978-A981 WeakPolarHBondContact O-CB 3.41Å; E978-A981 PolarHBondContact O-N 3.46Å; E978-A981 VanDerWaalsContact O-N 3.12Å; E978-V982 WeakPolarHBondContact O-CG2 3.32Å; E978-V982 PolarHBondContact O-N 3.13Å; E978-L1187 HydrophobicContact CB-CD2 3.92Å; E978-L1187 HydrophobicContact CB-CG 4.07Å; E978-L1187 HydrophobicContact CG-CD2 4.08Å; E978-L1187 HydrophobicContact CG-CG 3.86Å; E978-L1187 WeakPolarHBondContact OE1-CA 3.33Å; E978-L1187 PolarHBondContact OE1-N 3.18Å; E978-L1187 WeakPolarHBondContact OE2-CD2 3.21Å; E978-L1202 HydrophobicContact CG-CD1 3.87Å
979	R	90.5	Very high	89.6	Confident	1 Å²	1	13.6 Å²	13.6	0%	0.004	8%	0.078	C	C	.	.	H	α-helix	trans	-62.9	-42.3	177.6	-168.6	167.8	59.1	-111	7.9	112.6	V970 C973 G974 N975 I976 A981 V982 M983 T1020 E1166	V970-R979 HydrophobicContact CG1-CG 3.97Å; V970-R979 WeakPolarHBondContact O-CD 3.38Å; C973-R979 HydrophobicContact CB-CB 3.87Å; C973-R979 HydrophobicContact CB-CG 4.28Å; C973-R979 PolarHBondContact O-NH1 2.94Å; G974-R979 PolarHBondContact O-NH1 3Å; N975-R979 WeakPolarHBondContact O-CB 3.47Å; N975-R979 PolarHBondContact O-N 3.29Å; I976-R979 PolarHBondContact O-N 3.33Å; R979-A981 VanDerWaalsContact C-N 3.31Å; R979-A981 PolarHBondContact O-N 3.48Å; R979-V982 PolarHBondContact O-N 3.08Å; R979-M983 PolarHBondContact O-N 2.93Å; R979-T1020 HydrophobicContact CB-CG2 4.47Å; R979-T1020 HydrophobicContact CG-CG2 3.95Å; R979-T1020 PolarHBondContact NE-OG1 3.02Å; R979-T1020 PolarHBondContact NH2-OG1 3.42Å; R979-E1166 IonicContact CZ-OE1 2.71Å; R979-E1166 IonicContact NE-OE1 3.85Å; R979-E1166 IonicContact NH2-OE1 2.81Å; R979-E1166 PolarHBondContact NH2-OE1 3.17Å
980	V	91.3	Very high	89.7	Confident	17 Å²	17	13.4 Å²	13.4	10%	0.103	8%	0.077	C	C	.	.	H	α-helix	trans	-59.8	-41.2	171.7	167	0	0	0	0	111	I976 M983 N984 T1020 R1023 L1024	I976-V980 HydrophobicContact CG1-CG2 4.24Å; I976-V980 WeakPolarHBondContact O-CB 3.4Å; I976-V980 WeakPolarHBondContact O-CG2 3.46Å; I976-V980 PolarHBondContact O-N 3.41Å; V980-M983 PolarHBondContact O-N 3.39Å; V980-N984 WeakPolarHBondContact O-CB 3.4Å; V980-N984 PolarHBondContact O-N 3.31Å; V980-N984 PolarHBondContact O-ND2 3.49Å; V980-T1020 HydrophobicContact CG2-CG2 3.87Å; V980-R1023 HydrophobicContact CG1-CB 4.26Å; V980-R1023 WeakPolarHBondContact CG1-O 3.45Å; V980-R1023 HydrophobicContact CG2-CB 3.62Å; V980-L1024 HydrophobicContact CG1-CD2 4.25Å
981	A	89.4	Confident	89.8	Confident	17 Å²	17	14 Å²	14	14%	0.14	8%	0.081	C	C	.	.	H	α-helix	trans	-65.7	-38.6	176.2	0	0	0	0	0	112.3	F908 N977 E978 R979 R985 L1202	F908-A981 HydrophobicContact CE1-CB 4.06Å; F908-A981 HydrophobicContact CZ-CB 3.74Å; N977-A981 PolarHBondContact O-N 2.94Å; N977-A981 VanDerWaalsContact O-N 3.13Å; E978-A981 WeakPolarHBondContact O-CB 3.41Å; E978-A981 PolarHBondContact O-N 3.46Å; E978-A981 VanDerWaalsContact O-N 3.12Å; R979-A981 VanDerWaalsContact C-N 3.31Å; R979-A981 PolarHBondContact O-N 3.48Å; A981-R985 WeakPolarHBondContact O-CB 3.47Å; A981-R985 PolarHBondContact O-N 3.2Å; A981-L1202 HydrophobicContact CB-CB 4.13Å; A981-L1202 HydrophobicContact CB-CD1 4.36Å
982	V	91.3	Very high	89.8	Confident	4 Å²	4	14.2 Å²	14.2	2%	0.024	8%	0.082	C	C	.	.	H	α-helix	trans	-63	-50	175.3	170.8	0	0	0	0	110.4	L907 F908 C969 V970 E978 R979 N984 R985 I986	L907-V982 HydrophobicContact CD2-CG1 3.8Å; F908-V982 HydrophobicContact CE2-CG2 3.52Å; F908-V982 HydrophobicContact CZ-CG2 3.92Å; C969-V982 HydrophobicContact CB-CG1 4.15Å; V970-V982 HydrophobicContact CG2-CG1 3.78Å; E978-V982 WeakPolarHBondContact O-CG2 3.32Å; E978-V982 PolarHBondContact O-N 3.13Å; R979-V982 PolarHBondContact O-N 3.08Å; V982-N984 PolarHBondContact O-N 3.12Å; V982-R985 WeakPolarHBondContact O-CB 3.29Å; V982-R985 PolarHBondContact O-N 3.4Å; V982-R985 VanDerWaalsContact O-N 3.12Å; V982-I986 HydrophobicContact CG1-CD1 4.02Å; V982-I986 WeakPolarHBondContact O-CG1 3.33Å; V982-I986 PolarHBondContact O-N 3.46Å
983	M	92.9	Very high	90.2	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-63.7	-40.7	179.8	-77.1	-172.2	76	0	0	112.2	V970 R979 V980 R985 I986 L987 L1009 I1014 T1020 W1021 L1024	V970-M983 HydrophobicContact CG1-CG 4.01Å; V970-M983 HydrophobicContact CG1-SD 4.2Å; V970-M983 HydrophobicContact CG2-CG 4.02Å; R979-M983 PolarHBondContact O-N 2.93Å; V980-M983 PolarHBondContact O-N 3.39Å; M983-R985 VanDerWaalsContact C-N 3.31Å; M983-R985 PolarHBondContact O-N 3.14Å; M983-I986 PolarHBondContact O-N 3.33Å; M983-L987 WeakPolarHBondContact O-CG 3.32Å; M983-L987 PolarHBondContact O-N 2.74Å; M983-L1009 HydrophobicContact CE-CD2 3.68Å; M983-I1014 HydrophobicContact CE-CG2 3.87Å; M983-I1014 HydrophobicContact SD-CG2 4.42Å; M983-T1020 HydrophobicContact CG-CG2 4.39Å; M983-T1020 HydrophobicContact SD-CG2 3.34Å; M983-T1020 WeakPolarHBondContact SD-CG2 3.47Å; M983-W1021 HydrophobicContact CE-CD2 4.06Å; M983-W1021 HydrophobicContact CE-CE3 4.41Å; M983-W1021 HydrophobicContact CE-CH2 4.13Å; M983-W1021 HydrophobicContact CE-CZ2 3.74Å; M983-W1021 HydrophobicContact CE-CZ3 4.44Å; M983-L1024 HydrophobicContact CB-CD1 4.39Å; M983-L1024 HydrophobicContact CB-CD2 3.47Å; M983-L1024 VanDerWaalsContact CB-CD2 3.47Å; M983-L1024 HydrophobicContact CE-CD1 3.79Å; M983-L1024 HydrophobicContact SD-CD1 4.43Å; M983-L1024 HydrophobicContact SD-CD2 4.49Å
984	N	93.1	Very high	90.5	Very high	31 Å²	31	14.6 Å²	14.6	17%	0.166	8%	0.084	C	C	.	.	H	α-helix	trans	-60.9	-39.6	172.2	-78.5	-34.6	0	0	0	111.8	V980 V982 I986 L987 E988 D1025 L1028	V980-N984 WeakPolarHBondContact O-CB 3.4Å; V980-N984 PolarHBondContact O-N 3.31Å; V980-N984 PolarHBondContact O-ND2 3.49Å; V982-N984 PolarHBondContact O-N 3.12Å; N984-I986 PolarHBondContact O-N 2.94Å; N984-L987 PolarHBondContact O-N 3.08Å; N984-E988 WeakPolarHBondContact O-CG 3.3Å; N984-E988 PolarHBondContact O-N 3.4Å; N984-D1025 PolarHBondContact OD1-N 3.37Å; N984-L1028 HydrophobicContact CB-CD1 4.1Å
985	R	90.2	Very high	90.9	Very high	2 Å²	2	18.9 Å²	18.9	1%	0.008	10%	0.098	C	C	.	.	H	α-helix	trans	-64.3	-38.5	175.6	178.3	59.1	67.4	84.6	4.2	112.4	L907 L910 A981 V982 M983 E988 I989	L907-R985 HydrophobicContact CD1-CG 4.26Å; L907-R985 HydrophobicContact CD2-CB 4.26Å; L907-R985 HydrophobicContact CD2-CG 3.96Å; L907-R985 HydrophobicContact CG-CG 3.83Å; L907-R985 PolarHBondContact O-NH1 3.48Å; L910-R985 PolarHBondContact O-NH1 3.47Å; L910-R985 VanDerWaalsContact O-NH1 3.14Å; A981-R985 WeakPolarHBondContact O-CB 3.47Å; A981-R985 PolarHBondContact O-N 3.2Å; V982-R985 WeakPolarHBondContact O-CB 3.29Å; V982-R985 PolarHBondContact O-N 3.4Å; V982-R985 VanDerWaalsContact O-N 3.12Å; M983-R985 VanDerWaalsContact C-N 3.31Å; M983-R985 PolarHBondContact O-N 3.14Å; R985-E988 IonicContact NE-OE2 3.37Å; R985-E988 PolarHBondContact NE-OE2 3.37Å; R985-E988 WeakPolarHBondContact O-CB 3.16Å; R985-E988 PolarHBondContact O-N 2.87Å; R985-I989 HydrophobicContact CG-CD1 4.42Å; R985-I989 WeakPolarHBondContact O-CG1 3.27Å; R985-I989 PolarHBondContact O-N 3.14Å; R985-I989 VanDerWaalsContact O-N 3.12Å
986	I	94.6	Very high	91.2	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-63.2	-44.6	174.7	-68.1	172.7	0	0	0	110.2	L907 L966 V970 V982 M983 N984 E988 I989 M990 I1005	L907-I986 HydrophobicContact CD2-CG1 4.35Å; L966-I986 HydrophobicContact CB-CD1 4.33Å; L966-I986 HydrophobicContact CD2-CD1 4.23Å; L966-I986 HydrophobicContact CD2-CG1 4.1Å; V970-I986 HydrophobicContact CG2-CD1 3.62Å; V982-I986 HydrophobicContact CG1-CD1 4.02Å; V982-I986 WeakPolarHBondContact O-CG1 3.33Å; V982-I986 PolarHBondContact O-N 3.46Å; M983-I986 PolarHBondContact O-N 3.33Å; N984-I986 PolarHBondContact O-N 2.94Å; I986-E988 VanDerWaalsContact C-N 3.32Å; I986-E988 PolarHBondContact O-N 3.48Å; I986-I989 WeakPolarHBondContact O-CB 3.5Å; I986-I989 PolarHBondContact O-N 3.12Å; I986-M990 PolarHBondContact O-N 3.35Å; I986-I1005 HydrophobicContact CG2-CB 4.45Å; I986-I1005 HydrophobicContact CG2-CD1 4.35Å; I986-I1005 HydrophobicContact CG2-CG1 4.23Å; I986-I1005 HydrophobicContact CG2-CG2 3.53Å
987	L	94.3	Very high	91.5	Very high	2 Å²	2	19.3 Å²	19.3	1%	0.01	10%	0.101	C	C	.	.	H	α-helix	trans	-64.8	-33.4	176.3	-68.5	174.1	0	0	0	113.2	M983 N984 M990 C991 L1009 L1024 L1028 L1029 F1032	M983-L987 WeakPolarHBondContact O-CG 3.32Å; M983-L987 PolarHBondContact O-N 2.74Å; N984-L987 PolarHBondContact O-N 3.08Å; L987-M990 HydrophobicContact CD2-SD 4.19Å; L987-M990 WeakPolarHBondContact O-CB 3.25Å; L987-M990 PolarHBondContact O-N 2.9Å; L987-C991 PolarHBondContact O-N 2.81Å; L987-C991 VanDerWaalsContact O-N 3.15Å; L987-C991 PolarHBondContact O-SG 3.13Å; L987-L1009 HydrophobicContact CD2-CD1 3.64Å; L987-L1024 HydrophobicContact CD1-CD1 4.3Å; L987-L1028 HydrophobicContact CB-CB 3.89Å; L987-L1028 HydrophobicContact CB-CD1 4.07Å; L987-L1028 HydrophobicContact CB-CG 4.39Å; L987-L1028 HydrophobicContact CD1-CB 3.85Å; L987-L1028 HydrophobicContact CG-CB 4.49Å; L987-L1029 HydrophobicContact CD1-CD2 4.45Å; L987-F1032 HydrophobicContact CD2-CB 3.8Å; L987-F1032 HydrophobicContact CD2-CD2 4.17Å; L987-F1032 HydrophobicContact CD2-CG 4.15Å
988	E	92.9	Very high	91.9	Very high	25 Å²	25	15.9 Å²	15.9	12%	0.117	8%	0.082	C	C	.	.	H	α-helix	trans	-62.9	-44.5	171.6	-75.5	175.3	163.4	0	0	111.9	P912 N984 R985 I986 M990 C991 I992 L1028 S1204 I1207	P912-E988 HydrophobicContact CB-CB 4.37Å; N984-E988 WeakPolarHBondContact O-CG 3.3Å; N984-E988 PolarHBondContact O-N 3.4Å; R985-E988 IonicContact NE-OE2 3.37Å; R985-E988 PolarHBondContact NE-OE2 3.37Å; R985-E988 WeakPolarHBondContact O-CB 3.16Å; R985-E988 PolarHBondContact O-N 2.87Å; I986-E988 VanDerWaalsContact C-N 3.32Å; I986-E988 PolarHBondContact O-N 3.48Å; E988-M990 VanDerWaalsContact C-N 3.29Å; E988-M990 PolarHBondContact O-N 3.36Å; E988-C991 WeakPolarHBondContact O-CB 3.47Å; E988-C991 PolarHBondContact O-N 3.07Å; E988-I992 WeakPolarHBondContact O-CD1 3.45Å; E988-I992 PolarHBondContact O-N 2.7Å; E988-L1028 HydrophobicContact CG-CD1 4.05Å; E988-L1028 HydrophobicContact CG-CD2 4.28Å; E988-S1204 WeakPolarHBondContact OE1-CB 3.42Å; E988-S1204 PolarHBondContact OE1-OG 3.48Å; E988-S1204 VanDerWaalsContact OE2-CB 3.29Å; E988-S1204 WeakPolarHBondContact OE2-CB 3.45Å; E988-S1204 PolarHBondContact OE2-OG 2.99Å; E988-I1207 HydrophobicContact CB-CG2 3.57Å; E988-I1207 HydrophobicContact CG-CG2 3.81Å
989	I	93.6	Very high	92.3	Very high	1 Å²	1	15.8 Å²	15.8	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-61.4	-40.6	175.7	-65.4	163.9	0	0	0	110.3	L907 P912 I915 A916 R985 I986 C991 I992 F993 I1005	L907-I989 HydrophobicContact CD1-CD1 4.01Å; P912-I989 HydrophobicContact CB-CG1 4.18Å; I915-I989 HydrophobicContact CB-CD1 4.31Å; I915-I989 HydrophobicContact CD1-CD1 4.09Å; I915-I989 HydrophobicContact CG2-CD1 3.82Å; I915-I989 HydrophobicContact CG2-CG1 4.39Å; A916-I989 HydrophobicContact CB-CG2 4.17Å; R985-I989 HydrophobicContact CG-CD1 4.42Å; R985-I989 WeakPolarHBondContact O-CG1 3.27Å; R985-I989 PolarHBondContact O-N 3.14Å; R985-I989 VanDerWaalsContact O-N 3.12Å; I986-I989 WeakPolarHBondContact O-CB 3.5Å; I986-I989 PolarHBondContact O-N 3.12Å; I989-C991 VanDerWaalsContact C-N 3.33Å; I989-C991 PolarHBondContact O-N 3.28Å; I989-I992 PolarHBondContact O-N 3.37Å; I989-I992 VanDerWaalsContact O-N 3.07Å; I989-F993 HydrophobicContact CG2-CD2 4.07Å; I989-F993 HydrophobicContact CG2-CE1 4.36Å; I989-F993 HydrophobicContact CG2-CE2 3.65Å; I989-F993 HydrophobicContact CG2-CZ 3.8Å; I989-F993 PolarHBondContact O-N 3.38Å; I989-I1005 HydrophobicContact CB-CD1 4.18Å; I989-I1005 HydrophobicContact CG2-CD1 3.86Å
990	M	94.4	Very high	92.4	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.005	8%	0.083	C	C	.	.	H	α-helix	trans	-58.3	-41.7	176.3	-167.1	177.7	175.5	0	0	112.8	I986 L987 E988 I992 F993 Q994 L1002 I1005 L1009 F1032 V1035	I986-M990 PolarHBondContact O-N 3.35Å; L987-M990 HydrophobicContact CD2-SD 4.19Å; L987-M990 WeakPolarHBondContact O-CB 3.25Å; L987-M990 PolarHBondContact O-N 2.9Å; E988-M990 VanDerWaalsContact C-N 3.29Å; E988-M990 PolarHBondContact O-N 3.36Å; M990-I992 VanDerWaalsContact C-N 3.28Å; M990-I992 PolarHBondContact O-N 2.81Å; M990-F993 PolarHBondContact O-N 3.46Å; M990-Q994 PolarHBondContact O-N 3.31Å; M990-Q994 VanDerWaalsContact O-N 3.12Å; M990-L1002 HydrophobicContact CG-CD2 3.75Å; M990-L1002 VanDerWaalsContact O-CD2 3.32Å; M990-L1002 WeakPolarHBondContact O-CD2 3.41Å; M990-I1005 HydrophobicContact CB-CD1 3.85Å; M990-I1005 HydrophobicContact CB-CG2 4.06Å; M990-I1005 HydrophobicContact CG-CB 4.47Å; M990-I1005 HydrophobicContact CG-CD1 4.47Å; M990-I1005 HydrophobicContact CG-CG2 4.07Å; M990-I1005 HydrophobicContact SD-CG2 3.77Å; M990-L1009 HydrophobicContact SD-CD1 4.48Å; M990-F1032 HydrophobicContact CE-CD2 3.88Å; M990-F1032 HydrophobicContact SD-CD2 3.87Å; M990-V1035 HydrophobicContact CE-CB 3.42Å; M990-V1035 VanDerWaalsContact CE-CB 3.42Å; M990-V1035 HydrophobicContact CE-CG1 3.22Å; M990-V1035 HydrophobicContact CE-CG2 4.02Å
991	C	92.4	Very high	92.6	Very high	12 Å²	12	15.3 Å²	15.3	8%	0.081	8%	0.079	C	C	.	.	H	α-helix	trans	-60	-40.3	175.1	-62.3	0	0	0	0	111.5	L987 E988 I989 Q994 E995 I1207	L987-C991 PolarHBondContact O-N 2.81Å; L987-C991 VanDerWaalsContact O-N 3.15Å; L987-C991 PolarHBondContact O-SG 3.13Å; E988-C991 WeakPolarHBondContact O-CB 3.47Å; E988-C991 PolarHBondContact O-N 3.07Å; I989-C991 VanDerWaalsContact C-N 3.33Å; I989-C991 PolarHBondContact O-N 3.28Å; C991-Q994 WeakPolarHBondContact O-CB 3.39Å; C991-Q994 PolarHBondContact O-N 3.45Å; C991-E995 PolarHBondContact O-N 3.1Å; C991-I1207 HydrophobicContact CB-CD1 4.01Å
992	I	91.8	Very high	92.8	Very high	6 Å²	6	14.9 Å²	14.9	3%	0.031	7%	0.074	C	C	.	.	H	α-helix	trans	-73.2	-38.3	-178.8	-58.7	150	0	0	0	111.2	P912 I913 A916 E988 I989 M990 Q994 E995 L996 I1207	P912-I992 HydrophobicContact CB-CD1 4.09Å; I913-I992 HydrophobicContact CB-CD1 4.27Å; I913-I992 HydrophobicContact CG1-CD1 3.79Å; I913-I992 HydrophobicContact CG1-CG1 4.34Å; A916-I992 HydrophobicContact CB-CB 3.71Å; A916-I992 HydrophobicContact CB-CD1 4.29Å; A916-I992 HydrophobicContact CB-CG2 3.41Å; A916-I992 VanDerWaalsContact CB-CG2 3.41Å; E988-I992 WeakPolarHBondContact O-CD1 3.45Å; E988-I992 PolarHBondContact O-N 2.7Å; I989-I992 PolarHBondContact O-N 3.37Å; I989-I992 VanDerWaalsContact O-N 3.07Å; M990-I992 VanDerWaalsContact C-N 3.28Å; M990-I992 PolarHBondContact O-N 2.81Å; I992-Q994 PolarHBondContact O-N 3.07Å; I992-E995 PolarHBondContact O-N 3.23Å; I992-E995 VanDerWaalsContact O-N 3.14Å; I992-L996 HydrophobicContact CG2-CD1 4Å; I992-L996 HydrophobicContact CG2-CG 4.3Å; I992-L996 WeakPolarHBondContact O-CG 3.48Å; I992-L996 PolarHBondContact O-N 2.74Å; I992-I1207 HydrophobicContact CD1-CB 4.42Å; I992-I1207 HydrophobicContact CD1-CG2 3.97Å; I992-I1207 HydrophobicContact CG1-CB 4.34Å; I992-I1207 HydrophobicContact CG1-CG2 4.26Å
993	F	94.5	Very high	92.9	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-59.3	-36.7	172.4	-74.1	-29.5	0	0	0	112.3	A916 I919 F962 I989 M990 L996 N997 N998 G1001 L1002 I1005	A916-F993 HydrophobicContact CB-CD1 4.01Å; A916-F993 HydrophobicContact CB-CE1 3.92Å; A916-F993 WeakPolarHBondContact O-CE1 3.4Å; I919-F993 HydrophobicContact CB-CE1 4.14Å; I919-F993 HydrophobicContact CB-CZ 4.07Å; I919-F993 HydrophobicContact CG2-CE1 3.91Å; I919-F993 HydrophobicContact CG2-CZ 3.61Å; F962-F993 HydrophobicContact CE1-CE2 4.39Å; F962-F993 HydrophobicContact CE1-CZ 4.42Å; I989-F993 HydrophobicContact CG2-CD2 4.07Å; I989-F993 HydrophobicContact CG2-CE1 4.36Å; I989-F993 HydrophobicContact CG2-CE2 3.65Å; I989-F993 HydrophobicContact CG2-CZ 3.8Å; I989-F993 PolarHBondContact O-N 3.38Å; M990-F993 PolarHBondContact O-N 3.46Å; F993-L996 PolarHBondContact O-N 2.96Å; F993-N997 PolarHBondContact O-N 3.12Å; F993-N997 VanDerWaalsContact O-N 3.12Å; F993-N998 HydrophobicContact CB-CB 4.22Å; F993-N998 HydrophobicContact CD1-CB 4.03Å; F993-N998 HydrophobicContact CG-CB 4.36Å; F993-N998 PolarHBondContact O-N 3.29Å; F993-G1001 VanDerWaalsContact CD2-C 3.41Å; F993-G1001 WeakPolarHBondContact CD2-O 3.33Å; F993-L1002 HydrophobicContact CB-CD2 3.87Å; F993-L1002 HydrophobicContact CB-CG 4.05Å; F993-I1005 HydrophobicContact CD2-CD1 3.66Å; F993-I1005 HydrophobicContact CD2-CG1 4.47Å; F993-I1005 HydrophobicContact CE2-CD1 3.62Å; F993-I1005 HydrophobicContact CE2-CG1 4.24Å
994	Q	90.7	Very high	93	Very high	48 Å²	48	16.5 Å²	16.5	22%	0.224	8%	0.082	C	C	.	.	H	α-helix	trans	-64.5	-40.7	174.6	-168.2	-175.9	-21.1	0	0	112.4	M990 C991 I992 N997 L1002 V1035	M990-Q994 PolarHBondContact O-N 3.31Å; M990-Q994 VanDerWaalsContact O-N 3.12Å; C991-Q994 WeakPolarHBondContact O-CB 3.39Å; C991-Q994 PolarHBondContact O-N 3.45Å; I992-Q994 PolarHBondContact O-N 3.07Å; Q994-N997 PolarHBondContact O-N 3.35Å; Q994-L1002 HydrophobicContact CB-CD1 4.39Å; Q994-L1002 HydrophobicContact CB-CD2 4.17Å; Q994-V1035 VanDerWaalsContact OE1-CG2 3.31Å
995	E	89.4	Confident	93.1	Very high	109 Å²	109	15 Å²	15	51%	0.509	7%	0.074	S	C	.	.	H	α-helix	trans	-67.5	-36.3	175.4	-69.4	-179.7	-178.4	0	0	112.5	C991 I992 N997	C991-E995 PolarHBondContact O-N 3.1Å; I992-E995 PolarHBondContact O-N 3.23Å; I992-E995 VanDerWaalsContact O-N 3.14Å; E995-N997 VanDerWaalsContact C-N 3.26Å; E995-N997 PolarHBondContact O-N 3.44Å
996	L	90.4	Very high	93.2	Very high	34 Å²	34	17.2 Å²	17.2	18%	0.178	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-0.9	177.7	-66.8	177	0	0	0	113.5	R917 T920 I992 F993 N998 Y1127 L1129	R917-L996 HydrophobicContact CG-CD1 4.33Å; T920-L996 HydrophobicContact CG2-CB 4.36Å; T920-L996 HydrophobicContact CG2-CD1 4.34Å; I992-L996 HydrophobicContact CG2-CD1 4Å; I992-L996 HydrophobicContact CG2-CG 4.3Å; I992-L996 WeakPolarHBondContact O-CG 3.48Å; I992-L996 PolarHBondContact O-N 2.74Å; F993-L996 PolarHBondContact O-N 2.96Å; L996-N998 PolarHBondContact O-N 3.22Å; L996-Y1127 HydrophobicContact CB-CE1 4.41Å; L996-Y1127 VanDerWaalsContact O-CE1 3.3Å; L996-Y1127 WeakPolarHBondContact O-CE1 3.29Å; L996-Y1127 PolarHBondContact O-OH 3.3Å; L996-L1129 HydrophobicContact CD1-CD1 4.46Å; L996-L1129 HydrophobicContact CD2-CD1 4.25Å
997	N	92.6	Very high	93.1	Very high	11 Å²	11	18.7 Å²	18.7	6%	0.059	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	35	-172.2	-53.5	-53.1	0	0	0	113.4	F993 Q994 E995 F999 I1054 C1058 V1059	F993-N997 PolarHBondContact O-N 3.12Å; F993-N997 VanDerWaalsContact O-N 3.12Å; Q994-N997 PolarHBondContact O-N 3.35Å; E995-N997 VanDerWaalsContact C-N 3.26Å; E995-N997 PolarHBondContact O-N 3.44Å; N997-F999 HydrophobicContact CB-CE2 4.3Å; N997-F999 WeakPolarHBondContact O-CD2 3.43Å; N997-F999 PolarHBondContact O-N 2.66Å; N997-I1054 HydrophobicContact CB-CD1 4.37Å; N997-I1054 HydrophobicContact CB-CG2 4.29Å; N997-I1054 WeakPolarHBondContact ND2-CG2 3.45Å; N997-I1054 WeakPolarHBondContact OD1-CD1 3.33Å; N997-C1058 HydrophobicContact CB-CB 3.67Å; N997-C1058 WeakPolarHBondContact O-CA 3.47Å; N997-C1058 WeakPolarHBondContact O-CB 3.33Å; N997-V1059 PolarHBondContact O-N 3.14Å
998	N	94.5	Very high	93.1	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.098	C	C	.	.	B	Isolated β-bridge	trans	-88.8	89.2	173.6	-176.5	-1.8	0	0	0	110.4	T920 E923 F993 L996 T1000 G1001 L1002 V1059	T920-N998 HydrophobicContact CG2-CB 4.13Å; T920-N998 PolarHBondContact OG1-ND2 2.85Å; E923-N998 VanDerWaalsContact OE2-CG 3.3Å; E923-N998 PolarHBondContact OE2-ND2 3.03Å; E923-N998 PolarHBondContact OE2-OD1 3.35Å; F993-N998 HydrophobicContact CB-CB 4.22Å; F993-N998 HydrophobicContact CD1-CB 4.03Å; F993-N998 HydrophobicContact CG-CB 4.36Å; F993-N998 PolarHBondContact O-N 3.29Å; L996-N998 PolarHBondContact O-N 3.22Å; N998-T1000 VanDerWaalsContact C-N 3.35Å; N998-T1000 PolarHBondContact OD1-N 3.44Å; N998-G1001 PolarHBondContact OD1-N 2.86Å; N998-L1002 VanDerWaalsContact O-CG 3.32Å; N998-L1002 WeakPolarHBondContact O-CG 3.43Å; N998-L1002 PolarHBondContact O-N 3.28Å; N998-V1059 HydrophobicContact CB-CB 4.48Å; N998-V1059 WeakPolarHBondContact OD1-CB 3.48Å
999	F	93.4	Very high	93.2	Very high	11 Å²	11	17.4 Å²	17.4	5%	0.048	9%	0.092	C	C	.	.	H	α-helix	trans	-72.3	-27.9	179.8	-63.9	-83	0	0	0	113.2	N997 L1002 I1003 I1047 R1050 L1051 I1054 V1059	N997-F999 HydrophobicContact CB-CE2 4.3Å; N997-F999 WeakPolarHBondContact O-CD2 3.43Å; N997-F999 PolarHBondContact O-N 2.66Å; F999-L1002 HydrophobicContact CD1-CD1 4.35Å; F999-L1002 PolarHBondContact O-N 3.09Å; F999-I1003 PolarHBondContact O-N 3.47Å; F999-I1003 VanDerWaalsContact O-N 3.11Å; F999-I1047 HydrophobicContact CD1-CG2 4.06Å; F999-I1047 HydrophobicContact CE1-CG2 4.42Å; F999-I1047 HydrophobicContact CG-CG2 4.4Å; F999-R1050 HydrophobicContact CE1-CB 4.46Å; F999-R1050 HydrophobicContact CE1-CG 4.14Å; F999-R1050 HydrophobicContact CZ-CB 4.33Å; F999-R1050 HydrophobicContact CZ-CG 3.87Å; F999-L1051 HydrophobicContact CD2-CD2 3.74Å; F999-L1051 HydrophobicContact CD2-CG 4.47Å; F999-L1051 HydrophobicContact CE2-CD2 3.49Å; F999-L1051 VanDerWaalsContact CE2-CD2 3.49Å; F999-L1051 HydrophobicContact CE2-CG 4.16Å; F999-L1051 HydrophobicContact CZ-CD2 4.3Å; F999-I1054 HydrophobicContact CE2-CD1 3.81Å; F999-I1054 HydrophobicContact CZ-CD1 3.47Å; F999-I1054 VanDerWaalsContact CZ-CD1 3.47Å; F999-V1059 WeakPolarHBondContact CA-O 3.44Å; F999-V1059 WeakPolarHBondContact CB-O 3.44Å; F999-V1059 PolarHBondContact N-O 3.44Å
1000	T	94	Very high	93.1	Very high	7 Å²	7	19.9 Å²	19.9	4%	0.043	10%	0.104	C	C	.	.	H	α-helix	trans	-63.2	-54.2	174.4	-64.2	0	0	0	0	110.2	E923 N998 L1002 I1003 E1004 V1059 P1060	E923-T1000 HydrophobicContact CG-CG2 4.47Å; N998-T1000 VanDerWaalsContact C-N 3.35Å; N998-T1000 PolarHBondContact OD1-N 3.44Å; T1000-L1002 VanDerWaalsContact C-N 3.28Å; T1000-L1002 PolarHBondContact O-N 3.5Å; T1000-I1003 PolarHBondContact O-N 2.96Å; T1000-I1003 VanDerWaalsContact O-N 3.1Å; T1000-E1004 WeakPolarHBondContact CG2-OE1 3.47Å; T1000-E1004 WeakPolarHBondContact O-CG 3.47Å; T1000-E1004 PolarHBondContact O-N 3.37Å; T1000-V1059 PolarHBondContact N-O 3Å; T1000-P1060 PolarHBondContact OG1-O 3.19Å
1001	G	94.3	Very high	93.1	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-60.4	-32.6	176	0	0	0	0	0	114.1	E923 F993 N998 I1005	E923-G1001 PolarHBondContact OE2-N 2.99Å; F993-G1001 VanDerWaalsContact CD2-C 3.41Å; F993-G1001 WeakPolarHBondContact CD2-O 3.33Å; N998-G1001 PolarHBondContact OD1-N 2.86Å; G1001-I1005 PolarHBondContact O-N 3.2Å; G1001-I1005 VanDerWaalsContact O-N 3.12Å
1002	L	94	Very high	93.1	Very high	8 Å²	8	23.9 Å²	23.9	4%	0.042	13%	0.132	C	C	.	.	H	α-helix	trans	-64.3	-43.5	173.2	-74.1	178.8	0	0	0	112.5	M990 F993 Q994 N998 F999 T1000 Y1006 V1035 L1039	M990-L1002 HydrophobicContact CG-CD2 3.75Å; M990-L1002 VanDerWaalsContact O-CD2 3.32Å; M990-L1002 WeakPolarHBondContact O-CD2 3.41Å; F993-L1002 HydrophobicContact CB-CD2 3.87Å; F993-L1002 HydrophobicContact CB-CG 4.05Å; Q994-L1002 HydrophobicContact CB-CD1 4.39Å; Q994-L1002 HydrophobicContact CB-CD2 4.17Å; N998-L1002 VanDerWaalsContact O-CG 3.32Å; N998-L1002 WeakPolarHBondContact O-CG 3.43Å; N998-L1002 PolarHBondContact O-N 3.28Å; F999-L1002 HydrophobicContact CD1-CD1 4.35Å; F999-L1002 PolarHBondContact O-N 3.09Å; T1000-L1002 VanDerWaalsContact C-N 3.28Å; T1000-L1002 PolarHBondContact O-N 3.5Å; L1002-Y1006 VanDerWaalsContact O-CB 3.32Å; L1002-Y1006 WeakPolarHBondContact O-CB 3.05Å; L1002-Y1006 PolarHBondContact O-N 2.68Å; L1002-V1035 HydrophobicContact CD2-CG1 4.29Å; L1002-L1039 HydrophobicContact CB-CD1 4.16Å; L1002-L1039 WeakPolarHBondContact O-CD1 3.45Å
1003	I	92.5	Very high	93.2	Very high	33 Å²	33	23.7 Å²	23.7	17%	0.169	13%	0.131	C	C	.	.	H	α-helix	trans	-70.1	-36.1	178.2	-74.1	172.5	0	0	0	111.5	F999 T1000 Y1006 G1007 L1039 I1047 F1061	F999-I1003 PolarHBondContact O-N 3.47Å; F999-I1003 VanDerWaalsContact O-N 3.11Å; T1000-I1003 PolarHBondContact O-N 2.96Å; T1000-I1003 VanDerWaalsContact O-N 3.1Å; I1003-Y1006 PolarHBondContact O-N 3Å; I1003-G1007 PolarHBondContact O-N 3.26Å; I1003-L1039 HydrophobicContact CD1-CD2 4.43Å; I1003-L1039 HydrophobicContact CG1-CD1 4.26Å; I1003-L1039 HydrophobicContact CG1-CD2 3.81Å; I1003-I1047 HydrophobicContact CD1-CD1 4.11Å; I1003-F1061 HydrophobicContact CB-CD2 4.37Å; I1003-F1061 HydrophobicContact CD1-CB 3.49Å; I1003-F1061 VanDerWaalsContact CD1-CB 3.49Å; I1003-F1061 HydrophobicContact CD1-CD1 3.46Å; I1003-F1061 VanDerWaalsContact CD1-CD1 3.46Å; I1003-F1061 HydrophobicContact CD1-CD2 3.55Å; I1003-F1061 HydrophobicContact CD1-CE1 4.01Å; I1003-F1061 HydrophobicContact CD1-CE2 4.09Å; I1003-F1061 HydrophobicContact CD1-CG 3.19Å; I1003-F1061 HydrophobicContact CD1-CZ 4.3Å; I1003-F1061 HydrophobicContact CG2-CD2 4.24Å; I1003-F1061 HydrophobicContact CG2-CE2 3.92Å; I1003-F1061 HydrophobicContact CG2-CZ 4.25Å
1004	E	95	Very high	93.2	Very high	5 Å²	5	23.7 Å²	23.7	2%	0.023	13%	0.131	C	C	.	.	H	α-helix	trans	-59.8	-51.7	174.5	-71.2	168.8	177.6	0	0	111.3	E923 S959 F962 T1000 Y1006 G1007 V1008	E923-E1004 VanDerWaalsContact OE1-OE2 3.08Å; S959-E1004 WeakPolarHBondContact CA-OE1 3.46Å; S959-E1004 WeakPolarHBondContact CB-OE1 3.39Å; S959-E1004 VanDerWaalsContact OG-CD 3.31Å; S959-E1004 VanDerWaalsContact OG-CG 3.24Å; S959-E1004 WeakPolarHBondContact OG-CG 3.41Å; S959-E1004 PolarHBondContact OG-OE1 3.04Å; F962-E1004 HydrophobicContact CD1-CB 4.38Å; F962-E1004 WeakPolarHBondContact CD1-OE2 3.09Å; T1000-E1004 WeakPolarHBondContact CG2-OE1 3.47Å; T1000-E1004 WeakPolarHBondContact O-CG 3.47Å; T1000-E1004 PolarHBondContact O-N 3.37Å; E1004-Y1006 VanDerWaalsContact C-N 3.34Å; E1004-Y1006 PolarHBondContact O-N 2.76Å; E1004-G1007 PolarHBondContact O-N 3.48Å; E1004-V1008 WeakPolarHBondContact O-CG2 3.43Å; E1004-V1008 PolarHBondContact O-N 3.14Å
1005	I	95.3	Very high	93.4	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64	-40.4	178	-68.4	177.5	0	0	0	111.5	L966 I986 I989 M990 F993 G1001 G1007 V1008 L1009	L966-I1005 HydrophobicContact CD1-CG1 4.02Å; I986-I1005 HydrophobicContact CG2-CB 4.45Å; I986-I1005 HydrophobicContact CG2-CD1 4.35Å; I986-I1005 HydrophobicContact CG2-CG1 4.23Å; I986-I1005 HydrophobicContact CG2-CG2 3.53Å; I989-I1005 HydrophobicContact CB-CD1 4.18Å; I989-I1005 HydrophobicContact CG2-CD1 3.86Å; M990-I1005 HydrophobicContact CB-CD1 3.85Å; M990-I1005 HydrophobicContact CB-CG2 4.06Å; M990-I1005 HydrophobicContact CG-CB 4.47Å; M990-I1005 HydrophobicContact CG-CD1 4.47Å; M990-I1005 HydrophobicContact CG-CG2 4.07Å; M990-I1005 HydrophobicContact SD-CG2 3.77Å; F993-I1005 HydrophobicContact CD2-CD1 3.66Å; F993-I1005 HydrophobicContact CD2-CG1 4.47Å; F993-I1005 HydrophobicContact CE2-CD1 3.62Å; F993-I1005 HydrophobicContact CE2-CG1 4.24Å; G1001-I1005 PolarHBondContact O-N 3.2Å; G1001-I1005 VanDerWaalsContact O-N 3.12Å; I1005-G1007 VanDerWaalsContact C-N 3.32Å; I1005-G1007 PolarHBondContact O-N 3.46Å; I1005-V1008 WeakPolarHBondContact O-CB 2.98Å; I1005-V1008 PolarHBondContact O-N 2.94Å; I1005-L1009 HydrophobicContact CG2-CD1 3.85Å; I1005-L1009 HydrophobicContact CG2-CG 4.29Å; I1005-L1009 WeakPolarHBondContact O-CG 3.4Å; I1005-L1009 PolarHBondContact O-N 3.42Å
1006	Y	93.4	Very high	93.5	Very high	48 Å²	48	23.7 Å²	23.7	19%	0.188	13%	0.129	C	C	.	.	H	α-helix	trans	-59.4	-44	174.5	175	-108.5	0	0	0	111.7	L1002 I1003 E1004 V1008 L1009 E1010 F1032 K1036 L1039	L1002-Y1006 VanDerWaalsContact O-CB 3.32Å; L1002-Y1006 WeakPolarHBondContact O-CB 3.05Å; L1002-Y1006 PolarHBondContact O-N 2.68Å; I1003-Y1006 PolarHBondContact O-N 3Å; E1004-Y1006 VanDerWaalsContact C-N 3.34Å; E1004-Y1006 PolarHBondContact O-N 2.76Å; Y1006-V1008 VanDerWaalsContact C-N 3.34Å; Y1006-V1008 PolarHBondContact O-N 3Å; Y1006-L1009 PolarHBondContact O-N 3.02Å; Y1006-E1010 HydrophobicContact CD2-CG 4.04Å; Y1006-E1010 HydrophobicContact CE1-CG 4.47Å; Y1006-E1010 HydrophobicContact CE2-CG 3.53Å; Y1006-E1010 WeakPolarHBondContact O-CB 3.17Å; Y1006-E1010 PolarHBondContact O-N 2.89Å; Y1006-F1032 HydrophobicContact CD2-CE2 4.1Å; Y1006-F1032 HydrophobicContact CD2-CZ 4.47Å; Y1006-K1036 HydrophobicContact CE2-CB 4.17Å; Y1006-K1036 HydrophobicContact CE2-CD 4.21Å; Y1006-K1036 HydrophobicContact CE2-CG 3.81Å; Y1006-L1039 HydrophobicContact CD1-CB 4.24Å; Y1006-L1039 HydrophobicContact CD1-CD1 4.42Å; Y1006-L1039 HydrophobicContact CE1-CB 4.5Å; Y1006-L1039 HydrophobicContact CG-CB 4.32Å; Y1006-L1039 HydrophobicContact CG-CD1 3.94Å
1007	G	92.2	Very high	93.6	Very high	32 Å²	32	22.1 Å²	22.1	33%	0.33	12%	0.12	S	C	.	.	H	α-helix	trans	-62	-36.4	175.5	0	0	0	0	0	113.5	I1003 E1004 I1005 S1011	I1003-G1007 PolarHBondContact O-N 3.26Å; E1004-G1007 PolarHBondContact O-N 3.48Å; I1005-G1007 VanDerWaalsContact C-N 3.32Å; I1005-G1007 PolarHBondContact O-N 3.46Å; G1007-S1011 WeakPolarHBondContact O-CB 3.24Å; G1007-S1011 PolarHBondContact O-N 3.49Å; G1007-S1011 VanDerWaalsContact O-N 3.12Å
1008	V	95	Very high	93.5	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.3	-51.1	172.3	172.9	0	0	0	0	110.7	T963 L966 E967 E1004 I1005 Y1006 E1010 S1011 I1014	T963-V1008 HydrophobicContact CG2-CG2 3.67Å; T963-V1008 WeakPolarHBondContact O-CG2 3.32Å; L966-V1008 HydrophobicContact CB-CG1 4.04Å; L966-V1008 HydrophobicContact CB-CG2 3.74Å; L966-V1008 HydrophobicContact CD1-CG2 4.09Å; E967-V1008 HydrophobicContact CG-CB 4.25Å; E967-V1008 HydrophobicContact CG-CG1 3.89Å; E967-V1008 HydrophobicContact CG-CG2 4.15Å; E1004-V1008 WeakPolarHBondContact O-CG2 3.43Å; E1004-V1008 PolarHBondContact O-N 3.14Å; I1005-V1008 WeakPolarHBondContact O-CB 2.98Å; I1005-V1008 PolarHBondContact O-N 2.94Å; Y1006-V1008 VanDerWaalsContact C-N 3.34Å; Y1006-V1008 PolarHBondContact O-N 3Å; V1008-E1010 PolarHBondContact O-N 2.69Å; V1008-S1011 WeakPolarHBondContact O-CB 3.22Å; V1008-S1011 PolarHBondContact O-N 3.14Å; V1008-S1011 PolarHBondContact O-OG 3.23Å; V1008-I1014 HydrophobicContact CG1-CD1 3.49Å; V1008-I1014 VanDerWaalsContact CG1-CD1 3.49Å; V1008-I1014 WeakPolarHBondContact O-CB 3.34Å; V1008-I1014 WeakPolarHBondContact O-CD1 3.27Å
1009	L	94	Very high	93.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-69.4	-32.7	-173.6	-68.5	174.3	0	0	0	112.8	M983 L987 M990 I1005 Y1006 I1014 W1021 F1032	M983-L1009 HydrophobicContact CE-CD2 3.68Å; L987-L1009 HydrophobicContact CD2-CD1 3.64Å; M990-L1009 HydrophobicContact SD-CD1 4.48Å; I1005-L1009 HydrophobicContact CG2-CD1 3.85Å; I1005-L1009 HydrophobicContact CG2-CG 4.29Å; I1005-L1009 WeakPolarHBondContact O-CG 3.4Å; I1005-L1009 PolarHBondContact O-N 3.42Å; Y1006-L1009 PolarHBondContact O-N 3.02Å; L1009-I1014 HydrophobicContact CD2-CG2 4.45Å; L1009-W1021 HydrophobicContact CB-CH2 4.02Å; L1009-W1021 HydrophobicContact CB-CZ2 4.22Å; L1009-W1021 HydrophobicContact CD2-CH2 4.05Å; L1009-W1021 HydrophobicContact CD2-CZ2 4.25Å; L1009-W1021 HydrophobicContact CG-CH2 4.42Å; L1009-F1032 HydrophobicContact CB-CE2 3.89Å; L1009-F1032 HydrophobicContact CB-CZ 4.01Å; L1009-F1032 HydrophobicContact CD1-CD2 3.5Å; L1009-F1032 VanDerWaalsContact CD1-CD2 3.5Å; L1009-F1032 HydrophobicContact CD1-CE2 3.36Å; L1009-F1032 HydrophobicContact CD1-CG 4.35Å; L1009-F1032 HydrophobicContact CD1-CZ 4.11Å; L1009-F1032 HydrophobicContact CG-CE2 4.27Å
1010	E	92.2	Very high	93.2	Very high	53 Å²	53	30.1 Å²	30.1	25%	0.248	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	3.2	174.7	-66.9	-66.3	166.7	0	0	113.4	Y1006 V1008 H1015 K1036	Y1006-E1010 HydrophobicContact CD2-CG 4.04Å; Y1006-E1010 HydrophobicContact CE1-CG 4.47Å; Y1006-E1010 HydrophobicContact CE2-CG 3.53Å; Y1006-E1010 WeakPolarHBondContact O-CB 3.17Å; Y1006-E1010 PolarHBondContact O-N 2.89Å; V1008-E1010 PolarHBondContact O-N 2.69Å; E1010-H1015 IonicContact OE2-CE1 3.22Å; E1010-H1015 PolarHBondContact OE2-CE1 3.22Å; E1010-H1015 IonicContact OE2-CG 2.86Å; E1010-H1015 IonicContact OE2-ND1 3.11Å; E1010-H1015 PolarHBondContact OE2-ND1 3.27Å; E1010-K1036 VanDerWaalsContact OE1-CE 3.31Å; E1010-K1036 WeakPolarHBondContact OE1-CE 3.24Å; E1010-K1036 IonicContact OE1-NZ 2.78Å; E1010-K1036 PolarHBondContact OE1-NZ 3.46Å
1011	S	93.5	Very high	93.2	Very high	16 Å²	16	32 Å²	32	11%	0.112	16%	0.158	C	C	.	.	S	Bend	trans	-64.6	146.8	176.6	102.6	0	0	0	0	110.6	E967 G1007 V1008 A1013 I1014 H1015	E967-S1011 WeakPolarHBondContact OE2-CB 3.38Å; E967-S1011 PolarHBondContact OE2-OG 3.12Å; G1007-S1011 WeakPolarHBondContact O-CB 3.24Å; G1007-S1011 PolarHBondContact O-N 3.49Å; G1007-S1011 VanDerWaalsContact O-N 3.12Å; V1008-S1011 WeakPolarHBondContact O-CB 3.22Å; V1008-S1011 PolarHBondContact O-N 3.14Å; V1008-S1011 PolarHBondContact O-OG 3.23Å; S1011-A1013 PolarHBondContact O-N 3.24Å; S1011-A1013 VanDerWaalsContact O-N 3.08Å; S1011-I1014 PolarHBondContact O-N 2.93Å; S1011-H1015 VanDerWaalsContact O-CB 3.29Å; S1011-H1015 WeakPolarHBondContact O-CB 3.39Å; S1011-H1015 PolarHBondContact O-N 2.95Å
1012	S	93.4	Very high	93.1	Very high	81 Å²	81	37.8 Å²	37.8	57%	0.566	19%	0.185	S	C	*	.	H	α-helix	trans	-59.3	-26.4	-177.2	62.2	0	0	0	0	113.3	R1016	S1012-R1016 VanDerWaalsContact O-CD 3.3Å; S1012-R1016 WeakPolarHBondContact O-CD 3.11Å; S1012-R1016 VanDerWaalsContact O-CG 3.29Å; S1012-R1016 WeakPolarHBondContact O-CG 3.33Å
1013	A	93.5	Very high	93	Very high	2 Å²	2	43 Å²	43	2%	0.017	20%	0.204	C	C	.	.	H	α-helix	trans	-76.8	-27.9	177.4	0	0	0	0	0	112.8	V971 S1011 L1158 S1162	V971-A1013 HydrophobicContact CG1-CB 4.17Å; S1011-A1013 PolarHBondContact O-N 3.24Å; S1011-A1013 VanDerWaalsContact O-N 3.08Å; A1013-L1158 HydrophobicContact CB-CB 4.21Å; A1013-S1162 WeakPolarHBondContact O-CB 3.34Å; A1013-S1162 PolarHBondContact O-OG 3.15Å
1014	I	94.9	Very high	92.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-104.6	-41.6	-175.6	-66.2	178.7	0	0	0	112.3	E967 V970 V971 M983 V1008 L1009 S1011 R1016 L1017 W1021	E967-I1014 HydrophobicContact CB-CD1 4.28Å; E967-I1014 HydrophobicContact CG-CD1 4.01Å; V970-I1014 HydrophobicContact CB-CD1 3.8Å; V970-I1014 HydrophobicContact CB-CG1 4.27Å; V970-I1014 HydrophobicContact CG1-CD1 4.01Å; V970-I1014 HydrophobicContact CG1-CG1 4.01Å; V970-I1014 HydrophobicContact CG2-CD1 3.91Å; V971-I1014 HydrophobicContact CG1-CG1 4.43Å; M983-I1014 HydrophobicContact CE-CG2 3.87Å; M983-I1014 HydrophobicContact SD-CG2 4.42Å; V1008-I1014 HydrophobicContact CG1-CD1 3.49Å; V1008-I1014 VanDerWaalsContact CG1-CD1 3.49Å; V1008-I1014 WeakPolarHBondContact O-CB 3.34Å; V1008-I1014 WeakPolarHBondContact O-CD1 3.27Å; L1009-I1014 HydrophobicContact CD2-CG2 4.45Å; S1011-I1014 PolarHBondContact O-N 2.93Å; I1014-R1016 PolarHBondContact O-N 3.37Å; I1014-R1016 VanDerWaalsContact O-N 3.08Å; I1014-L1017 WeakPolarHBondContact O-CB 3.37Å; I1014-L1017 PolarHBondContact O-N 2.83Å; I1014-W1021 HydrophobicContact CG2-CZ2 4.42Å; I1014-W1021 PolarHBondContact O-NE1 3.46Å; I1014-W1021 VanDerWaalsContact O-NE1 3.11Å
1015	H	93.2	Very high	92.8	Very high	104 Å²	104	45 Å²	45	48%	0.481	22%	0.216	S	C	.	.	H	α-helix	trans	-53.7	-34.9	-179.6	-176.2	95.3	0	0	0	112	E1010 S1011 L1017	E1010-H1015 IonicContact OE2-CE1 3.22Å; E1010-H1015 PolarHBondContact OE2-CE1 3.22Å; E1010-H1015 IonicContact OE2-CG 2.86Å; E1010-H1015 IonicContact OE2-ND1 3.11Å; E1010-H1015 PolarHBondContact OE2-ND1 3.27Å; S1011-H1015 VanDerWaalsContact O-CB 3.29Å; S1011-H1015 WeakPolarHBondContact O-CB 3.39Å; S1011-H1015 PolarHBondContact O-N 2.95Å; H1015-L1017 VanDerWaalsContact C-N 3.33Å; H1015-L1017 PolarHBondContact O-N 3.02Å
1016	R	93.3	Very high	92.6	Very high	53 Å²	53	50.2 Å²	50.2	20%	0.2	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-10	-179.5	68.2	177.7	-64.2	-68.2	-10.6	116	S1012 I1014 Y1018 S1162 M1163 E1166	S1012-R1016 VanDerWaalsContact O-CD 3.3Å; S1012-R1016 WeakPolarHBondContact O-CD 3.11Å; S1012-R1016 VanDerWaalsContact O-CG 3.29Å; S1012-R1016 WeakPolarHBondContact O-CG 3.33Å; I1014-R1016 PolarHBondContact O-N 3.37Å; I1014-R1016 VanDerWaalsContact O-N 3.08Å; R1016-Y1018 PolarHBondContact O-N 3.09Å; R1016-S1162 VanDerWaalsContact CD-OG 3.29Å; R1016-S1162 WeakPolarHBondContact CD-OG 3.41Å; R1016-S1162 WeakPolarHBondContact CG-OG 3.28Å; R1016-S1162 PolarHBondContact NH1-O 3.1Å; R1016-S1162 PolarHBondContact NH1-OG 3.49Å; R1016-M1163 PolarHBondContact NH2-SD 3.04Å; R1016-E1166 VanDerWaalsContact CZ-O 3.26Å; R1016-E1166 PolarHBondContact NH1-O 3.22Å; R1016-E1166 PolarHBondContact NH2-O 3.14Å
1017	L	92	Very high	92.4	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.263	C	S	.	.			trans	-78.8	61.4	-173.9	-61.3	177.5	0	0	0	112.3	V970 I1014 H1015 H1019 T1020 W1021 S1162 I1165 E1166	V970-L1017 HydrophobicContact CG1-CD1 4Å; I1014-L1017 WeakPolarHBondContact O-CB 3.37Å; I1014-L1017 PolarHBondContact O-N 2.83Å; H1015-L1017 VanDerWaalsContact C-N 3.33Å; H1015-L1017 PolarHBondContact O-N 3.02Å; L1017-H1019 VanDerWaalsContact C-N 3.28Å; L1017-H1019 PolarHBondContact O-N 2.9Å; L1017-T1020 WeakPolarHBondContact O-CB 3.43Å; L1017-T1020 PolarHBondContact O-N 2.88Å; L1017-W1021 PolarHBondContact O-N 3.33Å; L1017-W1021 VanDerWaalsContact O-N 3.1Å; L1017-S1162 WeakPolarHBondContact CD2-OG 3.43Å; L1017-I1165 HydrophobicContact CD1-CD1 4.15Å; L1017-I1165 HydrophobicContact CD2-CD1 3.89Å; L1017-I1165 HydrophobicContact CD2-CG1 3.89Å; L1017-E1166 VanDerWaalsContact CA-OE2 3.24Å; L1017-E1166 WeakPolarHBondContact CA-OE2 3.36Å; L1017-E1166 HydrophobicContact CD2-CB 3.85Å; L1017-E1166 HydrophobicContact CD2-CG 3.93Å
1018	Y	90.4	Very high	92.4	Very high	161 Å²	161	54.8 Å²	54.8	63%	0.631	25%	0.252	S	S	*	.	H	α-helix	trans	-51.6	-43	-171.7	-176.2	-90.2	0	0	0	113.3	R1016 T1020 W1021 E1022 E1166	R1016-Y1018 PolarHBondContact O-N 3.09Å; Y1018-T1020 PolarHBondContact O-N 3.38Å; Y1018-W1021 PolarHBondContact O-N 3.39Å; Y1018-E1022 PolarHBondContact O-N 2.96Å; Y1018-E1022 VanDerWaalsContact O-N 3.13Å; Y1018-E1166 PolarHBondContact N-OE2 3.14Å
1019	H	89.8	Confident	92.1	Very high	30 Å²	30	56 Å²	56	14%	0.139	26%	0.259	C	S	.	.	H	α-helix	trans	-67.7	-27.9	-178.2	-64.3	-72.8	0	0	0	112.3	I976 L1017 E1166 C1170 D1171 P1173	I976-H1019 HydrophobicContact CD1-CB 3.82Å; L1017-H1019 VanDerWaalsContact C-N 3.28Å; L1017-H1019 PolarHBondContact O-N 2.9Å; H1019-E1166 IonicContact CD2-OE2 2.64Å; H1019-E1166 IonicContact CG-OE2 3.47Å; H1019-E1166 PolarHBondContact N-OE2 3.32Å; H1019-C1170 PolarHBondContact NE2-O 3.43Å; H1019-D1171 PolarHBondContact CE1-O 3.23Å; H1019-D1171 VanDerWaalsContact CE1-O 3.29Å; H1019-P1173 HydrophobicContact CB-CG 4.15Å
1020	T	91.8	Very high	91.9	Very high	0 Å²	0	64 Å²	64	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-76	-46.2	175.7	-55.2	0	0	0	0	110.8	R979 V980 M983 L1017 Y1018 E1022 R1023 E1166	R979-T1020 HydrophobicContact CB-CG2 4.47Å; R979-T1020 HydrophobicContact CG-CG2 3.95Å; R979-T1020 PolarHBondContact NE-OG1 3.02Å; R979-T1020 PolarHBondContact NH2-OG1 3.42Å; V980-T1020 HydrophobicContact CG2-CG2 3.87Å; M983-T1020 HydrophobicContact CG-CG2 4.39Å; M983-T1020 HydrophobicContact SD-CG2 3.34Å; M983-T1020 WeakPolarHBondContact SD-CG2 3.47Å; L1017-T1020 WeakPolarHBondContact O-CB 3.43Å; L1017-T1020 PolarHBondContact O-N 2.88Å; Y1018-T1020 PolarHBondContact O-N 3.38Å; T1020-E1022 VanDerWaalsContact C-N 3.31Å; T1020-E1022 PolarHBondContact O-N 2.99Å; T1020-R1023 PolarHBondContact O-N 3.24Å; T1020-R1023 VanDerWaalsContact O-N 3.12Å; T1020-E1166 PolarHBondContact N-OE1 2.93Å; T1020-E1166 PolarHBondContact OG1-OE1 2.94Å
1021	W	93	Very high	91.6	Very high	45 Å²	45	63.2 Å²	63.2	17%	0.17	29%	0.288	C	S	.	.	H	α-helix	trans	-57.2	-41.2	178.5	-78.7	103.4	0	0	0	112.8	M983 L1009 I1014 L1017 Y1018 R1023 L1024 L1029 F1032	M983-W1021 HydrophobicContact CE-CD2 4.06Å; M983-W1021 HydrophobicContact CE-CE3 4.41Å; M983-W1021 HydrophobicContact CE-CH2 4.13Å; M983-W1021 HydrophobicContact CE-CZ2 3.74Å; M983-W1021 HydrophobicContact CE-CZ3 4.44Å; L1009-W1021 HydrophobicContact CB-CH2 4.02Å; L1009-W1021 HydrophobicContact CB-CZ2 4.22Å; L1009-W1021 HydrophobicContact CD2-CH2 4.05Å; L1009-W1021 HydrophobicContact CD2-CZ2 4.25Å; L1009-W1021 HydrophobicContact CG-CH2 4.42Å; I1014-W1021 HydrophobicContact CG2-CZ2 4.42Å; I1014-W1021 PolarHBondContact O-NE1 3.46Å; I1014-W1021 VanDerWaalsContact O-NE1 3.11Å; L1017-W1021 PolarHBondContact O-N 3.33Å; L1017-W1021 VanDerWaalsContact O-N 3.1Å; Y1018-W1021 PolarHBondContact O-N 3.39Å; W1021-R1023 PolarHBondContact O-N 3.12Å; W1021-R1023 VanDerWaalsContact O-N 3.14Å; W1021-L1024 HydrophobicContact CD2-CD1 4.18Å; W1021-L1024 HydrophobicContact CE3-CD1 3.63Å; W1021-L1024 HydrophobicContact CZ3-CD1 4.07Å; W1021-L1024 PolarHBondContact O-N 2.59Å; W1021-L1029 HydrophobicContact CE3-CD2 3.83Å; W1021-L1029 HydrophobicContact CZ3-CD2 3.75Å; W1021-F1032 HydrophobicContact CH2-CD1 4.38Å; W1021-F1032 AromaticContact CH2-CE1 3.8Å; W1021-F1032 HydrophobicContact CH2-CE1 3.8Å; W1021-F1032 HydrophobicContact CH2-CZ 4.06Å; W1021-F1032 HydrophobicContact CZ3-CD1 4.16Å; W1021-F1032 AromaticContact CZ3-CE1 3.95Å; W1021-F1032 HydrophobicContact CZ3-CE1 3.95Å
1022	E	91.6	Very high	91.5	Very high	122 Å²	122	62.6 Å²	62.6	57%	0.57	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-24.6	179.4	-167.3	-179.4	-169.6	0	0	113.3	Y1018 T1020	Y1018-E1022 PolarHBondContact O-N 2.96Å; Y1018-E1022 VanDerWaalsContact O-N 3.13Å; T1020-E1022 VanDerWaalsContact C-N 3.31Å; T1020-E1022 PolarHBondContact O-N 2.99Å
1023	R	92.1	Very high	91.3	Very high	117 Å²	117	63 Å²	63	44%	0.442	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	2.1	-173.4	-63.7	-178.7	-171.3	-165.9	4.6	114.6	I976 V980 T1020 W1021	I976-R1023 VanDerWaalsContact CD1-CZ 3.47Å; V980-R1023 HydrophobicContact CG1-CB 4.26Å; V980-R1023 WeakPolarHBondContact CG1-O 3.45Å; V980-R1023 HydrophobicContact CG2-CB 3.62Å; T1020-R1023 PolarHBondContact O-N 3.24Å; T1020-R1023 VanDerWaalsContact O-N 3.12Å; W1021-R1023 PolarHBondContact O-N 3.12Å; W1021-R1023 VanDerWaalsContact O-N 3.14Å
1024	L	92.3	Very high	91	Very high	7 Å²	7	66.6 Å²	66.6	4%	0.037	29%	0.292	C	S	.	.	S	Bend	trans	-72.4	159.9	179.1	-62	174.9	0	0	0	112	V980 M983 L987 W1021 Q1026 L1029	V980-L1024 HydrophobicContact CG1-CD2 4.25Å; M983-L1024 HydrophobicContact CB-CD1 4.39Å; M983-L1024 HydrophobicContact CB-CD2 3.47Å; M983-L1024 VanDerWaalsContact CB-CD2 3.47Å; M983-L1024 HydrophobicContact CE-CD1 3.79Å; M983-L1024 HydrophobicContact SD-CD1 4.43Å; M983-L1024 HydrophobicContact SD-CD2 4.49Å; L987-L1024 HydrophobicContact CD1-CD1 4.3Å; W1021-L1024 HydrophobicContact CD2-CD1 4.18Å; W1021-L1024 HydrophobicContact CE3-CD1 3.63Å; W1021-L1024 HydrophobicContact CZ3-CD1 4.07Å; W1021-L1024 PolarHBondContact O-N 2.59Å; L1024-Q1026 PolarHBondContact O-N 3.22Å; L1024-L1029 HydrophobicContact CB-CD1 3.98Å; L1024-L1029 HydrophobicContact CB-CD2 4.2Å; L1024-L1029 HydrophobicContact CB-CG 3.98Å; L1024-L1029 HydrophobicContact CD1-CD2 3.91Å
1025	D	91	Very high	90.6	Very high	75 Å²	75	66.8 Å²	66.8	40%	0.401	29%	0.294	S	S	.	.			trans	-65.3	117.8	175.4	-173.2	-20.9	0	0	0	109.8	N984 K1027 L1028 L1029	N984-D1025 PolarHBondContact OD1-N 3.37Å; D1025-K1027 PolarHBondContact O-N 3.42Å; D1025-K1027 VanDerWaalsContact O-N 3.09Å; D1025-K1027 WeakPolarHBondContact OD1-CB 3.38Å; D1025-K1027 PolarHBondContact OD1-N 2.99Å; D1025-L1028 HydrophobicContact CB-CB 4.26Å; D1025-L1028 HydrophobicContact CB-CD1 4Å; D1025-L1028 HydrophobicContact CB-CG 4.07Å; D1025-L1028 PolarHBondContact O-N 3.49Å; D1025-L1029 PolarHBondContact O-N 2.74Å
1026	Q	91.7	Very high	90.3	Very high	109 Å²	109	64.3 Å²	64.3	51%	0.509	28%	0.282	S	S	.	.	H	α-helix	trans	-58.7	-23	-179.7	-64.7	-62.6	-34.9	0	0	113.5	L1024 R1030	L1024-Q1026 PolarHBondContact O-N 3.22Å; Q1026-R1030 WeakPolarHBondContact O-CG 3.38Å; Q1026-R1030 PolarHBondContact O-N 2.83Å
1027	K	90.4	Very high	89.9	Confident	156 Å²	156	68.1 Å²	68.1	68%	0.678	30%	0.301	S	S	*	.	H	α-helix	trans	-73.1	-44.9	173.2	-67.4	179	-178.4	174.5	0	111.6	D1025 L1029 R1030 V1031	D1025-K1027 PolarHBondContact O-N 3.42Å; D1025-K1027 VanDerWaalsContact O-N 3.09Å; D1025-K1027 WeakPolarHBondContact OD1-CB 3.38Å; D1025-K1027 PolarHBondContact OD1-N 2.99Å; K1027-L1029 VanDerWaalsContact C-N 3.33Å; K1027-R1030 PolarHBondContact O-N 3.48Å; K1027-V1031 PolarHBondContact O-N 2.91Å
1028	L	90.2	Very high	89.4	Confident	19 Å²	19	70.1 Å²	70.1	10%	0.099	31%	0.314	C	S	.	.	H	α-helix	trans	-67	-37.5	178.4	-66.3	178.9	0	0	0	110.9	N984 L987 E988 D1025 R1030 V1031 F1032	N984-L1028 HydrophobicContact CB-CD1 4.1Å; L987-L1028 HydrophobicContact CB-CB 3.89Å; L987-L1028 HydrophobicContact CB-CD1 4.07Å; L987-L1028 HydrophobicContact CB-CG 4.39Å; L987-L1028 HydrophobicContact CD1-CB 3.85Å; L987-L1028 HydrophobicContact CG-CB 4.49Å; E988-L1028 HydrophobicContact CG-CD1 4.05Å; E988-L1028 HydrophobicContact CG-CD2 4.28Å; D1025-L1028 HydrophobicContact CB-CB 4.26Å; D1025-L1028 HydrophobicContact CB-CD1 4Å; D1025-L1028 HydrophobicContact CB-CG 4.07Å; D1025-L1028 PolarHBondContact O-N 3.49Å; L1028-R1030 VanDerWaalsContact C-N 3.34Å; L1028-R1030 PolarHBondContact O-N 2.95Å; L1028-V1031 PolarHBondContact O-N 3.22Å; L1028-F1032 PolarHBondContact O-N 3.34Å
1029	L	90.2	Very high	89.1	Confident	25 Å²	25	63 Å²	63	13%	0.131	29%	0.286	C	S	.	.	H	α-helix	trans	-60.9	-37.7	173.8	-75.9	177.7	0	0	0	113.3	L987 W1021 L1024 D1025 K1027 F1032 E1033	L987-L1029 HydrophobicContact CD1-CD2 4.45Å; W1021-L1029 HydrophobicContact CE3-CD2 3.83Å; W1021-L1029 HydrophobicContact CZ3-CD2 3.75Å; L1024-L1029 HydrophobicContact CB-CD1 3.98Å; L1024-L1029 HydrophobicContact CB-CD2 4.2Å; L1024-L1029 HydrophobicContact CB-CG 3.98Å; L1024-L1029 HydrophobicContact CD1-CD2 3.91Å; D1025-L1029 PolarHBondContact O-N 2.74Å; K1027-L1029 VanDerWaalsContact C-N 3.33Å; L1029-F1032 WeakPolarHBondContact O-CB 3.5Å; L1029-F1032 PolarHBondContact O-N 3.44Å; L1029-E1033 WeakPolarHBondContact O-CG 3.33Å; L1029-E1033 PolarHBondContact O-N 2.9Å
1030	R	89.9	Confident	88.5	Confident	170 Å²	170	64.8 Å²	64.8	64%	0.642	30%	0.303	S	S	*	.	H	α-helix	trans	-63.5	-43.1	175.3	-71.4	175	-154.2	-166.9	2.3	112	Q1026 K1027 L1028 F1032 E1033 E1034	Q1026-R1030 WeakPolarHBondContact O-CG 3.38Å; Q1026-R1030 PolarHBondContact O-N 2.83Å; K1027-R1030 PolarHBondContact O-N 3.48Å; L1028-R1030 VanDerWaalsContact C-N 3.34Å; L1028-R1030 PolarHBondContact O-N 2.95Å; R1030-F1032 VanDerWaalsContact C-N 3.31Å; R1030-F1032 PolarHBondContact O-N 3.33Å; R1030-E1033 PolarHBondContact O-N 2.93Å; R1030-E1034 WeakPolarHBondContact O-CG 3.44Å; R1030-E1034 PolarHBondContact O-N 3.16Å
1031	V	85.5	Confident	87.9	Confident	36 Å²	36	66.9 Å²	66.9	22%	0.218	31%	0.314	C	S	.	.	H	α-helix	trans	-62.8	-41.9	176.4	-179.4	0	0	0	0	110.3	K1027 L1028 E1033 E1034 V1035	K1027-V1031 PolarHBondContact O-N 2.91Å; L1028-V1031 PolarHBondContact O-N 3.22Å; V1031-E1033 PolarHBondContact O-N 2.86Å; V1031-E1034 PolarHBondContact O-N 2.67Å; V1031-V1035 HydrophobicContact CG1-CG2 4.4Å; V1031-V1035 WeakPolarHBondContact O-CG2 3.48Å; V1031-V1035 PolarHBondContact O-N 2.88Å
1032	F	91.1	Very high	86.8	Confident	2 Å²	2	68.8 Å²	68.8	1%	0.009	34%	0.339	C	S	.	.	H	α-helix	trans	-58.3	-47.1	173.8	173.5	-110.6	0	0	0	112.4	L987 M990 Y1006 L1009 W1021 L1028 L1029 R1030 E1034 V1035 K1036	L987-F1032 HydrophobicContact CD2-CB 3.8Å; L987-F1032 HydrophobicContact CD2-CD2 4.17Å; L987-F1032 HydrophobicContact CD2-CG 4.15Å; M990-F1032 HydrophobicContact CE-CD2 3.88Å; M990-F1032 HydrophobicContact SD-CD2 3.87Å; Y1006-F1032 HydrophobicContact CD2-CE2 4.1Å; Y1006-F1032 HydrophobicContact CD2-CZ 4.47Å; L1009-F1032 HydrophobicContact CB-CE2 3.89Å; L1009-F1032 HydrophobicContact CB-CZ 4.01Å; L1009-F1032 HydrophobicContact CD1-CD2 3.5Å; L1009-F1032 VanDerWaalsContact CD1-CD2 3.5Å; L1009-F1032 HydrophobicContact CD1-CE2 3.36Å; L1009-F1032 HydrophobicContact CD1-CG 4.35Å; L1009-F1032 HydrophobicContact CD1-CZ 4.11Å; L1009-F1032 HydrophobicContact CG-CE2 4.27Å; W1021-F1032 HydrophobicContact CH2-CD1 4.38Å; W1021-F1032 AromaticContact CH2-CE1 3.8Å; W1021-F1032 HydrophobicContact CH2-CE1 3.8Å; W1021-F1032 HydrophobicContact CH2-CZ 4.06Å; W1021-F1032 HydrophobicContact CZ3-CD1 4.16Å; W1021-F1032 AromaticContact CZ3-CE1 3.95Å; W1021-F1032 HydrophobicContact CZ3-CE1 3.95Å; L1028-F1032 PolarHBondContact O-N 3.34Å; L1029-F1032 WeakPolarHBondContact O-CB 3.5Å; L1029-F1032 PolarHBondContact O-N 3.44Å; R1030-F1032 VanDerWaalsContact C-N 3.31Å; R1030-F1032 PolarHBondContact O-N 3.33Å; F1032-E1034 PolarHBondContact O-N 3.22Å; F1032-V1035 PolarHBondContact O-N 3.08Å; F1032-K1036 HydrophobicContact CE1-CD 4.14Å; F1032-K1036 HydrophobicContact CZ-CD 4.21Å; F1032-K1036 WeakPolarHBondContact O-CB 3.43Å; F1032-K1036 PolarHBondContact O-N 3.03Å
1033	E	90.2	Very high	86.1	Confident	90 Å²	90	70.1 Å²	70.1	42%	0.421	35%	0.345	S	S	.	.	H	α-helix	trans	-64.2	-37.2	178.4	-70.9	-60.5	159	0	0	112.7	L1029 R1030 V1031 K1036 Q1037	L1029-E1033 WeakPolarHBondContact O-CG 3.33Å; L1029-E1033 PolarHBondContact O-N 2.9Å; R1030-E1033 PolarHBondContact O-N 2.93Å; V1031-E1033 PolarHBondContact O-N 2.86Å; E1033-K1036 PolarHBondContact O-N 3.01Å; E1033-Q1037 WeakPolarHBondContact O-CG 3.1Å; E1033-Q1037 PolarHBondContact O-N 3.16Å; E1033-Q1037 VanDerWaalsContact O-N 3.09Å
1034	E	85.9	Confident	85.6	Confident	77 Å²	77	66.4 Å²	66.4	36%	0.36	33%	0.333	S	S	.	.	H	α-helix	trans	-64.2	-47	174.2	-73.5	172.5	-164.4	0	0	111.7	R1030 V1031 F1032 K1036 Q1037 V1038 L1232	R1030-E1034 WeakPolarHBondContact O-CG 3.44Å; R1030-E1034 PolarHBondContact O-N 3.16Å; V1031-E1034 PolarHBondContact O-N 2.67Å; F1032-E1034 PolarHBondContact O-N 3.22Å; E1034-K1036 VanDerWaalsContact C-N 3.35Å; E1034-Q1037 PolarHBondContact O-N 2.98Å; E1034-V1038 PolarHBondContact O-N 2.78Å; E1034-L1232 HydrophobicContact CB-CD1 4.39Å
1035	V	86	Confident	85.2	Confident	5 Å²	5	72.1 Å²	72.1	3%	0.03	36%	0.357	C	S	.	.	H	α-helix	trans	-67.9	-38.2	177.6	176.4	0	0	0	0	110.8	M990 Q994 L1002 V1031 F1032 Q1037 V1038 L1039	M990-V1035 HydrophobicContact CE-CB 3.42Å; M990-V1035 VanDerWaalsContact CE-CB 3.42Å; M990-V1035 HydrophobicContact CE-CG1 3.22Å; M990-V1035 HydrophobicContact CE-CG2 4.02Å; Q994-V1035 VanDerWaalsContact OE1-CG2 3.31Å; L1002-V1035 HydrophobicContact CD2-CG1 4.29Å; V1031-V1035 HydrophobicContact CG1-CG2 4.4Å; V1031-V1035 WeakPolarHBondContact O-CG2 3.48Å; V1031-V1035 PolarHBondContact O-N 2.88Å; F1032-V1035 PolarHBondContact O-N 3.08Å; V1035-Q1037 VanDerWaalsContact C-N 3.29Å; V1035-Q1037 PolarHBondContact O-N 3.13Å; V1035-V1038 WeakPolarHBondContact O-CA 3.2Å; V1035-V1038 WeakPolarHBondContact O-CB 3.45Å; V1035-V1038 PolarHBondContact O-N 2.56Å; V1035-L1039 HydrophobicContact CG1-CD1 3.47Å; V1035-L1039 VanDerWaalsContact CG1-CD1 3.47Å; V1035-L1039 HydrophobicContact CG1-CG 3.75Å; V1035-L1039 WeakPolarHBondContact O-CG 3.27Å; V1035-L1039 PolarHBondContact O-N 3.44Å
1036	K	87.9	Confident	84.9	Confident	52 Å²	52	72 Å²	72	23%	0.226	36%	0.356	C	S	.	.	H	α-helix	trans	-56.2	-41.9	174.6	173.1	166.5	177.9	171.6	0	111.4	Y1006 E1010 F1032 E1033 E1034 V1038 L1039 S1040	Y1006-K1036 HydrophobicContact CE2-CB 4.17Å; Y1006-K1036 HydrophobicContact CE2-CD 4.21Å; Y1006-K1036 HydrophobicContact CE2-CG 3.81Å; E1010-K1036 VanDerWaalsContact OE1-CE 3.31Å; E1010-K1036 WeakPolarHBondContact OE1-CE 3.24Å; E1010-K1036 IonicContact OE1-NZ 2.78Å; E1010-K1036 PolarHBondContact OE1-NZ 3.46Å; F1032-K1036 HydrophobicContact CE1-CD 4.14Å; F1032-K1036 HydrophobicContact CZ-CD 4.21Å; F1032-K1036 WeakPolarHBondContact O-CB 3.43Å; F1032-K1036 PolarHBondContact O-N 3.03Å; E1033-K1036 PolarHBondContact O-N 3.01Å; E1034-K1036 VanDerWaalsContact C-N 3.35Å; K1036-V1038 VanDerWaalsContact C-N 3.29Å; K1036-V1038 PolarHBondContact O-N 2.9Å; K1036-L1039 PolarHBondContact O-N 2.92Å; K1036-S1040 WeakPolarHBondContact O-CA 3.29Å; K1036-S1040 WeakPolarHBondContact O-CB 3.4Å; K1036-S1040 PolarHBondContact O-N 3.22Å; K1036-S1040 PolarHBondContact O-OG 3.12Å
1037	Q	84.5	Confident	84.5	Confident	132 Å²	132	66.8 Å²	66.8	62%	0.617	33%	0.332	S	S	*	.	H	α-helix	trans	-59.7	-39	174.6	-71.3	173.8	18.3	0	0	112.5	E1033 E1034 V1035 S1040	E1033-Q1037 WeakPolarHBondContact O-CG 3.1Å; E1033-Q1037 PolarHBondContact O-N 3.16Å; E1033-Q1037 VanDerWaalsContact O-N 3.09Å; E1034-Q1037 PolarHBondContact O-N 2.98Å; V1035-Q1037 VanDerWaalsContact C-N 3.29Å; V1035-Q1037 PolarHBondContact O-N 3.13Å; Q1037-S1040 PolarHBondContact O-OG 3.47Å
1038	V	82.2	Confident	84.3	Confident	42 Å²	42	61.6 Å²	61.6	26%	0.255	31%	0.308	S	S	.	.	H	α-helix	trans	-71.2	-38.9	177.9	178.8	0	0	0	0	112.1	E1034 V1035 K1036 L1046 I1047	E1034-V1038 PolarHBondContact O-N 2.78Å; V1035-V1038 WeakPolarHBondContact O-CA 3.2Å; V1035-V1038 WeakPolarHBondContact O-CB 3.45Å; V1035-V1038 PolarHBondContact O-N 2.56Å; K1036-V1038 VanDerWaalsContact C-N 3.29Å; K1036-V1038 PolarHBondContact O-N 2.9Å; V1038-L1046 HydrophobicContact CG1-CB 4.04Å; V1038-I1047 HydrophobicContact CG1-CG1 4.1Å
1039	L	84.2	Confident	84.1	Confident	11 Å²	11	65 Å²	65	6%	0.058	32%	0.323	C	S	.	.	H	α-helix	trans	-88.6	-25.1	-174.3	-60.7	-176	0	0	0	114.3	L1002 I1003 Y1006 V1035 K1036 D1041 I1047	L1002-L1039 HydrophobicContact CB-CD1 4.16Å; L1002-L1039 WeakPolarHBondContact O-CD1 3.45Å; I1003-L1039 HydrophobicContact CD1-CD2 4.43Å; I1003-L1039 HydrophobicContact CG1-CD1 4.26Å; I1003-L1039 HydrophobicContact CG1-CD2 3.81Å; Y1006-L1039 HydrophobicContact CD1-CB 4.24Å; Y1006-L1039 HydrophobicContact CD1-CD1 4.42Å; Y1006-L1039 HydrophobicContact CE1-CB 4.5Å; Y1006-L1039 HydrophobicContact CG-CB 4.32Å; Y1006-L1039 HydrophobicContact CG-CD1 3.94Å; V1035-L1039 HydrophobicContact CG1-CD1 3.47Å; V1035-L1039 VanDerWaalsContact CG1-CD1 3.47Å; V1035-L1039 HydrophobicContact CG1-CG 3.75Å; V1035-L1039 WeakPolarHBondContact O-CG 3.27Å; V1035-L1039 PolarHBondContact O-N 3.44Å; K1036-L1039 PolarHBondContact O-N 2.92Å; L1039-D1041 PolarHBondContact O-N 3.37Å; L1039-I1047 HydrophobicContact CD2-CD1 3.67Å; L1039-I1047 HydrophobicContact CD2-CG1 4.2Å
1040	S	77.1	Confident	83.8	Confident	69 Å²	69	68.6 Å²	68.6	48%	0.483	34%	0.335	S	S	.	.			trans	-71.1	-13.4	-176.1	66.3	0	0	0	0	114.6	K1036 Q1037 A1042	K1036-S1040 WeakPolarHBondContact O-CA 3.29Å; K1036-S1040 WeakPolarHBondContact O-CB 3.4Å; K1036-S1040 PolarHBondContact O-N 3.22Å; K1036-S1040 PolarHBondContact O-OG 3.12Å; Q1037-S1040 PolarHBondContact O-OG 3.47Å; S1040-A1042 PolarHBondContact O-N 2.73Å
1041	D	78.3	Confident	83.6	Confident	43 Å²	43	60.6 Å²	60.6	23%	0.23	31%	0.305	C	S	.	.			trans	-69.6	115.3	178.8	176.6	18	0	0	0	110.7	L1039 H1043 H1044 K1045	L1039-D1041 PolarHBondContact O-N 3.37Å; D1041-H1043 PolarHBondContact O-N 2.84Å; D1041-H1043 PolarHBondContact OD1-N 2.89Å; D1041-H1043 VanDerWaalsContact OD1-N 3.13Å; D1041-H1044 PolarHBondContact O-CD2 3.06Å; D1041-H1044 VanDerWaalsContact O-CD2 3.31Å; D1041-H1044 PolarHBondContact O-N 2.89Å; D1041-K1045 WeakPolarHBondContact OD2-CA 3.29Å; D1041-K1045 WeakPolarHBondContact OD2-CB 3.25Å; D1041-K1045 PolarHBondContact OD2-N 3.37Å
1042	A	70.4	Confident	83.6	Confident	86 Å²	86	67.9 Å²	67.9	71%	0.711	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-22.9	-179.4	0	0	0	0	0	113.9	S1040	S1040-A1042 PolarHBondContact O-N 2.73Å
1043	H	77.5	Confident	83.3	Confident	150 Å²	150	71.7 Å²	71.7	69%	0.694	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	2.5	178.8	-61.2	-56.5	0	0	0	114.2	D1041 K1045	D1041-H1043 PolarHBondContact O-N 2.84Å; D1041-H1043 PolarHBondContact OD1-N 2.89Å; D1041-H1043 VanDerWaalsContact OD1-N 3.13Å; H1043-K1045 PolarHBondContact O-N 2.95Å
1044	H	81.6	Confident	83.1	Confident	38 Å²	38	68.5 Å²	68.5	18%	0.176	34%	0.341	C	S	.	.			trans	53.3	30.4	-178.9	-52.4	142.6	0	0	0	113.9	D1041 L1046 I1047 R1048 F1061 M1064	D1041-H1044 PolarHBondContact O-CD2 3.06Å; D1041-H1044 VanDerWaalsContact O-CD2 3.31Å; D1041-H1044 PolarHBondContact O-N 2.89Å; H1044-L1046 VanDerWaalsContact C-N 3.33Å; H1044-L1046 PolarHBondContact O-N 3.5Å; H1044-I1047 HydrophobicContact CB-CB 4.22Å; H1044-I1047 HydrophobicContact CB-CD1 4.12Å; H1044-I1047 HydrophobicContact CB-CG1 4.45Å; H1044-I1047 PolarHBondContact O-N 3.29Å; H1044-R1048 WeakPolarHBondContact O-CG 3.38Å; H1044-R1048 PolarHBondContact O-N 2.89Å; H1044-F1061 AromaticContact CE1-CD1 3.83Å; H1044-F1061 AromaticContact CE1-CE1 3.64Å; H1044-M1064 HydrophobicContact CB-CG 4.17Å; H1044-M1064 HydrophobicContact CB-SD 3.71Å
1045	K	83	Confident	82.8	Confident	127 Å²	127	71.5 Å²	71.5	55%	0.552	36%	0.36	S	S	*	.	H	α-helix	trans	-57.6	-45.9	-176.8	-175.3	-175.9	170.7	-174.8	0	111.3	D1041 H1043 I1047 R1048 E1049	D1041-K1045 WeakPolarHBondContact OD2-CA 3.29Å; D1041-K1045 WeakPolarHBondContact OD2-CB 3.25Å; D1041-K1045 PolarHBondContact OD2-N 3.37Å; H1043-K1045 PolarHBondContact O-N 2.95Å; K1045-I1047 PolarHBondContact O-N 3.35Å; K1045-R1048 PolarHBondContact O-N 2.88Å; K1045-E1049 WeakPolarHBondContact CE-OE1 3.49Å; K1045-E1049 WeakPolarHBondContact O-CG 3.47Å; K1045-E1049 PolarHBondContact O-N 3.2Å
1046	L	84	Confident	82.8	Confident	73 Å²	73	73.4 Å²	73.4	38%	0.382	37%	0.372	S	S	.	.	H	α-helix	trans	-65.5	-37.9	179.5	-67.8	172.4	0	0	0	112.1	V1038 H1044 E1049 R1050	V1038-L1046 HydrophobicContact CG1-CB 4.04Å; H1044-L1046 VanDerWaalsContact C-N 3.33Å; H1044-L1046 PolarHBondContact O-N 3.5Å; L1046-E1049 PolarHBondContact O-N 2.92Å; L1046-R1050 VanDerWaalsContact O-CB 3.29Å; L1046-R1050 WeakPolarHBondContact O-CB 3.47Å; L1046-R1050 PolarHBondContact O-N 3.48Å
1047	I	85.3	Confident	82.8	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-62.8	-44.6	173.9	-59.5	177.7	0	0	0	110.2	F999 I1003 V1038 L1039 H1044 K1045 R1050 L1051	F999-I1047 HydrophobicContact CD1-CG2 4.06Å; F999-I1047 HydrophobicContact CE1-CG2 4.42Å; F999-I1047 HydrophobicContact CG-CG2 4.4Å; I1003-I1047 HydrophobicContact CD1-CD1 4.11Å; V1038-I1047 HydrophobicContact CG1-CG1 4.1Å; L1039-I1047 HydrophobicContact CD2-CD1 3.67Å; L1039-I1047 HydrophobicContact CD2-CG1 4.2Å; H1044-I1047 HydrophobicContact CB-CB 4.22Å; H1044-I1047 HydrophobicContact CB-CD1 4.12Å; H1044-I1047 HydrophobicContact CB-CG1 4.45Å; H1044-I1047 PolarHBondContact O-N 3.29Å; K1045-I1047 PolarHBondContact O-N 3.35Å; I1047-R1050 WeakPolarHBondContact O-CB 3.26Å; I1047-R1050 PolarHBondContact O-N 2.84Å; I1047-L1051 HydrophobicContact CG2-CD1 3.98Å; I1047-L1051 HydrophobicContact CG2-CG 4.31Å; I1047-L1051 WeakPolarHBondContact O-CB 3.41Å; I1047-L1051 WeakPolarHBondContact O-CG 3.22Å; I1047-L1051 PolarHBondContact O-N 3.1Å
1048	R	85.5	Confident	83.2	Confident	47 Å²	47	66.5 Å²	66.5	18%	0.177	34%	0.344	C	S	.	.	H	α-helix	trans	-62	-44.5	177.7	-67.1	175.9	-166.9	-89	7	112.2	H1044 K1045 R1050 L1051 R1052 M1064 N1068	H1044-R1048 WeakPolarHBondContact O-CG 3.38Å; H1044-R1048 PolarHBondContact O-N 2.89Å; K1045-R1048 PolarHBondContact O-N 2.88Å; R1048-R1050 VanDerWaalsContact C-N 3.3Å; R1048-R1050 PolarHBondContact O-N 3.26Å; R1048-L1051 PolarHBondContact O-N 2.6Å; R1048-R1052 VanDerWaalsContact O-CG 3.3Å; R1048-R1052 WeakPolarHBondContact O-CG 3.29Å; R1048-R1052 PolarHBondContact O-N 3.24Å; R1048-R1052 VanDerWaalsContact O-N 3.13Å; R1048-M1064 HydrophobicContact CG-CE 3.92Å; R1048-M1064 HydrophobicContact CG-SD 3.32Å; R1048-M1064 WeakPolarHBondContact CG-SD 3.23Å; R1048-M1064 PolarHBondContact NE-SD 3.14Å; R1048-N1068 PolarHBondContact NH1-ND2 2.95Å; R1048-N1068 PolarHBondContact NH2-ND2 2.98Å; R1048-N1068 VanDerWaalsContact NH2-ND2 3.13Å; R1048-N1068 PolarHBondContact NH2-OD1 3.44Å
1049	E	85.7	Confident	83.8	Confident	89 Å²	89	64.5 Å²	64.5	42%	0.416	33%	0.332	S	S	.	.	H	α-helix	trans	-61.9	-40.8	175.8	-73.1	173.4	-176.1	0	0	111.1	K1045 L1046 R1052 S1053	K1045-E1049 WeakPolarHBondContact CE-OE1 3.49Å; K1045-E1049 WeakPolarHBondContact O-CG 3.47Å; K1045-E1049 PolarHBondContact O-N 3.2Å; L1046-E1049 PolarHBondContact O-N 2.92Å; E1049-R1052 PolarHBondContact O-N 3.32Å; E1049-S1053 PolarHBondContact O-N 3.32Å
1050	R	83.3	Confident	84.2	Confident	102 Å²	102	64 Å²	64	39%	0.385	33%	0.329	S	S	.	.	H	α-helix	trans	-65.3	-48.1	177.3	-163.7	76.8	176.2	170.9	-0	111.9	F999 L1046 I1047 R1048 R1052 S1053 I1054	F999-R1050 HydrophobicContact CE1-CB 4.46Å; F999-R1050 HydrophobicContact CE1-CG 4.14Å; F999-R1050 HydrophobicContact CZ-CB 4.33Å; F999-R1050 HydrophobicContact CZ-CG 3.87Å; L1046-R1050 VanDerWaalsContact O-CB 3.29Å; L1046-R1050 WeakPolarHBondContact O-CB 3.47Å; L1046-R1050 PolarHBondContact O-N 3.48Å; I1047-R1050 WeakPolarHBondContact O-CB 3.26Å; I1047-R1050 PolarHBondContact O-N 2.84Å; R1048-R1050 VanDerWaalsContact C-N 3.3Å; R1048-R1050 PolarHBondContact O-N 3.26Å; R1050-R1052 VanDerWaalsContact C-N 3.29Å; R1050-R1052 PolarHBondContact O-N 2.71Å; R1050-S1053 PolarHBondContact O-N 2.97Å; R1050-S1053 PolarHBondContact O-OG 3.3Å; R1050-I1054 HydrophobicContact CG-CD1 3.62Å; R1050-I1054 HydrophobicContact CG-CG1 4.36Å; R1050-I1054 WeakPolarHBondContact O-CG1 3.48Å; R1050-I1054 PolarHBondContact O-N 2.83Å; R1050-I1054 VanDerWaalsContact O-N 3.11Å
1051	L	87	Confident	84.9	Confident	2 Å²	2	62.9 Å²	62.9	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-56	-42.6	177.1	-77.5	171	0	0	0	111.7	F999 I1047 R1048 S1053 I1054 P1060 M1064 Y1122	F999-L1051 HydrophobicContact CD2-CD2 3.74Å; F999-L1051 HydrophobicContact CD2-CG 4.47Å; F999-L1051 HydrophobicContact CE2-CD2 3.49Å; F999-L1051 VanDerWaalsContact CE2-CD2 3.49Å; F999-L1051 HydrophobicContact CE2-CG 4.16Å; F999-L1051 HydrophobicContact CZ-CD2 4.3Å; I1047-L1051 HydrophobicContact CG2-CD1 3.98Å; I1047-L1051 HydrophobicContact CG2-CG 4.31Å; I1047-L1051 WeakPolarHBondContact O-CB 3.41Å; I1047-L1051 WeakPolarHBondContact O-CG 3.22Å; I1047-L1051 PolarHBondContact O-N 3.1Å; R1048-L1051 PolarHBondContact O-N 2.6Å; L1051-S1053 PolarHBondContact O-N 3.11Å; L1051-I1054 PolarHBondContact O-N 3.08Å; L1051-P1060 HydrophobicContact CD1-CB 4.13Å; L1051-P1060 HydrophobicContact CD2-CB 4.13Å; L1051-P1060 HydrophobicContact CD2-CG 3.97Å; L1051-M1064 HydrophobicContact CD1-CE 3.89Å; L1051-Y1122 PolarHBondContact O-OH 2.8Å
1052	R	85.4	Confident	85.6	Confident	188 Å²	188	61.2 Å²	61.2	71%	0.709	31%	0.307	S	S	*	.	H	α-helix	trans	-64.3	-19.9	175.8	-69.6	172.2	-171.4	163.7	1	114.4	R1048 E1049 R1050	R1048-R1052 VanDerWaalsContact O-CG 3.3Å; R1048-R1052 WeakPolarHBondContact O-CG 3.29Å; R1048-R1052 PolarHBondContact O-N 3.24Å; R1048-R1052 VanDerWaalsContact O-N 3.13Å; E1049-R1052 PolarHBondContact O-N 3.32Å; R1050-R1052 VanDerWaalsContact C-N 3.29Å; R1050-R1052 PolarHBondContact O-N 2.71Å
1053	S	85.3	Confident	86.6	Confident	83 Å²	83	58 Å²	58	58%	0.58	28%	0.282	S	S	*	.	H	α-helix	trans	-100.9	-13.7	-178.3	71.4	0	0	0	0	114.2	E1049 R1050 L1051	E1049-S1053 PolarHBondContact O-N 3.32Å; R1050-S1053 PolarHBondContact O-N 2.97Å; R1050-S1053 PolarHBondContact O-OG 3.3Å; L1051-S1053 PolarHBondContact O-N 3.11Å
1054	I	84.3	Confident	87.2	Confident	23 Å²	23	50.9 Å²	50.9	12%	0.118	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-90.9	138.6	-176.4	-73.8	165.3	0	0	0	109.8	N997 F999 R1050 L1051 C1058	N997-I1054 HydrophobicContact CB-CD1 4.37Å; N997-I1054 HydrophobicContact CB-CG2 4.29Å; N997-I1054 WeakPolarHBondContact ND2-CG2 3.45Å; N997-I1054 WeakPolarHBondContact OD1-CD1 3.33Å; F999-I1054 HydrophobicContact CE2-CD1 3.81Å; F999-I1054 HydrophobicContact CZ-CD1 3.47Å; F999-I1054 VanDerWaalsContact CZ-CD1 3.47Å; R1050-I1054 HydrophobicContact CG-CD1 3.62Å; R1050-I1054 HydrophobicContact CG-CG1 4.36Å; R1050-I1054 WeakPolarHBondContact O-CG1 3.48Å; R1050-I1054 PolarHBondContact O-N 2.83Å; R1050-I1054 VanDerWaalsContact O-N 3.11Å; L1051-I1054 PolarHBondContact O-N 3.08Å; I1054-C1058 HydrophobicContact CG2-CB 4.48Å
1055	N	80.3	Confident	87.7	Confident	140 Å²	140	49 Å²	49	75%	0.749	24%	0.24	S	C	*	.	P	Polyproline II helix	trans	-81.7	129.7	164.2	-68.4	-33.2	0	0	0	109.1
1056	P	85	Confident	88.2	Confident	45 Å²	45	43.8 Å²	43.8	29%	0.292	22%	0.218	S	C	.	.	S	Bend	trans	-52.6	154.3	170.9	-25.7	34.8	0	0	0	112.1	Y1122 V1125	P1056-Y1122 HydrophobicContact CG-CD1 4.13Å; P1056-Y1122 HydrophobicContact CG-CE1 4.47Å; P1056-V1125 HydrophobicContact CB-CB 3.7Å; P1056-V1125 HydrophobicContact CB-CG1 3.99Å; P1056-V1125 HydrophobicContact CB-CG2 3.99Å
1057	P	89	Confident	88.6	Confident	39 Å²	39	43.7 Å²	43.7	25%	0.253	22%	0.221	S	C	.	.	P	Polyproline II helix	cis	-80	148.6	11.9	32.7	-36.8	0	0	0	113.6	Y1127	P1057-Y1127 HydrophobicContact CB-CD1 3.94Å; P1057-Y1127 HydrophobicContact CB-CD2 3.92Å; P1057-Y1127 HydrophobicContact CB-CE1 4.01Å; P1057-Y1127 HydrophobicContact CB-CE2 3.99Å; P1057-Y1127 HydrophobicContact CB-CG 3.9Å; P1057-Y1127 HydrophobicContact CG-CD1 3.75Å; P1057-Y1127 HydrophobicContact CG-CE1 3.97Å; P1057-Y1127 HydrophobicContact CG-CG 4.09Å
1058	C	92.7	Very high	88.8	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.229	C	C	.	.			trans	-150.9	162	172.5	64.6	0	0	0	0	109.8	N997 I1054 Y1122 Y1127	N997-C1058 HydrophobicContact CB-CB 3.67Å; N997-C1058 WeakPolarHBondContact O-CA 3.47Å; N997-C1058 WeakPolarHBondContact O-CB 3.33Å; I1054-C1058 HydrophobicContact CG2-CB 4.48Å; C1058-Y1122 WeakPolarHBondContact SG-CD1 3.4Å; C1058-Y1127 WeakPolarHBondContact CA-OH 3.48Å
1059	V	94	Very high	89.1	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-115.3	96.9	167.9	-172.5	0	0	0	0	108.5	T920 E923 F924 N997 N998 F999 T1000 Y1127	T920-V1059 HydrophobicContact CG2-CG2 4.23Å; E923-V1059 HydrophobicContact CB-CG1 4.23Å; F924-V1059 HydrophobicContact CB-CG2 3.92Å; F924-V1059 HydrophobicContact CD2-CG2 4.19Å; N997-V1059 PolarHBondContact O-N 3.14Å; N998-V1059 HydrophobicContact CB-CB 4.48Å; N998-V1059 WeakPolarHBondContact OD1-CB 3.48Å; F999-V1059 WeakPolarHBondContact CA-O 3.44Å; F999-V1059 WeakPolarHBondContact CB-O 3.44Å; F999-V1059 PolarHBondContact N-O 3.44Å; T1000-V1059 PolarHBondContact N-O 3Å; V1059-Y1127 HydrophobicContact CG2-CE2 3.73Å; V1059-Y1127 PolarHBondContact N-OH 3.11Å
1060	P	93.2	Very high	89.4	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.213	C	C	.	.			trans	-66.2	148.9	176.3	-22.8	34.6	0	0	0	112.8	Y927 T1000 L1051 F1062 Y1065 Y1122	Y927-P1060 HydrophobicContact CE2-CB 4.23Å; Y927-P1060 HydrophobicContact CE2-CG 4.33Å; T1000-P1060 PolarHBondContact OG1-O 3.19Å; L1051-P1060 HydrophobicContact CD1-CB 4.13Å; L1051-P1060 HydrophobicContact CD2-CB 4.13Å; L1051-P1060 HydrophobicContact CD2-CG 3.97Å; P1060-F1062 PolarHBondContact O-N 2.97Å; P1060-F1062 VanDerWaalsContact O-N 3.16Å; P1060-Y1065 HydrophobicContact CB-CE2 3.94Å; P1060-Y1122 HydrophobicContact CG-CD1 4.5Å; P1060-Y1122 HydrophobicContact CG-CD2 3.71Å; P1060-Y1122 HydrophobicContact CG-CE2 4.34Å; P1060-Y1122 HydrophobicContact CG-CG 3.81Å
1061	F	92.4	Very high	89.7	Confident	45 Å²	45	43 Å²	43	20%	0.197	22%	0.224	C	C	.	.			trans	-70.2	111.2	173.3	178.1	-123.8	0	0	0	111.8	I1003 H1044 G1063 M1064	I1003-F1061 HydrophobicContact CB-CD2 4.37Å; I1003-F1061 HydrophobicContact CD1-CB 3.49Å; I1003-F1061 VanDerWaalsContact CD1-CB 3.49Å; I1003-F1061 HydrophobicContact CD1-CD1 3.46Å; I1003-F1061 VanDerWaalsContact CD1-CD1 3.46Å; I1003-F1061 HydrophobicContact CD1-CD2 3.55Å; I1003-F1061 HydrophobicContact CD1-CE1 4.01Å; I1003-F1061 HydrophobicContact CD1-CE2 4.09Å; I1003-F1061 HydrophobicContact CD1-CG 3.19Å; I1003-F1061 HydrophobicContact CD1-CZ 4.3Å; I1003-F1061 HydrophobicContact CG2-CD2 4.24Å; I1003-F1061 HydrophobicContact CG2-CE2 3.92Å; I1003-F1061 HydrophobicContact CG2-CZ 4.25Å; H1044-F1061 AromaticContact CE1-CD1 3.83Å; H1044-F1061 AromaticContact CE1-CE1 3.64Å; F1061-G1063 VanDerWaalsContact C-N 3.3Å; F1061-G1063 PolarHBondContact O-N 3.12Å; F1061-M1064 HydrophobicContact CD1-CB 4.12Å; F1061-M1064 WeakPolarHBondContact O-CB 3.34Å; F1061-M1064 PolarHBondContact O-N 3.46Å
1062	F	93.2	Very high	89.9	Confident	8 Å²	8	44.2 Å²	44.2	4%	0.035	23%	0.23	C	C	.	.	H	α-helix	trans	-63.7	-33.5	-174.3	-142.4	-71	0	0	0	113.2	Y927 V930 L935 L952 L955 P1060 M1064 Y1065 L1066 I1119	Y927-F1062 AromaticContact CD2-CD2 3.53Å; Y927-F1062 HydrophobicContact CD2-CD2 3.53Å; Y927-F1062 AromaticContact CD2-CE2 3.99Å; Y927-F1062 HydrophobicContact CD2-CE2 3.99Å; Y927-F1062 AromaticContact CE2-CD2 3.48Å; Y927-F1062 HydrophobicContact CE2-CD2 3.48Å; Y927-F1062 VanDerWaalsContact CE2-CD2 3.48Å; Y927-F1062 AromaticContact CE2-CE2 3.83Å; Y927-F1062 HydrophobicContact CE2-CE2 3.83Å; Y927-F1062 HydrophobicContact CE2-CG 4.5Å; V930-F1062 HydrophobicContact CB-CE2 4.07Å; V930-F1062 HydrophobicContact CB-CZ 4.21Å; V930-F1062 HydrophobicContact CG1-CE2 4.1Å; V930-F1062 HydrophobicContact CG1-CZ 3.72Å; V930-F1062 HydrophobicContact CG2-CE2 4Å; V930-F1062 HydrophobicContact CG2-CZ 4.39Å; L935-F1062 HydrophobicContact CD1-CE1 4.25Å; L935-F1062 HydrophobicContact CD1-CZ 3.99Å; L935-F1062 HydrophobicContact CD2-CE1 3.59Å; L935-F1062 HydrophobicContact CD2-CZ 3.9Å; L952-F1062 HydrophobicContact CD1-CD1 3.68Å; L952-F1062 HydrophobicContact CD1-CE1 3.72Å; L952-F1062 HydrophobicContact CD1-CG 4.14Å; L952-F1062 HydrophobicContact CD1-CZ 4.19Å; L955-F1062 HydrophobicContact CD2-CB 4Å; L955-F1062 HydrophobicContact CD2-CD2 3.6Å; L955-F1062 HydrophobicContact CD2-CE2 4.41Å; L955-F1062 HydrophobicContact CD2-CG 3.99Å; P1060-F1062 PolarHBondContact O-N 2.97Å; P1060-F1062 VanDerWaalsContact O-N 3.16Å; F1062-M1064 PolarHBondContact O-N 3.41Å; F1062-M1064 VanDerWaalsContact O-N 3.13Å; F1062-Y1065 PolarHBondContact O-N 2.99Å; F1062-L1066 HydrophobicContact CD1-CD1 4.36Å; F1062-L1066 HydrophobicContact CD1-CD2 3.69Å; F1062-L1066 HydrophobicContact CD1-CG 3.84Å; F1062-L1066 HydrophobicContact CE1-CD2 3.7Å; F1062-L1066 HydrophobicContact CE1-CG 4.35Å; F1062-L1066 PolarHBondContact O-N 2.77Å; F1062-L1066 VanDerWaalsContact O-N 3.17Å; F1062-I1119 HydrophobicContact CE1-CD1 4.22Å; F1062-I1119 HydrophobicContact CE2-CG2 4.23Å; F1062-I1119 HydrophobicContact CZ-CD1 3.94Å; F1062-I1119 HydrophobicContact CZ-CG2 4.34Å
1063	G	90.6	Very high	90	Very high	18 Å²	18	36.7 Å²	36.7	19%	0.186	20%	0.203	C	C	.	.	H	α-helix	trans	-57.1	-32.2	-177.7	0	0	0	0	0	113.5	F1061 Y1065 L1066 T1067	F1061-G1063 VanDerWaalsContact C-N 3.3Å; F1061-G1063 PolarHBondContact O-N 3.12Å; G1063-Y1065 VanDerWaalsContact C-N 3.3Å; G1063-Y1065 PolarHBondContact O-N 2.85Å; G1063-L1066 PolarHBondContact O-N 3.31Å; G1063-T1067 PolarHBondContact O-N 3.27Å; G1063-T1067 VanDerWaalsContact O-N 3.08Å; G1063-T1067 PolarHBondContact O-OG1 3.42Å; G1063-T1067 VanDerWaalsContact O-OG1 3.12Å
1064	M	90.1	Very high	90.1	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-60.7	-37.9	174.9	-176.3	179.3	68.6	0	0	112.9	H1044 R1048 L1051 F1061 F1062 N1068	H1044-M1064 HydrophobicContact CB-CG 4.17Å; H1044-M1064 HydrophobicContact CB-SD 3.71Å; R1048-M1064 HydrophobicContact CG-CE 3.92Å; R1048-M1064 HydrophobicContact CG-SD 3.32Å; R1048-M1064 WeakPolarHBondContact CG-SD 3.23Å; R1048-M1064 PolarHBondContact NE-SD 3.14Å; L1051-M1064 HydrophobicContact CD1-CE 3.89Å; F1061-M1064 HydrophobicContact CD1-CB 4.12Å; F1061-M1064 WeakPolarHBondContact O-CB 3.34Å; F1061-M1064 PolarHBondContact O-N 3.46Å; F1062-M1064 PolarHBondContact O-N 3.41Å; F1062-M1064 VanDerWaalsContact O-N 3.13Å; M1064-N1068 PolarHBondContact O-N 3.02Å; M1064-N1068 PolarHBondContact O-OD1 2.89Å
1065	Y	93	Very high	90.2	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-76.8	-40.1	177.8	-61.6	-60.9	0	0	0	111.5	P1060 F1062 G1063 T1067 N1068 I1069 I1115 E1118 I1119	P1060-Y1065 HydrophobicContact CB-CE2 3.94Å; F1062-Y1065 PolarHBondContact O-N 2.99Å; G1063-Y1065 VanDerWaalsContact C-N 3.3Å; G1063-Y1065 PolarHBondContact O-N 2.85Å; Y1065-T1067 VanDerWaalsContact C-N 3.33Å; Y1065-T1067 PolarHBondContact O-N 2.97Å; Y1065-N1068 PolarHBondContact O-N 3.29Å; Y1065-I1069 VanDerWaalsContact O-CG1 3.32Å; Y1065-I1069 WeakPolarHBondContact O-CG1 3.49Å; Y1065-I1069 PolarHBondContact O-N 2.89Å; Y1065-I1115 HydrophobicContact CD1-CG2 3.72Å; Y1065-I1115 HydrophobicContact CG-CG2 4.31Å; Y1065-E1118 HydrophobicContact CE1-CG 4.4Å; Y1065-E1118 WeakPolarHBondContact CE1-OE1 3.48Å; Y1065-E1118 PolarHBondContact OH-OE1 3.5Å; Y1065-I1119 HydrophobicContact CD1-CD1 4.47Å; Y1065-I1119 HydrophobicContact CD1-CG1 4.23Å; Y1065-I1119 HydrophobicContact CD2-CD1 4.02Å; Y1065-I1119 HydrophobicContact CD2-CG1 3.68Å; Y1065-I1119 HydrophobicContact CE1-CG1 4.4Å; Y1065-I1119 HydrophobicContact CE2-CG1 3.89Å; Y1065-I1119 HydrophobicContact CG-CD1 3.89Å; Y1065-I1119 HydrophobicContact CG-CG1 3.86Å
1066	L	93.8	Very high	90.5	Very high	17 Å²	17	38 Å²	38	9%	0.089	21%	0.212	C	C	.	.	H	α-helix	trans	-58.9	-44.5	177.6	-58.9	-178.1	0	0	0	111.7	L935 W940 L952 I956 F1062 G1063 N1068 I1069 I1070	L935-L1066 HydrophobicContact CD2-CD2 4Å; W940-L1066 HydrophobicContact CD2-CD2 4.15Å; W940-L1066 HydrophobicContact CE3-CD2 4.24Å; W940-L1066 HydrophobicContact CH2-CB 4.4Å; W940-L1066 HydrophobicContact CH2-CD2 3.81Å; W940-L1066 HydrophobicContact CZ2-CB 3.76Å; W940-L1066 HydrophobicContact CZ2-CD2 3.68Å; W940-L1066 HydrophobicContact CZ2-CG 4.21Å; W940-L1066 HydrophobicContact CZ3-CD2 4.06Å; L952-L1066 HydrophobicContact CD1-CD1 4.4Å; L952-L1066 HydrophobicContact CD1-CD2 4.25Å; L952-L1066 HydrophobicContact CD2-CD2 3.87Å; I956-L1066 HydrophobicContact CD1-CD1 4.16Å; F1062-L1066 HydrophobicContact CD1-CD1 4.36Å; F1062-L1066 HydrophobicContact CD1-CD2 3.69Å; F1062-L1066 HydrophobicContact CD1-CG 3.84Å; F1062-L1066 HydrophobicContact CE1-CD2 3.7Å; F1062-L1066 HydrophobicContact CE1-CG 4.35Å; F1062-L1066 PolarHBondContact O-N 2.77Å; F1062-L1066 VanDerWaalsContact O-N 3.17Å; G1063-L1066 PolarHBondContact O-N 3.31Å; L1066-N1068 PolarHBondContact O-N 3.29Å; L1066-I1069 PolarHBondContact O-N 3.39Å; L1066-I1070 WeakPolarHBondContact O-CG1 3.4Å; L1066-I1070 PolarHBondContact O-N 3.2Å
1067	T	91	Very high	90.5	Very high	70 Å²	70	39.7 Å²	39.7	43%	0.429	22%	0.223	S	C	.	.	H	α-helix	trans	-59.4	-46	176.5	-61.8	0	0	0	0	111.5	G1063 Y1065 I1069 I1070 F1071	G1063-T1067 PolarHBondContact O-N 3.27Å; G1063-T1067 VanDerWaalsContact O-N 3.08Å; G1063-T1067 PolarHBondContact O-OG1 3.42Å; G1063-T1067 VanDerWaalsContact O-OG1 3.12Å; Y1065-T1067 VanDerWaalsContact C-N 3.33Å; Y1065-T1067 PolarHBondContact O-N 2.97Å; T1067-I1069 PolarHBondContact O-N 3.38Å; T1067-I1070 PolarHBondContact O-N 3.41Å; T1067-F1071 HydrophobicContact CG2-CD2 3.63Å; T1067-F1071 HydrophobicContact CG2-CE2 3.29Å; T1067-F1071 HydrophobicContact CG2-CZ 4.35Å; T1067-F1071 WeakPolarHBondContact O-CD2 3.34Å; T1067-F1071 PolarHBondContact O-N 3.07Å
1068	N	90.2	Very high	90.3	Very high	35 Å²	35	39.1 Å²	39.1	19%	0.187	22%	0.218	C	C	.	.	H	α-helix	trans	-63.2	-42.1	177.7	-74.8	7.3	0	0	0	112.3	R1048 M1064 Y1065 L1066 F1071 L1072 I1115	R1048-N1068 PolarHBondContact NH1-ND2 2.95Å; R1048-N1068 PolarHBondContact NH2-ND2 2.98Å; R1048-N1068 VanDerWaalsContact NH2-ND2 3.13Å; R1048-N1068 PolarHBondContact NH2-OD1 3.44Å; M1064-N1068 PolarHBondContact O-N 3.02Å; M1064-N1068 PolarHBondContact O-OD1 2.89Å; Y1065-N1068 PolarHBondContact O-N 3.29Å; L1066-N1068 PolarHBondContact O-N 3.29Å; N1068-F1071 PolarHBondContact O-N 3.21Å; N1068-L1072 WeakPolarHBondContact O-CG 3.25Å; N1068-L1072 PolarHBondContact O-N 3.48Å; N1068-L1072 VanDerWaalsContact O-N 3.07Å; N1068-I1115 HydrophobicContact CB-CD1 3.82Å
1069	I	92.1	Very high	90	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66	-43	179.3	-66.8	167.4	0	0	0	110.3	L935 W940 Y1065 L1066 T1067 L1072 E1073 I1115	L935-I1069 HydrophobicContact CB-CD1 4.19Å; L935-I1069 HydrophobicContact CD1-CD1 4.47Å; W940-I1069 HydrophobicContact CH2-CB 3.88Å; W940-I1069 HydrophobicContact CH2-CD1 4.48Å; W940-I1069 HydrophobicContact CH2-CG2 3.6Å; W940-I1069 HydrophobicContact CZ3-CG2 4.06Å; Y1065-I1069 VanDerWaalsContact O-CG1 3.32Å; Y1065-I1069 WeakPolarHBondContact O-CG1 3.49Å; Y1065-I1069 PolarHBondContact O-N 2.89Å; L1066-I1069 PolarHBondContact O-N 3.39Å; T1067-I1069 PolarHBondContact O-N 3.38Å; I1069-L1072 PolarHBondContact O-N 3.27Å; I1069-E1073 HydrophobicContact CG2-CG 4.09Å; I1069-E1073 WeakPolarHBondContact O-CB 3.21Å; I1069-E1073 VanDerWaalsContact O-CG 3.27Å; I1069-E1073 WeakPolarHBondContact O-CG 3.35Å; I1069-E1073 PolarHBondContact O-N 3.41Å; I1069-I1115 HydrophobicContact CD1-CG2 4.17Å; I1069-I1115 HydrophobicContact CG1-CD1 4.24Å; I1069-I1115 HydrophobicContact CG1-CG2 4.08Å
1070	I	91.4	Very high	89.4	Confident	47 Å²	47	46.6 Å²	46.6	24%	0.241	25%	0.253	C	S	.	.	H	α-helix	trans	-59.9	-48.1	175.5	-71.6	165.1	0	0	0	110.9	W940 T941 L1066 T1067 L1072 E1073 E1074	W940-I1070 HydrophobicContact CH2-CG1 4.31Å; W940-I1070 HydrophobicContact CZ2-CD1 3.75Å; W940-I1070 HydrophobicContact CZ2-CG1 3.63Å; T941-I1070 HydrophobicContact CG2-CD1 4.21Å; T941-I1070 HydrophobicContact CG2-CG1 4.47Å; L1066-I1070 WeakPolarHBondContact O-CG1 3.4Å; L1066-I1070 PolarHBondContact O-N 3.2Å; T1067-I1070 PolarHBondContact O-N 3.41Å; I1070-L1072 VanDerWaalsContact C-N 3.26Å; I1070-L1072 PolarHBondContact O-N 3.02Å; I1070-E1073 PolarHBondContact O-N 2.95Å; I1070-E1073 VanDerWaalsContact O-N 3.14Å; I1070-E1074 HydrophobicContact CG2-CG 4.25Å; I1070-E1074 PolarHBondContact O-N 3.37Å
1071	F	90.3	Very high	88.4	Confident	143 Å²	143	55.8 Å²	55.8	63%	0.627	29%	0.293	S	S	*	.	H	α-helix	trans	-58.5	-38.1	178.1	-80.4	-55.9	0	0	0	112.7	T1067 N1068 G1075	T1067-F1071 HydrophobicContact CG2-CD2 3.63Å; T1067-F1071 HydrophobicContact CG2-CE2 3.29Å; T1067-F1071 HydrophobicContact CG2-CZ 4.35Å; T1067-F1071 WeakPolarHBondContact O-CD2 3.34Å; T1067-F1071 PolarHBondContact O-N 3.07Å; N1068-F1071 PolarHBondContact O-N 3.21Å; F1071-G1075 WeakPolarHBondContact O-CA 3.14Å; F1071-G1075 PolarHBondContact O-N 2.99Å
1072	L	89.9	Confident	86.9	Confident	27 Å²	27	57.8 Å²	57.8	14%	0.141	30%	0.304	C	S	.	.	H	α-helix	trans	-72.7	-39.4	176	-72.1	173.2	0	0	0	112.5	N1068 I1069 I1070 N1076 K1111 I1112 I1115	N1068-L1072 WeakPolarHBondContact O-CG 3.25Å; N1068-L1072 PolarHBondContact O-N 3.48Å; N1068-L1072 VanDerWaalsContact O-N 3.07Å; I1069-L1072 PolarHBondContact O-N 3.27Å; I1070-L1072 VanDerWaalsContact C-N 3.26Å; I1070-L1072 PolarHBondContact O-N 3.02Å; L1072-N1076 PolarHBondContact O-N 3.41Å; L1072-N1076 PolarHBondContact O-ND2 3.43Å; L1072-N1076 VanDerWaalsContact O-ND2 3.1Å; L1072-K1111 HydrophobicContact CD1-CB 3.9Å; L1072-K1111 HydrophobicContact CD2-CB 4.25Å; L1072-K1111 HydrophobicContact CD2-CD 3.9Å; L1072-I1112 HydrophobicContact CB-CG1 4.27Å; L1072-I1112 HydrophobicContact CD1-CG1 4.22Å; L1072-I1115 HydrophobicContact CD1-CD1 3.51Å
1073	E	87.4	Confident	84.8	Confident	29 Å²	29	62.7 Å²	62.7	14%	0.136	34%	0.336	C	S	.	.	H	α-helix	trans	-66.1	-44.9	-179.8	-78.3	-73.8	-172	0	0	112.3	G937 A938 I1069 I1070 K1108 I1112	G937-E1073 WeakPolarHBondContact CA-OE1 3.47Å; G937-E1073 PolarHBondContact N-OE1 2.93Å; A938-E1073 HydrophobicContact CB-CG 4.28Å; I1069-E1073 HydrophobicContact CG2-CG 4.09Å; I1069-E1073 WeakPolarHBondContact O-CB 3.21Å; I1069-E1073 VanDerWaalsContact O-CG 3.27Å; I1069-E1073 WeakPolarHBondContact O-CG 3.35Å; I1069-E1073 PolarHBondContact O-N 3.41Å; I1070-E1073 PolarHBondContact O-N 2.95Å; I1070-E1073 VanDerWaalsContact O-N 3.14Å; E1073-K1108 PolarHBondContact O-NZ 3.22Å; E1073-K1108 WeakPolarHBondContact OE2-CE 3.42Å; E1073-K1108 IonicContact OE2-NZ 3.67Å; E1073-K1108 PolarHBondContact OE2-NZ 3.17Å; E1073-I1112 HydrophobicContact CG-CD1 4.11Å; E1073-I1112 WeakPolarHBondContact OE1-CD1 3.44Å
1074	E	87.4	Confident	82.3	Confident	161 Å²	161	69.4 Å²	69.4	75%	0.752	37%	0.367	S	S	*	.	H	α-helix	trans	-80.6	-35.6	179.6	-66	-177.8	170	0	0	112.6	I1070	I1070-E1074 HydrophobicContact CG2-CG 4.25Å; I1070-E1074 PolarHBondContact O-N 3.37Å
1075	G	86.3	Confident	79.8	Confident	57 Å²	57	74.5 Å²	74.5	59%	0.588	40%	0.403	S	S	*	.	H	α-helix	trans	-79.2	-15.6	-176	0	0	0	0	0	115.1	F1071	F1071-G1075 WeakPolarHBondContact O-CA 3.14Å; F1071-G1075 PolarHBondContact O-N 2.99Å
1076	N	87	Confident	76.9	Confident	55 Å²	55	79.1 Å²	79.1	29%	0.294	44%	0.435	S	S	.	.	S	Bend	trans	-132	123.2	-177.3	-55.7	-89.8	0	0	0	110.5	L1072 K1108	L1072-N1076 PolarHBondContact O-N 3.41Å; L1072-N1076 PolarHBondContact O-ND2 3.43Å; L1072-N1076 VanDerWaalsContact O-ND2 3.1Å; N1076-K1108 HydrophobicContact CB-CB 4.32Å; N1076-K1108 HydrophobicContact CB-CD 3.98Å; N1076-K1108 HydrophobicContact CB-CG 4.12Å; N1076-K1108 VanDerWaalsContact O-CD 3.29Å; N1076-K1108 WeakPolarHBondContact O-CD 3.16Å; N1076-K1108 WeakPolarHBondContact O-CE 3.24Å; N1076-K1108 PolarHBondContact O-NZ 3.41Å
1077	P	85.7	Confident	74.2	Confident	82 Å²	82	87.2 Å²	87.2	53%	0.532	47%	0.473	S	S	.	.			trans	-68.5	142.8	173.9	28.9	-33.7	0	0	0	110.7	L1080 S1105	P1077-L1080 HydrophobicContact CG-CD2 4.29Å; P1077-S1105 WeakPolarHBondContact O-CB 3.44Å
1078	I	84.5	Confident	71.5	Confident	26 Å²	26	88.5 Å²	88.5	13%	0.133	48%	0.484	C	S	.	.	S	Bend	trans	-69.4	-38.6	170.8	-91.9	171.6	0	0	0	110.8	F726 I1104 S1105 K1108	F726-I1078 HydrophobicContact CB-CG2 4.3Å; I1078-I1104 CarbonylContact O-C 3.52Å; I1078-I1104 WeakPolarHBondContact O-CA 3.43Å; I1078-S1105 WeakPolarHBondContact O-CB 3.22Å; I1078-S1105 PolarHBondContact O-N 3.47Å; I1078-K1108 HydrophobicContact CG1-CD 3.83Å
1079	F	86.7	Confident	68.8	Low	104 Å²	104	91.9 Å²	91.9	46%	0.456	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	117	-179.4	-59.2	-74.8	0	0	0	109.8	F726 L1103 I1104	F726-F1079 HydrophobicContact CB-CZ 4.43Å; F1079-L1103 CarbonylContact C-O 3.54Å; F1079-L1103 WeakPolarHBondContact CA-O 3.33Å; F1079-I1104 HydrophobicContact CD1-CG1 4.31Å; F1079-I1104 HydrophobicContact CE1-CG1 4.09Å
1080	L	81.9	Confident	66	Low	54 Å²	54	101.1 Å²	101.1	28%	0.283	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.9	130.9	175.9	-55.8	172.9	0	0	0	109	P1077 L1103	P1077-L1080 HydrophobicContact CG-CD2 4.29Å; L1080-L1103 HydrophobicContact CB-CB 4.24Å; L1080-L1103 PolarHBondContact N-O 3.45Å; L1080-L1103 PolarHBondContact O-N 3.39Å
1081	K	72	Confident	63.5	Low	192 Å²	192	103.9 Å²	103.9	84%	0.835	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-90.9	131.2	168.6	-65.6	-176.1	179.1	-177.2	0	108.5
1082	M	60.3	Low	60.8	Low	87 Å²	87	106.2 Å²	106.2	43%	0.429	60%	0.597	S	S	.	*	P	Polyproline II helix	trans	-64.4	133	177.9	-71.3	-64.7	-76.4	0	0	111.3	D676 L1103	D676-M1082 WeakPolarHBondContact O-CE 3.39Å; M1082-L1103 HydrophobicContact SD-CD1 3.66Å; M1082-L1103 HydrophobicContact SD-CG 4.49Å
1083	P	48.1	Very low	58.2	Low	111 Å²	111	110.4 Å²	110.4	72%	0.721	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-72.8	129.3	167.7	24.2	-21.9	0	0	0	109.8	S1085	P1083-S1085 PolarHBondContact O-N 3.05Å; P1083-S1085 VanDerWaalsContact O-N 3.07Å
1084	L	39.5	Very low	55.6	Low	159 Å²	159	114.2 Å²	114.2	83%	0.832	66%	0.658	S	S	*	*			trans	-63	104.9	177	-71	160.3	0	0	0	110.4	S1086	L1084-S1086 PolarHBondContact O-N 3.34Å
1085	S	37.2	Very low	53.1	Low	108 Å²	108	113 Å²	113	76%	0.755	66%	0.662	S	S	*	*			trans	-76.9	101.9	165.3	50.6	0	0	0	0	110.2	P1083	P1083-S1085 PolarHBondContact O-N 3.05Å; P1083-S1085 VanDerWaalsContact O-N 3.07Å
1086	S	32.6	Very low	50.5	Low	97 Å²	97	114.2 Å²	114.2	68%	0.678	67%	0.667	S	S	*	*	S	Bend	trans	49.7	94.3	150.7	58.2	0	0	0	0	119.2	L1084	L1084-S1086 PolarHBondContact O-N 3.34Å
1087	Q	36.3	Very low	47.8	Very low	187 Å²	187	119.6 Å²	119.6	87%	0.874	70%	0.695	S	S	*	*			trans	-178.2	115.9	131.4	-99.4	163.3	82.1	0	0	112.5
1088	S	34.2	Very low	45.5	Very low	97 Å²	97	123.5 Å²	123.5	68%	0.678	71%	0.711	S	S	*	*			trans	45.9	114.2	140.4	57	0	0	0	0	122.5
1089	S	33.7	Very low	43.6	Very low	107 Å²	107	131.7 Å²	131.7	75%	0.748	75%	0.748	S	S	*	*			trans	60.6	112.6	133.4	44.3	0	0	0	0	121.3
1090	E	33.1	Very low	41.8	Very low	194 Å²	194	134.4 Å²	134.4	91%	0.907	76%	0.76	S	S	*	*			trans	25.9	109.4	131.5	-62.4	176.6	-178.7	0	0	118.4
1091	A	38.6	Very low	40.4	Very low	104 Å²	104	135.5 Å²	135.5	86%	0.86	77%	0.77	S	S	*	*			trans	-173.4	131.4	130	0	0	0	0	0	110.5
1092	E	33.5	Very low	40.5	Very low	192 Å²	192	129.8 Å²	129.8	90%	0.897	75%	0.752	S	S	*	*			trans	-60.2	137.2	173.8	-60.1	168.9	151.9	0	0	111.7
1093	S	36.7	Very low	41.9	Very low	115 Å²	115	125.8 Å²	125.8	80%	0.804	73%	0.732	S	S	*	*			trans	-174.6	125.8	135	36.3	0	0	0	0	111.2
1094	S	33	Very low	44	Very low	109 Å²	109	120.9 Å²	120.9	76%	0.762	70%	0.699	S	S	*	*			trans	-49.5	126.3	167.9	47.6	0	0	0	0	112.8
1095	T	33.6	Very low	46.5	Very low	137 Å²	137	113.8 Å²	113.8	84%	0.84	66%	0.663	S	S	*	*			trans	-179.1	126.6	134.6	33.6	0	0	0	0	110.5
1096	A	32.2	Very low	49.1	Very low	82 Å²	82	108.8 Å²	108.8	68%	0.678	63%	0.628	S	S	*	*			trans	61.2	96.4	158.4	0	0	0	0	0	120.2	L1098	A1096-L1098 PolarHBondContact O-N 3.42Å
1097	D	29.7	Very low	51.8	Low	167 Å²	167	104.9 Å²	104.9	89%	0.893	60%	0.602	S	S	*	*				27.1	86.5	129.8	-55.9	-27.3	0	0	0	118.1
1098	L	37.3	Very low	54.4	Low	165 Å²	165	96.5 Å²	96.5	86%	0.864	56%	0.562	S	S	*	*			trans	-129.7	93.2	159.8	-92.2	143.4	0	0	0	107.8	A1096 K1100	A1096-L1098 PolarHBondContact O-N 3.42Å; L1098-K1100 PolarHBondContact O-N 3.38Å
1099	E	44.8	Very low	57.2	Low	197 Å²	197	92 Å²	92	92%	0.921	53%	0.531	S	S	*	.			trans	-61.3	105.4	175.4	-71.6	-173.2	154.4	0	0	109.5
1100	K	48.7	Very low	60	Low	162 Å²	162	88.6 Å²	88.6	70%	0.704	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-56.3	136.8	174.5	-72.5	178.5	177.5	179.7	0	109.9	L1098 T1102	L1098-K1100 PolarHBondContact O-N 3.38Å; K1100-T1102 PolarHBondContact O-N 2.97Å
1101	P	54	Low	62.7	Low	76 Å²	76	84.2 Å²	84.2	49%	0.494	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-58.8	127	-176	22.6	-31.7	0	0	0	110.5
1102	T	74	Confident	65.3	Low	73 Å²	73	79.4 Å²	79.4	45%	0.448	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-95.6	124.9	177	51.5	0	0	0	0	109.1	K1100	K1100-T1102 PolarHBondContact O-N 2.97Å
1103	L	88.9	Confident	68.1	Low	2 Å²	2	70.8 Å²	70.8	1%	0.01	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	133.4	178.6	-63.8	179.4	0	0	0	109.9	E677 V680 T697 F1079 L1080 M1082	E677-L1103 WeakPolarHBondContact O-CD2 3.47Å; V680-L1103 HydrophobicContact CG2-CD1 3.78Å; T697-L1103 HydrophobicContact CG2-CD2 4.06Å; F1079-L1103 CarbonylContact C-O 3.54Å; F1079-L1103 WeakPolarHBondContact CA-O 3.33Å; L1080-L1103 HydrophobicContact CB-CB 4.24Å; L1080-L1103 PolarHBondContact N-O 3.45Å; L1080-L1103 PolarHBondContact O-N 3.39Å; M1082-L1103 HydrophobicContact SD-CD1 3.66Å; M1082-L1103 HydrophobicContact SD-CG 4.49Å
1104	I	91.9	Very high	70.8	Confident	8 Å²	8	69.1 Å²	69.1	4%	0.041	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	122	173.9	-62	158.9	0	0	0	108.5	G695 A696 L698 L701 F726 I1078 F1079 F1106	G695-I1104 CarbonylContact C-O 3.46Å; G695-I1104 WeakPolarHBondContact CA-O 3.5Å; A696-I1104 PolarHBondContact N-O 3.46Å; A696-I1104 VanDerWaalsContact N-O 3.08Å; A696-I1104 WeakPolarHBondContact O-CB 3.36Å; A696-I1104 PolarHBondContact O-N 3.37Å; L698-I1104 HydrophobicContact CB-CD1 3.99Å; L698-I1104 HydrophobicContact CD1-CD1 4.44Å; L701-I1104 HydrophobicContact CD1-CB 4.01Å; L701-I1104 HydrophobicContact CD1-CD1 3.9Å; L701-I1104 HydrophobicContact CD1-CG2 4.04Å; F726-I1104 HydrophobicContact CB-CD1 4.2Å; F726-I1104 HydrophobicContact CB-CG1 4.34Å; F726-I1104 HydrophobicContact CB-CG2 4.22Å; F726-I1104 HydrophobicContact CD1-CG2 3.63Å; F726-I1104 HydrophobicContact CD2-CD1 3.7Å; F726-I1104 HydrophobicContact CD2-CG2 4.24Å; F726-I1104 HydrophobicContact CE1-CG2 3.96Å; F726-I1104 HydrophobicContact CE2-CD1 4.29Å; F726-I1104 HydrophobicContact CG-CD1 4.06Å; F726-I1104 HydrophobicContact CG-CG1 4.44Å; F726-I1104 HydrophobicContact CG-CG2 3.78Å; F726-I1104 HydrophobicContact CZ-CG2 4.39Å; I1078-I1104 CarbonylContact O-C 3.52Å; I1078-I1104 WeakPolarHBondContact O-CA 3.43Å; F1079-I1104 HydrophobicContact CD1-CG1 4.31Å; F1079-I1104 HydrophobicContact CE1-CG1 4.09Å; I1104-F1106 PolarHBondContact O-N 3.28Å
1105	S	92	Very high	73.6	Confident	11 Å²	11	64.9 Å²	64.9	8%	0.077	35%	0.352	C	S	.	.			trans	-70	88.9	176.5	-174.9	0	0	0	0	110.8	P1077 I1078 A1107 K1108 C1109	P1077-S1105 WeakPolarHBondContact O-CB 3.44Å; I1078-S1105 WeakPolarHBondContact O-CB 3.22Å; I1078-S1105 PolarHBondContact O-N 3.47Å; S1105-A1107 VanDerWaalsContact C-N 3.28Å; S1105-A1107 PolarHBondContact O-N 3.5Å; S1105-K1108 WeakPolarHBondContact O-CB 3.11Å; S1105-K1108 PolarHBondContact O-N 2.99Å; S1105-C1109 PolarHBondContact O-N 3.21Å; S1105-C1109 PolarHBondContact O-SG 3.42Å
1106	F	91.8	Very high	76.4	Confident	3 Å²	3	58.4 Å²	58.4	1%	0.013	31%	0.312	C	S	.	.	H	α-helix	trans	-71.9	-24.6	176.7	-157.7	-103	0	0	0	112.3	V693 R694 L701 F715 T718 F719 I1104 K1108 C1109 R1110	V693-F1106 HydrophobicContact CG1-CB 4.27Å; R694-F1106 PolarHBondContact O-N 3.33Å; L701-F1106 HydrophobicContact CD1-CD2 4.33Å; L701-F1106 HydrophobicContact CD2-CB 4.17Å; L701-F1106 HydrophobicContact CD2-CD2 3.8Å; L701-F1106 HydrophobicContact CD2-CE2 4.45Å; L701-F1106 HydrophobicContact CD2-CG 4.05Å; F715-F1106 HydrophobicContact CD1-CZ 4.43Å; F715-F1106 AromaticContact CD2-CD1 3.99Å; F715-F1106 HydrophobicContact CD2-CD1 3.99Å; F715-F1106 AromaticContact CD2-CE1 3.28Å; F715-F1106 HydrophobicContact CD2-CE1 3.28Å; F715-F1106 AromaticContact CD2-CZ 3.7Å; F715-F1106 HydrophobicContact CD2-CZ 3.7Å; F715-F1106 HydrophobicContact CE1-CZ 4.28Å; F715-F1106 AromaticContact CE2-CD1 3.6Å; F715-F1106 HydrophobicContact CE2-CD1 3.6Å; F715-F1106 HydrophobicContact CE2-CD2 4.41Å; F715-F1106 AromaticContact CE2-CE1 3.24Å; F715-F1106 HydrophobicContact CE2-CE1 3.24Å; F715-F1106 HydrophobicContact CE2-CE2 4.12Å; F715-F1106 HydrophobicContact CE2-CG 4.17Å; F715-F1106 AromaticContact CE2-CZ 3.52Å; F715-F1106 HydrophobicContact CE2-CZ 3.52Å; F715-F1106 HydrophobicContact CG-CE1 4.1Å; F715-F1106 HydrophobicContact CG-CZ 4.16Å; F715-F1106 HydrophobicContact CZ-CD1 4.46Å; F715-F1106 HydrophobicContact CZ-CE1 4.04Å; F715-F1106 HydrophobicContact CZ-CE2 4.13Å; F715-F1106 AromaticContact CZ-CZ 3.84Å; F715-F1106 HydrophobicContact CZ-CZ 3.84Å; T718-F1106 HydrophobicContact CG2-CE1 3.76Å; T718-F1106 HydrophobicContact CG2-CE2 4.26Å; T718-F1106 HydrophobicContact CG2-CZ 3.54Å; F719-F1106 HydrophobicContact CB-CE2 4.19Å; F719-F1106 HydrophobicContact CB-CZ 4.16Å; F719-F1106 HydrophobicContact CD2-CE2 4.01Å; I1104-F1106 PolarHBondContact O-N 3.28Å; F1106-K1108 VanDerWaalsContact C-N 3.29Å; F1106-K1108 PolarHBondContact O-N 3.31Å; F1106-C1109 HydrophobicContact CD2-CB 4.14Å; F1106-C1109 HydrophobicContact CE2-CB 4.39Å; F1106-C1109 WeakPolarHBondContact O-CB 3.43Å; F1106-C1109 PolarHBondContact O-N 3.17Å; F1106-R1110 WeakPolarHBondContact O-CB 3.45Å; F1106-R1110 PolarHBondContact O-N 3.15Å
1107	A	90.4	Very high	79.2	Confident	15 Å²	15	56.1 Å²	56.1	12%	0.124	30%	0.296	C	S	.	.	H	α-helix	trans	-59.4	-38.2	171.2	0	0	0	0	0	112.5	R694 S1105 K1111	R694-A1107 HydrophobicContact CG-CB 4.13Å; R694-A1107 PolarHBondContact O-N 2.98Å; S1105-A1107 VanDerWaalsContact C-N 3.28Å; S1105-A1107 PolarHBondContact O-N 3.5Å; A1107-K1111 WeakPolarHBondContact O-CG 3.19Å; A1107-K1111 PolarHBondContact O-N 3.33Å
1108	K	90.8	Very high	82.1	Confident	10 Å²	10	51 Å²	51	4%	0.043	27%	0.267	C	S	.	.	H	α-helix	trans	-64.1	-48.6	172.4	178.1	-175.3	176.8	172.4	0	110.9	E1073 N1076 I1078 S1105 F1106 R1110 K1111 I1112	E1073-K1108 PolarHBondContact O-NZ 3.22Å; E1073-K1108 WeakPolarHBondContact OE2-CE 3.42Å; E1073-K1108 IonicContact OE2-NZ 3.67Å; E1073-K1108 PolarHBondContact OE2-NZ 3.17Å; N1076-K1108 HydrophobicContact CB-CB 4.32Å; N1076-K1108 HydrophobicContact CB-CD 3.98Å; N1076-K1108 HydrophobicContact CB-CG 4.12Å; N1076-K1108 VanDerWaalsContact O-CD 3.29Å; N1076-K1108 WeakPolarHBondContact O-CD 3.16Å; N1076-K1108 WeakPolarHBondContact O-CE 3.24Å; N1076-K1108 PolarHBondContact O-NZ 3.41Å; I1078-K1108 HydrophobicContact CG1-CD 3.83Å; S1105-K1108 WeakPolarHBondContact O-CB 3.11Å; S1105-K1108 PolarHBondContact O-N 2.99Å; F1106-K1108 VanDerWaalsContact C-N 3.29Å; F1106-K1108 PolarHBondContact O-N 3.31Å; K1108-R1110 VanDerWaalsContact C-N 3.3Å; K1108-R1110 PolarHBondContact O-N 3.49Å; K1108-K1111 PolarHBondContact O-N 2.93Å; K1108-I1112 HydrophobicContact CG-CD1 4.04Å; K1108-I1112 PolarHBondContact O-N 3.49Å; K1108-I1112 VanDerWaalsContact O-N 3.14Å
1109	C	92	Very high	84.7	Confident	3 Å²	3	43.2 Å²	43.2	2%	0.02	23%	0.226	C	C	.	.	H	α-helix	trans	-56.4	-45	179.5	-64.6	0	0	0	0	111.8	T718 T722 S1105 F1106 I1112 A1113	T718-C1109 HydrophobicContact CG2-CB 4.41Å; T722-C1109 HydrophobicContact CG2-CB 4.25Å; T722-C1109 WeakPolarHBondContact OG1-CB 3.42Å; S1105-C1109 PolarHBondContact O-N 3.21Å; S1105-C1109 PolarHBondContact O-SG 3.42Å; F1106-C1109 HydrophobicContact CD2-CB 4.14Å; F1106-C1109 HydrophobicContact CE2-CB 4.39Å; F1106-C1109 WeakPolarHBondContact O-CB 3.43Å; F1106-C1109 PolarHBondContact O-N 3.17Å; C1109-I1112 PolarHBondContact O-N 3.1Å; C1109-A1113 WeakPolarHBondContact O-CB 3.47Å; C1109-A1113 PolarHBondContact O-N 3.43Å
1110	R	92.2	Very high	86.8	Confident	35 Å²	35	36.5 Å²	36.5	13%	0.132	20%	0.195	C	C	.	.	H	α-helix	trans	-59	-48.2	177.1	-170.9	168.6	63.5	-116.5	2.4	112.7	E682 V693 T718 F1106 K1108 I1112 A1113 D1114	E682-R1110 IonicContact OE1-CZ 2.83Å; E682-R1110 IonicContact OE1-NH1 3.43Å; E682-R1110 IonicContact OE1-NH2 3.45Å; E682-R1110 PolarHBondContact OE1-NH2 2.84Å; E682-R1110 IonicContact OE2-CZ 3.84Å; E682-R1110 IonicContact OE2-NH2 3.84Å; E682-R1110 PolarHBondContact OE2-NH2 3.28Å; V693-R1110 PolarHBondContact O-NH1 3.32Å; T718-R1110 HydrophobicContact CG2-CB 4.12Å; F1106-R1110 WeakPolarHBondContact O-CB 3.45Å; F1106-R1110 PolarHBondContact O-N 3.15Å; K1108-R1110 VanDerWaalsContact C-N 3.3Å; K1108-R1110 PolarHBondContact O-N 3.49Å; R1110-I1112 VanDerWaalsContact C-N 3.32Å; R1110-I1112 PolarHBondContact O-N 3.36Å; R1110-A1113 PolarHBondContact O-N 3.31Å; R1110-D1114 VanDerWaalsContact O-CG 3.25Å; R1110-D1114 PolarHBondContact O-N 3.28Å
1111	K	91.8	Very high	88.7	Confident	102 Å²	102	33.4 Å²	33.4	44%	0.443	18%	0.184	S	C	.	.	H	α-helix	trans	-60.8	-38.8	177.5	-69.5	179.3	-177.9	-179.9	0	112.9	L1072 A1107 K1108 I1115	L1072-K1111 HydrophobicContact CD1-CB 3.9Å; L1072-K1111 HydrophobicContact CD2-CB 4.25Å; L1072-K1111 HydrophobicContact CD2-CD 3.9Å; A1107-K1111 WeakPolarHBondContact O-CG 3.19Å; A1107-K1111 PolarHBondContact O-N 3.33Å; K1108-K1111 PolarHBondContact O-N 2.93Å; K1111-I1115 PolarHBondContact O-N 3.3Å
1112	I	92.7	Very high	90.5	Very high	4 Å²	4	30.2 Å²	30.2	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-69	-44.5	176.5	-66	171	0	0	0	110.3	L1072 E1073 K1108 C1109 R1110 D1114 I1115 I1116	L1072-I1112 HydrophobicContact CB-CG1 4.27Å; L1072-I1112 HydrophobicContact CD1-CG1 4.22Å; E1073-I1112 HydrophobicContact CG-CD1 4.11Å; E1073-I1112 WeakPolarHBondContact OE1-CD1 3.44Å; K1108-I1112 HydrophobicContact CG-CD1 4.04Å; K1108-I1112 PolarHBondContact O-N 3.49Å; K1108-I1112 VanDerWaalsContact O-N 3.14Å; C1109-I1112 PolarHBondContact O-N 3.1Å; R1110-I1112 VanDerWaalsContact C-N 3.32Å; R1110-I1112 PolarHBondContact O-N 3.36Å; I1112-D1114 VanDerWaalsContact C-N 3.31Å; I1112-D1114 PolarHBondContact O-N 2.97Å; I1112-I1115 PolarHBondContact O-N 2.98Å; I1112-I1116 HydrophobicContact CG2-CD1 3.91Å; I1112-I1116 WeakPolarHBondContact O-CG1 3.39Å; I1112-I1116 PolarHBondContact O-N 3.3Å
1113	A	92.6	Very high	91.2	Very high	11 Å²	11	27.7 Å²	27.7	9%	0.091	15%	0.145	C	C	.	.	H	α-helix	trans	-62.5	-36	177.5	0	0	0	0	0	112.5	T718 T722 C1109 R1110 I1115 I1116 G1117	T718-A1113 HydrophobicContact CG2-CB 3.83Å; T722-A1113 HydrophobicContact CG2-CB 4.18Å; C1109-A1113 WeakPolarHBondContact O-CB 3.47Å; C1109-A1113 PolarHBondContact O-N 3.43Å; R1110-A1113 PolarHBondContact O-N 3.31Å; A1113-I1115 VanDerWaalsContact C-N 3.34Å; A1113-I1115 PolarHBondContact O-N 3.21Å; A1113-I1116 PolarHBondContact O-N 2.87Å; A1113-G1117 PolarHBondContact O-N 3.43Å
1114	D	91.7	Very high	91	Very high	79 Å²	79	34.2 Å²	34.2	42%	0.422	18%	0.18	S	C	.	.	H	α-helix	trans	-61.8	-41.2	175.5	-70.3	-26.9	0	0	0	111.4	R1110 I1112 G1117 E1118	R1110-D1114 VanDerWaalsContact O-CG 3.25Å; R1110-D1114 PolarHBondContact O-N 3.28Å; I1112-D1114 VanDerWaalsContact C-N 3.31Å; I1112-D1114 PolarHBondContact O-N 2.97Å; D1114-G1117 PolarHBondContact O-N 3.3Å; D1114-E1118 PolarHBondContact O-N 2.97Å
1115	I	92.6	Very high	90.5	Very high	20 Å²	20	36.9 Å²	36.9	10%	0.103	20%	0.197	C	C	.	.	H	α-helix	trans	-65.5	-44.4	175	-64.9	167.7	0	0	0	111	Y1065 N1068 I1069 L1072 K1111 I1112 A1113 G1117 E1118 I1119	Y1065-I1115 HydrophobicContact CD1-CG2 3.72Å; Y1065-I1115 HydrophobicContact CG-CG2 4.31Å; N1068-I1115 HydrophobicContact CB-CD1 3.82Å; I1069-I1115 HydrophobicContact CD1-CG2 4.17Å; I1069-I1115 HydrophobicContact CG1-CD1 4.24Å; I1069-I1115 HydrophobicContact CG1-CG2 4.08Å; L1072-I1115 HydrophobicContact CD1-CD1 3.51Å; K1111-I1115 PolarHBondContact O-N 3.3Å; I1112-I1115 PolarHBondContact O-N 2.98Å; A1113-I1115 VanDerWaalsContact C-N 3.34Å; A1113-I1115 PolarHBondContact O-N 3.21Å; I1115-G1117 VanDerWaalsContact C-N 3.31Å; I1115-G1117 PolarHBondContact O-N 3.08Å; I1115-E1118 WeakPolarHBondContact O-CB 3.21Å; I1115-E1118 PolarHBondContact O-N 3.4Å; I1115-I1119 HydrophobicContact CG2-CD1 4.46Å; I1115-I1119 PolarHBondContact O-N 3.21Å; I1115-I1119 VanDerWaalsContact O-N 3.12Å
1116	I	92.5	Very high	90.2	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-63.9	-39.7	177.7	-66.4	173	0	0	0	110.6	T721 P932 L935 V936 I1112 A1113 E1118 I1119 Q1120	T721-I1116 HydrophobicContact CG2-CB 4.38Å; T721-I1116 HydrophobicContact CG2-CD1 3.77Å; T721-I1116 HydrophobicContact CG2-CG2 4.03Å; P932-I1116 HydrophobicContact CB-CD1 4.49Å; P932-I1116 HydrophobicContact CB-CG2 3.84Å; P932-I1116 HydrophobicContact CG-CG2 3.83Å; L935-I1116 HydrophobicContact CB-CD1 4.32Å; L935-I1116 HydrophobicContact CD1-CG1 4.12Å; V936-I1116 HydrophobicContact CG2-CD1 3.76Å; I1112-I1116 HydrophobicContact CG2-CD1 3.91Å; I1112-I1116 WeakPolarHBondContact O-CG1 3.39Å; I1112-I1116 PolarHBondContact O-N 3.3Å; A1113-I1116 PolarHBondContact O-N 2.87Å; I1116-E1118 VanDerWaalsContact C-N 3.3Å; I1116-E1118 PolarHBondContact O-N 2.84Å; I1116-I1119 WeakPolarHBondContact O-CB 3.12Å; I1116-I1119 PolarHBondContact O-N 2.92Å; I1116-I1119 VanDerWaalsContact O-N 3.15Å; I1116-Q1120 HydrophobicContact CG2-CG 4.39Å; I1116-Q1120 WeakPolarHBondContact O-CG 3.39Å; I1116-Q1120 PolarHBondContact O-N 2.84Å
1117	G	90.3	Very high	89.9	Confident	34 Å²	34	38.8 Å²	38.8	35%	0.351	21%	0.211	S	C	.	.	H	α-helix	trans	-61.4	-38.2	175.6	0	0	0	0	0	112.4	A1113 D1114 I1115 Q1120 M1121	A1113-G1117 PolarHBondContact O-N 3.43Å; D1114-G1117 PolarHBondContact O-N 3.3Å; I1115-G1117 VanDerWaalsContact C-N 3.31Å; I1115-G1117 PolarHBondContact O-N 3.08Å; G1117-Q1120 PolarHBondContact O-N 3.41Å; G1117-M1121 PolarHBondContact O-N 3.03Å
1118	E	90.8	Very high	89.5	Confident	58 Å²	58	40 Å²	40	27%	0.271	22%	0.219	S	C	.	.	H	α-helix	trans	-62.7	-42.9	172.4	-167	-170.4	144.3	0	0	111.7	Y1065 D1114 I1115 I1116 M1121 Y1122	Y1065-E1118 HydrophobicContact CE1-CG 4.4Å; Y1065-E1118 WeakPolarHBondContact CE1-OE1 3.48Å; Y1065-E1118 PolarHBondContact OH-OE1 3.5Å; D1114-E1118 PolarHBondContact O-N 2.97Å; I1115-E1118 WeakPolarHBondContact O-CB 3.21Å; I1115-E1118 PolarHBondContact O-N 3.4Å; I1116-E1118 VanDerWaalsContact C-N 3.3Å; I1116-E1118 PolarHBondContact O-N 2.84Å; E1118-M1121 WeakPolarHBondContact O-CB 3.38Å; E1118-M1121 PolarHBondContact O-N 3.02Å; E1118-Y1122 HydrophobicContact CG-CE2 3.89Å; E1118-Y1122 WeakPolarHBondContact O-CD2 3.43Å
1119	I	92.5	Very high	89.1	Confident	3 Å²	3	41.1 Å²	41.1	2%	0.015	23%	0.225	C	C	.	.	H	α-helix	trans	-59.8	-50.6	175.1	-67.5	166.2	0	0	0	110.3	Y927 L935 F1062 Y1065 I1115 I1116 M1121 Y1122 Q1123	Y927-I1119 HydrophobicContact CE1-CG2 4.34Å; L935-I1119 HydrophobicContact CD1-CD1 3.76Å; F1062-I1119 HydrophobicContact CE1-CD1 4.22Å; F1062-I1119 HydrophobicContact CE2-CG2 4.23Å; F1062-I1119 HydrophobicContact CZ-CD1 3.94Å; F1062-I1119 HydrophobicContact CZ-CG2 4.34Å; Y1065-I1119 HydrophobicContact CD1-CD1 4.47Å; Y1065-I1119 HydrophobicContact CD1-CG1 4.23Å; Y1065-I1119 HydrophobicContact CD2-CD1 4.02Å; Y1065-I1119 HydrophobicContact CD2-CG1 3.68Å; Y1065-I1119 HydrophobicContact CE1-CG1 4.4Å; Y1065-I1119 HydrophobicContact CE2-CG1 3.89Å; Y1065-I1119 HydrophobicContact CG-CD1 3.89Å; Y1065-I1119 HydrophobicContact CG-CG1 3.86Å; I1115-I1119 HydrophobicContact CG2-CD1 4.46Å; I1115-I1119 PolarHBondContact O-N 3.21Å; I1115-I1119 VanDerWaalsContact O-N 3.12Å; I1116-I1119 WeakPolarHBondContact O-CB 3.12Å; I1116-I1119 PolarHBondContact O-N 2.92Å; I1116-I1119 VanDerWaalsContact O-N 3.15Å; I1119-M1121 VanDerWaalsContact C-N 3.29Å; I1119-M1121 PolarHBondContact O-N 3.06Å; I1119-Y1122 PolarHBondContact O-N 2.93Å; I1119-Y1122 VanDerWaalsContact O-N 3.08Å; I1119-Q1123 HydrophobicContact CG2-CG 4.34Å; I1119-Q1123 WeakPolarHBondContact O-CG 3.46Å; I1119-Q1123 PolarHBondContact O-N 3.46Å
1120	Q	89.7	Confident	88.5	Confident	55 Å²	55	44.3 Å²	44.3	26%	0.257	24%	0.241	S	C	.	.	H	α-helix	trans	-60.5	-37.9	-178.3	-70.4	-176.7	-54.5	0	0	112.5	I1116 G1117 Y1122 Q1123 D1124	I1116-Q1120 HydrophobicContact CG2-CG 4.39Å; I1116-Q1120 WeakPolarHBondContact O-CG 3.39Å; I1116-Q1120 PolarHBondContact O-N 2.84Å; G1117-Q1120 PolarHBondContact O-N 3.41Å; Q1120-Y1122 PolarHBondContact O-N 3.44Å; Q1120-Q1123 WeakPolarHBondContact O-CB 3.42Å; Q1120-Q1123 PolarHBondContact O-N 2.84Å; Q1120-D1124 PolarHBondContact O-N 3.25Å
1121	M	88.8	Confident	88.2	Confident	98 Å²	98	45.8 Å²	45.8	48%	0.483	25%	0.254	S	S	.	.	H	α-helix	trans	-56.3	-36.9	175.4	-176.3	-172.5	69.9	0	0	112.7	G1117 E1118 I1119	G1117-M1121 PolarHBondContact O-N 3.03Å; E1118-M1121 WeakPolarHBondContact O-CB 3.38Å; E1118-M1121 PolarHBondContact O-N 3.02Å; I1119-M1121 VanDerWaalsContact C-N 3.29Å; I1119-M1121 PolarHBondContact O-N 3.06Å
1122	Y	90	Very high	87.8	Confident	8 Å²	8	43.3 Å²	43.3	3%	0.031	24%	0.244	C	C	.	.	H	α-helix	trans	-83	-15.9	176	-62.5	-62	0	0	0	113.5	L1051 P1056 C1058 P1060 E1118 I1119 Q1120	L1051-Y1122 PolarHBondContact O-OH 2.8Å; P1056-Y1122 HydrophobicContact CG-CD1 4.13Å; P1056-Y1122 HydrophobicContact CG-CE1 4.47Å; C1058-Y1122 WeakPolarHBondContact SG-CD1 3.4Å; P1060-Y1122 HydrophobicContact CG-CD1 4.5Å; P1060-Y1122 HydrophobicContact CG-CD2 3.71Å; P1060-Y1122 HydrophobicContact CG-CE2 4.34Å; P1060-Y1122 HydrophobicContact CG-CG 3.81Å; E1118-Y1122 HydrophobicContact CG-CE2 3.89Å; E1118-Y1122 WeakPolarHBondContact O-CD2 3.43Å; I1119-Y1122 PolarHBondContact O-N 2.93Å; I1119-Y1122 VanDerWaalsContact O-N 3.08Å; Q1120-Y1122 PolarHBondContact O-N 3.44Å
1123	Q	90.4	Very high	87.3	Confident	20 Å²	20	47.3 Å²	47.3	9%	0.093	27%	0.27	C	S	.	.	H	α-helix	trans	-78.2	-26.6	175.7	-67.4	176.9	-37.1	0	0	112.9	Y927 R928 V930 I1119 Q1120 V1125	Y927-Q1123 HydrophobicContact CD1-CG 3.75Å; Y927-Q1123 HydrophobicContact CE1-CG 3.54Å; Y927-Q1123 PolarHBondContact O-NE2 2.85Å; R928-Q1123 HydrophobicContact CG-CB 4.36Å; V930-Q1123 PolarHBondContact O-NE2 3.37Å; I1119-Q1123 HydrophobicContact CG2-CG 4.34Å; I1119-Q1123 WeakPolarHBondContact O-CG 3.46Å; I1119-Q1123 PolarHBondContact O-N 3.46Å; Q1120-Q1123 WeakPolarHBondContact O-CB 3.42Å; Q1120-Q1123 PolarHBondContact O-N 2.84Å; Q1123-V1125 PolarHBondContact O-N 3.32Å
1124	D	82.8	Confident	86.8	Confident	139 Å²	139	49.9 Å²	49.9	74%	0.743	29%	0.285	S	S	*	.	S	Bend	trans	-71.1	-26.9	-171.6	-74.1	-19.5	0	0	0	114.3	Q1120	Q1120-D1124 PolarHBondContact O-N 3.25Å
1125	V	83.3	Confident	86.5	Confident	64 Å²	64	46.2 Å²	46.2	39%	0.388	27%	0.265	S	S	.	.	S	Bend	trans	-106.3	108.8	-175.2	-177.2	0	0	0	0	110.9	F924 P1056 Q1123	F924-V1125 WeakPolarHBondContact CZ-O 3.36Å; P1056-V1125 HydrophobicContact CB-CB 3.7Å; P1056-V1125 HydrophobicContact CB-CG1 3.99Å; P1056-V1125 HydrophobicContact CB-CG2 3.99Å; Q1123-V1125 PolarHBondContact O-N 3.32Å
1126	A	85	Confident	86.2	Confident	42 Å²	42	46.6 Å²	46.6	35%	0.347	27%	0.265	S	S	.	.			trans	-76.9	155.4	-178.2	0	0	0	0	0	114.2	F924	F924-A1126 HydrophobicContact CE1-CB 4.09Å
1127	Y	85.2	Confident	86	Confident	12 Å²	12	51.6 Å²	51.6	5%	0.047	29%	0.288	C	S	.	.			trans	-68.4	141	171.1	-80.6	-89.3	0	0	0	112.3	T920 F924 L996 P1057 C1058 V1059 L1129	T920-Y1127 HydrophobicContact CG2-CD1 4.11Å; T920-Y1127 HydrophobicContact CG2-CD2 4.23Å; T920-Y1127 HydrophobicContact CG2-CE1 3.6Å; T920-Y1127 HydrophobicContact CG2-CE2 3.74Å; T920-Y1127 HydrophobicContact CG2-CG 4.38Å; F924-Y1127 HydrophobicContact CB-CD2 3.8Å; F924-Y1127 HydrophobicContact CB-CE2 3.84Å; F924-Y1127 AromaticContact CD1-CD2 4Å; F924-Y1127 HydrophobicContact CD1-CD2 4Å; F924-Y1127 AromaticContact CD2-CD2 3.77Å; F924-Y1127 HydrophobicContact CD2-CD2 3.77Å; F924-Y1127 AromaticContact CD2-CE2 3.57Å; F924-Y1127 HydrophobicContact CD2-CE2 3.57Å; F924-Y1127 HydrophobicContact CE2-CD2 4.35Å; F924-Y1127 HydrophobicContact CE2-CE2 4.29Å; F924-Y1127 AromaticContact CG-CD2 3.55Å; F924-Y1127 HydrophobicContact CG-CD2 3.55Å; F924-Y1127 AromaticContact CG-CE2 3.74Å; F924-Y1127 HydrophobicContact CG-CE2 3.74Å; L996-Y1127 HydrophobicContact CB-CE1 4.41Å; L996-Y1127 VanDerWaalsContact O-CE1 3.3Å; L996-Y1127 WeakPolarHBondContact O-CE1 3.29Å; L996-Y1127 PolarHBondContact O-OH 3.3Å; P1057-Y1127 HydrophobicContact CB-CD1 3.94Å; P1057-Y1127 HydrophobicContact CB-CD2 3.92Å; P1057-Y1127 HydrophobicContact CB-CE1 4.01Å; P1057-Y1127 HydrophobicContact CB-CE2 3.99Å; P1057-Y1127 HydrophobicContact CB-CG 3.9Å; P1057-Y1127 HydrophobicContact CG-CD1 3.75Å; P1057-Y1127 HydrophobicContact CG-CE1 3.97Å; P1057-Y1127 HydrophobicContact CG-CG 4.09Å; C1058-Y1127 WeakPolarHBondContact CA-OH 3.48Å; V1059-Y1127 HydrophobicContact CG2-CE2 3.73Å; V1059-Y1127 PolarHBondContact N-OH 3.11Å; Y1127-L1129 HydrophobicContact CD1-CD1 4.09Å; Y1127-L1129 HydrophobicContact CG-CD1 4.46Å; Y1127-L1129 PolarHBondContact O-N 3.15Å; Y1127-L1129 VanDerWaalsContact O-N 3.14Å
1128	C	82.4	Confident	85.8	Confident	42 Å²	42	50.7 Å²	50.7	28%	0.284	28%	0.275	S	S	.	.	S	Bend	trans	-89.3	54.2	175.7	-157.8	0	0	0	0	111.3	L875 L879 A880	L875-C1128 HydrophobicContact CD2-CB 4.05Å; L875-C1128 WeakPolarHBondContact CD2-SG 3.44Å; L879-C1128 PolarHBondContact O-SG 3.01Å; A880-C1128 WeakPolarHBondContact CA-SG 3.48Å
1129	L	81.4	Confident	85.8	Confident	32 Å²	32	48.1 Å²	48.1	17%	0.168	26%	0.263	C	S	.	.			trans	-128.7	152	-177.2	-59.9	173.1	0	0	0	109.6	R917 L921 L996 Y1127	R917-L1129 HydrophobicContact CB-CD1 4.18Å; R917-L1129 HydrophobicContact CG-CD1 4.05Å; R917-L1129 HydrophobicContact CG-CD2 4.09Å; L921-L1129 HydrophobicContact CD1-CB 3.8Å; L921-L1129 HydrophobicContact CD2-CB 3.99Å; L921-L1129 HydrophobicContact CG-CB 3.99Å; L921-L1129 HydrophobicContact CG-CD1 4.35Å; L996-L1129 HydrophobicContact CD1-CD1 4.46Å; L996-L1129 HydrophobicContact CD2-CD1 4.25Å; Y1127-L1129 HydrophobicContact CD1-CD1 4.09Å; Y1127-L1129 HydrophobicContact CG-CD1 4.46Å; Y1127-L1129 PolarHBondContact O-N 3.15Å; Y1127-L1129 VanDerWaalsContact O-N 3.14Å
1130	I	80.8	Confident	85.7	Confident	70 Å²	70	52.8 Å²	52.8	36%	0.359	29%	0.285	S	S	.	.			trans	-97.4	133.7	-178.5	-68.3	163	0	0	0	109.6	P883 Q918 L921 E1132	P883-I1130 HydrophobicContact CG-CB 4.23Å; P883-I1130 HydrophobicContact CG-CD1 3.58Å; P883-I1130 HydrophobicContact CG-CG1 4.5Å; P883-I1130 HydrophobicContact CG-CG2 4.3Å; Q918-I1130 PolarHBondContact NE2-O 3.18Å; L921-I1130 WeakPolarHBondContact CD1-O 3.36Å; I1130-E1132 PolarHBondContact O-N 3.43Å
1131	V	85	Confident	85.6	Confident	66 Å²	66	53.1 Å²	53.1	40%	0.4	29%	0.293	S	S	.	.			trans	-73.4	124.3	175.1	-179.6	0	0	0	0	108.9	L921 P1133 R1136	L921-V1131 HydrophobicContact CD1-CG2 4.02Å; V1131-P1133 WeakPolarHBondContact O-CD 3.12Å; V1131-R1136 HydrophobicContact CG1-CB 4.06Å; V1131-R1136 HydrophobicContact CG1-CG 4.07Å
1132	E	83.1	Confident	85.5	Confident	51 Å²	51	49.2 Å²	49.2	24%	0.238	27%	0.274	C	S	.	.			trans	-96.4	105.6	170.8	175	46.4	-131.9	0	0	108.7	Q918 I1130 T1134 I1135 R1136	Q918-E1132 VanDerWaalsContact CD-N 3.34Å; Q918-E1132 HydrophobicContact CG-CB 4.35Å; I1130-E1132 PolarHBondContact O-N 3.43Å; E1132-T1134 VanDerWaalsContact C-N 3.26Å; E1132-T1134 PolarHBondContact O-N 3.2Å; E1132-T1134 VanDerWaalsContact O-N 3.14Å; E1132-T1134 PolarHBondContact OE1-N 3.41Å; E1132-T1134 PolarHBondContact OE1-OG1 2.94Å; E1132-I1135 HydrophobicContact CB-CB 4.43Å; E1132-I1135 HydrophobicContact CB-CD1 4.26Å; E1132-I1135 HydrophobicContact CG-CB 4.17Å; E1132-I1135 HydrophobicContact CG-CD1 3.72Å; E1132-I1135 HydrophobicContact CG-CG1 3.81Å; E1132-I1135 PolarHBondContact O-N 3.18Å; E1132-R1136 WeakPolarHBondContact O-CB 3.24Å; E1132-R1136 PolarHBondContact O-N 2.96Å
1133	P	83	Confident	85.3	Confident	87 Å²	87	52.9 Å²	52.9	57%	0.565	29%	0.294	S	S	*	.	H	α-helix	trans	-58.7	-34.5	-167.3	-26.2	35.1	0	0	0	114	V1131 H1137	V1131-P1133 WeakPolarHBondContact O-CD 3.12Å; P1133-H1137 VanDerWaalsContact O-CB 3.32Å; P1133-H1137 WeakPolarHBondContact O-CB 3.29Å; P1133-H1137 PolarHBondContact O-N 3Å
1134	T	81.3	Confident	85	Confident	65 Å²	65	52.2 Å²	52.2	40%	0.399	29%	0.291	S	S	.	.	H	α-helix	trans	-70.1	-43	-177.3	57.6	0	0	0	0	112.6	E1132 F1138	E1132-T1134 VanDerWaalsContact C-N 3.26Å; E1132-T1134 PolarHBondContact O-N 3.2Å; E1132-T1134 VanDerWaalsContact O-N 3.14Å; E1132-T1134 PolarHBondContact OE1-N 3.41Å; E1132-T1134 PolarHBondContact OE1-OG1 2.94Å; T1134-F1138 PolarHBondContact O-N 3.5Å
1135	I	84.9	Confident	85	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.015	27%	0.271	C	S	.	.	H	α-helix	trans	-73.1	-40.7	178	-60.3	175	0	0	0	110	L910 E914 Q918 E1132 H1137 F1138 F1139	L910-I1135 HydrophobicContact CD1-CG1 4.46Å; L910-I1135 HydrophobicContact CD1-CG2 4.05Å; L910-I1135 HydrophobicContact CD2-CD1 3.9Å; L910-I1135 HydrophobicContact CD2-CG1 3.89Å; E914-I1135 HydrophobicContact CB-CD1 4.47Å; E914-I1135 HydrophobicContact CG-CD1 3.47Å; E914-I1135 VanDerWaalsContact CG-CD1 3.47Å; Q918-I1135 HydrophobicContact CB-CG2 3.75Å; Q918-I1135 HydrophobicContact CG-CB 4.02Å; Q918-I1135 HydrophobicContact CG-CG2 3.65Å; E1132-I1135 HydrophobicContact CB-CB 4.43Å; E1132-I1135 HydrophobicContact CB-CD1 4.26Å; E1132-I1135 HydrophobicContact CG-CB 4.17Å; E1132-I1135 HydrophobicContact CG-CD1 3.72Å; E1132-I1135 HydrophobicContact CG-CG1 3.81Å; E1132-I1135 PolarHBondContact O-N 3.18Å; I1135-H1137 PolarHBondContact O-N 3.02Å; I1135-F1138 WeakPolarHBondContact O-CB 3.3Å; I1135-F1138 PolarHBondContact O-N 3.32Å; I1135-F1139 HydrophobicContact CG2-CD2 3.7Å; I1135-F1139 HydrophobicContact CG2-CE2 3.42Å; I1135-F1139 VanDerWaalsContact CG2-CE2 3.42Å; I1135-F1139 VanDerWaalsContact O-CD2 3.29Å; I1135-F1139 WeakPolarHBondContact O-CD2 3.29Å; I1135-F1139 PolarHBondContact O-N 3.2Å; I1135-F1139 VanDerWaalsContact O-N 3.14Å
1136	R	87	Confident	84.9	Confident	27 Å²	27	51.9 Å²	51.9	10%	0.102	28%	0.283	C	S	.	.	H	α-helix	trans	-56.9	-50.9	175.6	-178.7	64.7	176.4	-126.3	-2.3	111.5	L921 L922 D925 V1131 E1132 F1138 F1139 E1140	L921-R1136 VanDerWaalsContact C-NH1 3.25Å; L921-R1136 PolarHBondContact O-NH1 3.08Å; L922-R1136 VanDerWaalsContact CD1-CZ 3.47Å; D925-R1136 IonicContact OD2-CZ 2.83Å; D925-R1136 IonicContact OD2-NH1 2.91Å; D925-R1136 PolarHBondContact OD2-NH1 3.07Å; D925-R1136 IonicContact OD2-NH2 3.07Å; D925-R1136 PolarHBondContact OD2-NH2 2.87Å; V1131-R1136 HydrophobicContact CG1-CB 4.06Å; V1131-R1136 HydrophobicContact CG1-CG 4.07Å; E1132-R1136 WeakPolarHBondContact O-CB 3.24Å; E1132-R1136 PolarHBondContact O-N 2.96Å; R1136-F1138 VanDerWaalsContact C-N 3.27Å; R1136-F1138 PolarHBondContact O-N 3Å; R1136-F1139 PolarHBondContact O-N 3.44Å; R1136-E1140 IonicContact CZ-OE1 3.51Å; R1136-E1140 IonicContact NE-OE1 2.97Å; R1136-E1140 PolarHBondContact NE-OE1 3.49Å; R1136-E1140 IonicContact NH2-OE1 3.28Å; R1136-E1140 WeakPolarHBondContact O-CG 3.48Å; R1136-E1140 PolarHBondContact O-N 2.97Å
1137	H	88.2	Confident	84.6	Confident	108 Å²	108	53.7 Å²	53.7	50%	0.5	31%	0.305	S	S	.	.	H	α-helix	trans	-60.2	-37.1	178.5	-175.7	66.6	0	0	0	112.6	P1133 I1135 E1140 S1141	P1133-H1137 VanDerWaalsContact O-CB 3.32Å; P1133-H1137 WeakPolarHBondContact O-CB 3.29Å; P1133-H1137 PolarHBondContact O-N 3Å; I1135-H1137 PolarHBondContact O-N 3.02Å; H1137-E1140 PolarHBondContact O-N 3.04Å; H1137-S1141 VanDerWaalsContact O-CB 3.25Å; H1137-S1141 WeakPolarHBondContact O-CB 3.49Å; H1137-S1141 PolarHBondContact O-N 3.49Å; H1137-S1141 PolarHBondContact O-OG 2.83Å
1138	F	87.2	Confident	84.6	Confident	15 Å²	15	55.5 Å²	55.5	7%	0.066	31%	0.314	C	S	.	.	H	α-helix	trans	-59.8	-51.2	175.7	168.1	-102.8	0	0	0	111.8	F905 W965 T1134 I1135 R1136 E1140 S1141 L1142	F905-F1138 HydrophobicContact CB-CD1 4.28Å; F905-F1138 HydrophobicContact CB-CD2 4.09Å; F905-F1138 HydrophobicContact CB-CE1 4.22Å; F905-F1138 HydrophobicContact CB-CE2 4.03Å; F905-F1138 HydrophobicContact CB-CG 4.22Å; F905-F1138 HydrophobicContact CB-CZ 4.1Å; F905-F1138 HydrophobicContact CD2-CB 3.63Å; F905-F1138 HydrophobicContact CD2-CD1 4.26Å; F905-F1138 AromaticContact CD2-CD2 3.89Å; F905-F1138 HydrophobicContact CD2-CD2 3.89Å; F905-F1138 AromaticContact CD2-CG 3.66Å; F905-F1138 HydrophobicContact CD2-CG 3.66Å; F905-F1138 HydrophobicContact CE2-CB 4.09Å; F905-F1138 HydrophobicContact CG-CG 4.44Å; F905-F1138 VanDerWaalsContact O-CE2 3.29Å; F905-F1138 WeakPolarHBondContact O-CE2 3.47Å; F905-F1138 WeakPolarHBondContact O-CZ 3.42Å; W965-F1138 HydrophobicContact CZ2-CE1 4.2Å; W965-F1138 HydrophobicContact CZ2-CZ 4.07Å; T1134-F1138 PolarHBondContact O-N 3.5Å; I1135-F1138 WeakPolarHBondContact O-CB 3.3Å; I1135-F1138 PolarHBondContact O-N 3.32Å; R1136-F1138 VanDerWaalsContact C-N 3.27Å; R1136-F1138 PolarHBondContact O-N 3Å; F1138-E1140 PolarHBondContact O-N 3.04Å; F1138-S1141 PolarHBondContact O-N 3.23Å; F1138-S1141 VanDerWaalsContact O-N 3.15Å; F1138-S1141 PolarHBondContact O-OG 3.48Å; F1138-L1142 HydrophobicContact CE1-CD2 4.38Å; F1138-L1142 HydrophobicContact CZ-CD2 4.1Å; F1138-L1142 PolarHBondContact O-N 3.18Å
1139	F	90.8	Very high	84.5	Confident	3 Å²	3	59.4 Å²	59.4	1%	0.013	34%	0.341	C	S	.	.	H	α-helix	trans	-67	-35.6	-179.7	-71.1	-59.6	0	0	0	113	L910 I915 Q918 I919 L922 F962 W965 I1135 R1136 S1141 L1142	L910-F1139 HydrophobicContact CD1-CE2 4.36Å; L910-F1139 HydrophobicContact CD1-CZ 4.28Å; I915-F1139 HydrophobicContact CB-CZ 4.31Å; I915-F1139 HydrophobicContact CG1-CZ 4.2Å; I915-F1139 HydrophobicContact CG2-CE1 4.47Å; I915-F1139 HydrophobicContact CG2-CE2 4.36Å; I915-F1139 HydrophobicContact CG2-CZ 3.72Å; Q918-F1139 HydrophobicContact CB-CD2 4.49Å; I919-F1139 HydrophobicContact CD1-CB 3.83Å; I919-F1139 HydrophobicContact CD1-CD1 3.47Å; I919-F1139 VanDerWaalsContact CD1-CD1 3.47Å; I919-F1139 HydrophobicContact CD1-CD2 3.82Å; I919-F1139 HydrophobicContact CD1-CE1 3.93Å; I919-F1139 HydrophobicContact CD1-CE2 4.23Å; I919-F1139 HydrophobicContact CD1-CG 3.43Å; I919-F1139 VanDerWaalsContact CD1-CG 3.43Å; I919-F1139 HydrophobicContact CD1-CZ 4.3Å; I919-F1139 HydrophobicContact CG1-CD1 4.3Å; I919-F1139 HydrophobicContact CG1-CD2 4.17Å; I919-F1139 HydrophobicContact CG1-CE1 4.31Å; I919-F1139 HydrophobicContact CG1-CE2 4.16Å; I919-F1139 HydrophobicContact CG1-CG 4.25Å; I919-F1139 HydrophobicContact CG1-CZ 4.26Å; L922-F1139 HydrophobicContact CD2-CB 3.94Å; F962-F1139 HydrophobicContact CD2-CD1 4.48Å; F962-F1139 HydrophobicContact CE2-CD1 4.41Å; F962-F1139 HydrophobicContact CE2-CE1 4.11Å; W965-F1139 HydrophobicContact CH2-CE1 4.16Å; W965-F1139 HydrophobicContact CZ3-CE1 4.12Å; I1135-F1139 HydrophobicContact CG2-CD2 3.7Å; I1135-F1139 HydrophobicContact CG2-CE2 3.42Å; I1135-F1139 VanDerWaalsContact CG2-CE2 3.42Å; I1135-F1139 VanDerWaalsContact O-CD2 3.29Å; I1135-F1139 WeakPolarHBondContact O-CD2 3.29Å; I1135-F1139 PolarHBondContact O-N 3.2Å; I1135-F1139 VanDerWaalsContact O-N 3.14Å; R1136-F1139 PolarHBondContact O-N 3.44Å; F1139-S1141 VanDerWaalsContact C-N 3.29Å; F1139-S1141 PolarHBondContact O-N 3.5Å; F1139-L1142 HydrophobicContact CD1-CD1 3.75Å; F1139-L1142 HydrophobicContact CD1-CG 4.4Å; F1139-L1142 WeakPolarHBondContact O-CB 3.36Å; F1139-L1142 WeakPolarHBondContact O-CG 2.89Å; F1139-L1142 PolarHBondContact O-N 2.77Å
1140	E	89.3	Confident	84.8	Confident	102 Å²	102	60 Å²	60	48%	0.477	35%	0.348	S	S	.	.	H	α-helix	trans	-64	-33.5	172.1	-72	174	174.5	0	0	112.8	L922 R1136 H1137 F1138 L1142	L922-E1140 HydrophobicContact CD1-CG 3.92Å; L922-E1140 HydrophobicContact CD2-CG 4.02Å; R1136-E1140 IonicContact CZ-OE1 3.51Å; R1136-E1140 IonicContact NE-OE1 2.97Å; R1136-E1140 PolarHBondContact NE-OE1 3.49Å; R1136-E1140 IonicContact NH2-OE1 3.28Å; R1136-E1140 WeakPolarHBondContact O-CG 3.48Å; R1136-E1140 PolarHBondContact O-N 2.97Å; H1137-E1140 PolarHBondContact O-N 3.04Å; F1138-E1140 PolarHBondContact O-N 3.04Å; E1140-L1142 VanDerWaalsContact C-N 3.33Å
1141	S	87.7	Confident	85	Confident	62 Å²	62	61.5 Å²	61.5	43%	0.434	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	0.9	-178.9	76.7	0	0	0	0	114.7	H1137 F1138 F1139 N1143	H1137-S1141 VanDerWaalsContact O-CB 3.25Å; H1137-S1141 WeakPolarHBondContact O-CB 3.49Å; H1137-S1141 PolarHBondContact O-N 3.49Å; H1137-S1141 PolarHBondContact O-OG 2.83Å; F1138-S1141 PolarHBondContact O-N 3.23Å; F1138-S1141 VanDerWaalsContact O-N 3.15Å; F1138-S1141 PolarHBondContact O-OG 3.48Å; F1139-S1141 VanDerWaalsContact C-N 3.29Å; F1139-S1141 PolarHBondContact O-N 3.5Å; S1141-N1143 PolarHBondContact O-N 3.08Å
1142	L	86.8	Confident	85.2	Confident	16 Å²	16	63.8 Å²	63.8	8%	0.084	36%	0.362	C	S	.	.			trans	-58.3	127.2	-179.2	-78.8	179.3	0	0	0	111.9	F962 W965 F1138 F1139 E1140	F962-L1142 HydrophobicContact CD2-CD1 4.21Å; W965-L1142 HydrophobicContact CB-CD1 4.31Å; W965-L1142 HydrophobicContact CB-CD2 4.42Å; W965-L1142 HydrophobicContact CD2-CD1 4.27Å; W965-L1142 HydrophobicContact CD2-CD2 4.14Å; W965-L1142 HydrophobicContact CE3-CD1 4.5Å; W965-L1142 HydrophobicContact CG-CD1 4.18Å; W965-L1142 HydrophobicContact CG-CD2 3.79Å; F1138-L1142 HydrophobicContact CE1-CD2 4.38Å; F1138-L1142 HydrophobicContact CZ-CD2 4.1Å; F1138-L1142 PolarHBondContact O-N 3.18Å; F1139-L1142 HydrophobicContact CD1-CD1 3.75Å; F1139-L1142 HydrophobicContact CD1-CG 4.4Å; F1139-L1142 WeakPolarHBondContact O-CB 3.36Å; F1139-L1142 WeakPolarHBondContact O-CG 2.89Å; F1139-L1142 PolarHBondContact O-N 2.77Å; E1140-L1142 VanDerWaalsContact C-N 3.33Å
1143	N	86.5	Confident	85.6	Confident	85 Å²	85	64.8 Å²	64.8	46%	0.455	37%	0.369	S	S	.	.			trans	-139.3	78.9	175.6	-169.6	7.5	0	0	0	111.7	S1141 L1145 Q1146	S1141-N1143 PolarHBondContact O-N 3.08Å; N1143-L1145 PolarHBondContact O-N 3.43Å; N1143-Q1146 WeakPolarHBondContact O-CB 3.41Å; N1143-Q1146 PolarHBondContact O-N 3.03Å
1144	P	84.3	Confident	85.9	Confident	5 Å²	5	60.7 Å²	60.7	3%	0.032	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-23.3	179.6	27.3	-36.8	0	0	0	113.6	K961 Q1146 L1154	K961-P1144 HydrophobicContact CB-CG 4.2Å; K961-P1144 HydrophobicContact CG-CG 4.36Å; K961-P1144 WeakPolarHBondContact O-CG 3.32Å; P1144-Q1146 PolarHBondContact O-N 3.3Å; P1144-L1154 HydrophobicContact CB-CD2 4.49Å
1145	L	82.5	Confident	86.4	Confident	61 Å²	61	61.4 Å²	61.4	32%	0.319	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-6.1	177.5	-71.1	161.4	0	0	0	113.3	N1143 G1147 F1148 K1151 L1154	N1143-L1145 PolarHBondContact O-N 3.43Å; L1145-G1147 PolarHBondContact O-N 3.03Å; L1145-F1148 PolarHBondContact O-N 2.87Å; L1145-K1151 HydrophobicContact CD2-CB 4.5Å; L1145-L1154 HydrophobicContact CD2-CB 4.18Å; L1145-L1154 HydrophobicContact CD2-CD2 3.82Å; L1145-L1154 HydrophobicContact CG-CD2 4.27Å
1146	Q	81.7	Confident	86.8	Confident	135 Å²	135	64.1 Å²	64.1	63%	0.631	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	115.2	178.7	-172	177.5	24.3	0	0	110.8	N1143 P1144	N1143-Q1146 WeakPolarHBondContact O-CB 3.41Å; N1143-Q1146 PolarHBondContact O-N 3.03Å; P1144-Q1146 PolarHBondContact O-N 3.3Å
1147	G	77.5	Confident	87.1	Confident	80 Å²	80	65.5 Å²	65.5	83%	0.825	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.3	-3.2	-178.7	0	0	0	0	0	115.2	L1145	L1145-G1147 PolarHBondContact O-N 3.03Å
1148	F	86.1	Confident	87.3	Confident	51 Å²	51	60.5 Å²	60.5	22%	0.224	35%	0.346	C	S	.	.			trans	-115.7	142.5	178.7	-59	-80.6	0	0	0	110.9	L1145 D1153 L1154 Y1157	L1145-F1148 PolarHBondContact O-N 2.87Å; F1148-D1153 HydrophobicContact CB-CB 4.37Å; F1148-D1153 HydrophobicContact CD1-CB 4.37Å; F1148-L1154 HydrophobicContact CB-CB 4.34Å; F1148-L1154 HydrophobicContact CD2-CB 4.27Å; F1148-L1154 HydrophobicContact CD2-CD1 3.71Å; F1148-L1154 HydrophobicContact CE2-CD1 3.55Å; F1148-L1154 HydrophobicContact CG-CB 4.1Å; F1148-L1154 HydrophobicContact CG-CD1 4.31Å; F1148-L1154 HydrophobicContact CZ-CD1 4.05Å; F1148-Y1157 VanDerWaalsContact CE1-CB 3.45Å; F1148-Y1157 AromaticContact CE1-CD1 3.87Å; F1148-Y1157 HydrophobicContact CE1-CD1 3.87Å; F1148-Y1157 HydrophobicContact CE1-CD2 4.01Å; F1148-Y1157 AromaticContact CE1-CG 3.5Å; F1148-Y1157 HydrophobicContact CE1-CG 3.5Å; F1148-Y1157 VanDerWaalsContact CE1-CG 3.5Å; F1148-Y1157 HydrophobicContact CE2-CD1 4.35Å; F1148-Y1157 AromaticContact CZ-CD1 3.4Å; F1148-Y1157 HydrophobicContact CZ-CD1 3.4Å; F1148-Y1157 HydrophobicContact CZ-CD2 4.07Å; F1148-Y1157 AromaticContact CZ-CE1 3.84Å; F1148-Y1157 HydrophobicContact CZ-CE1 3.84Å; F1148-Y1157 HydrophobicContact CZ-CE2 4.45Å; F1148-Y1157 AromaticContact CZ-CG 3.52Å; F1148-Y1157 HydrophobicContact CZ-CG 3.52Å
1149	S	80.6	Confident	87.6	Confident	123 Å²	123	64 Å²	64	86%	0.86	36%	0.36	S	S	*	.	S	Bend	trans	-76.9	-32.8	-179	-54.2	0	0	0	0	112.3	D1153	S1149-D1153 WeakPolarHBondContact CB-OD2 3.4Å
1150	S	86.6	Confident	87.7	Confident	45 Å²	45	66.6 Å²	66.6	32%	0.315	38%	0.378	S	S	.	.	S	Bend	trans	-143.4	165	-179.6	73.3	0	0	0	0	112.4	N1152 D1153 L1154	S1150-N1152 PolarHBondContact O-N 3.09Å; S1150-N1152 PolarHBondContact OG-N 2.79Å; S1150-D1153 WeakPolarHBondContact CB-OD2 3.44Å; S1150-D1153 PolarHBondContact N-OD2 2.98Å; S1150-D1153 PolarHBondContact O-N 2.65Å; S1150-D1153 PolarHBondContact OG-N 2.91Å; S1150-D1153 PolarHBondContact OG-OD2 2.98Å; S1150-L1154 PolarHBondContact O-N 3.08Å
1151	K	86.3	Confident	87.8	Confident	102 Å²	102	65.8 Å²	65.8	44%	0.443	37%	0.371	S	S	.	.	H	α-helix	trans	-57.9	-38.2	171.5	171.4	173.9	145.2	135.2	0	111.9	Y964 L1145 D1153 L1154 E1155	Y964-K1151 HydrophobicContact CE2-CD 4.19Å; Y964-K1151 HydrophobicContact CE2-CG 4.23Å; Y964-K1151 WeakPolarHBondContact OH-CD 3.01Å; Y964-K1151 WeakPolarHBondContact OH-CE 3.38Å; Y964-K1151 WeakPolarHBondContact OH-CG 3.49Å; Y964-K1151 PolarHBondContact OH-NZ 3.12Å; L1145-K1151 HydrophobicContact CD2-CB 4.5Å; K1151-D1153 VanDerWaalsContact C-N 3.31Å; K1151-D1153 PolarHBondContact O-N 2.77Å; K1151-L1154 WeakPolarHBondContact O-CB 3.29Å; K1151-L1154 PolarHBondContact O-N 3.25Å; K1151-E1155 WeakPolarHBondContact CE-OE1 3.26Å; K1151-E1155 IonicContact NZ-OE1 3.06Å; K1151-E1155 PolarHBondContact O-N 3.19Å
1152	N	89.2	Confident	88.1	Confident	114 Å²	114	62.9 Å²	62.9	61%	0.61	35%	0.35	S	S	*	.	H	α-helix	trans	-64.7	-36.8	178.4	-63.4	-9.2	0	0	0	111.5	S1150 L1154 E1155 A1156	S1150-N1152 PolarHBondContact O-N 3.09Å; S1150-N1152 PolarHBondContact OG-N 2.79Å; N1152-L1154 VanDerWaalsContact C-N 3.33Å; N1152-E1155 PolarHBondContact O-N 3.21Å; N1152-A1156 VanDerWaalsContact O-CB 3.3Å; N1152-A1156 WeakPolarHBondContact O-CB 2.89Å; N1152-A1156 PolarHBondContact O-N 3.1Å
1153	D	90.5	Very high	88.2	Confident	72 Å²	72	64.7 Å²	64.7	39%	0.385	36%	0.359	S	S	.	.	H	α-helix	trans	-66.9	-37.4	176.5	-56.7	-43.3	0	0	0	111.6	F1148 S1149 S1150 K1151 Y1157	F1148-D1153 HydrophobicContact CB-CB 4.37Å; F1148-D1153 HydrophobicContact CD1-CB 4.37Å; S1149-D1153 WeakPolarHBondContact CB-OD2 3.4Å; S1150-D1153 WeakPolarHBondContact CB-OD2 3.44Å; S1150-D1153 PolarHBondContact N-OD2 2.98Å; S1150-D1153 PolarHBondContact O-N 2.65Å; S1150-D1153 PolarHBondContact OG-N 2.91Å; S1150-D1153 PolarHBondContact OG-OD2 2.98Å; K1151-D1153 VanDerWaalsContact C-N 3.31Å; K1151-D1153 PolarHBondContact O-N 2.77Å; D1153-Y1157 WeakPolarHBondContact O-CB 3.38Å; D1153-Y1157 PolarHBondContact O-N 2.59Å
1154	L	90	Very high	88.3	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-64.2	-49.6	173.6	175.4	64.2	0	0	0	110.8	Y964 P1144 L1145 F1148 S1150 K1151 N1152 A1156 Y1157 L1158	Y964-L1154 HydrophobicContact CD1-CD2 4.13Å; Y964-L1154 HydrophobicContact CD2-CD2 3.99Å; Y964-L1154 HydrophobicContact CE2-CD2 4.49Å; Y964-L1154 HydrophobicContact CG-CD2 3.8Å; P1144-L1154 HydrophobicContact CB-CD2 4.49Å; L1145-L1154 HydrophobicContact CD2-CB 4.18Å; L1145-L1154 HydrophobicContact CD2-CD2 3.82Å; L1145-L1154 HydrophobicContact CG-CD2 4.27Å; F1148-L1154 HydrophobicContact CB-CB 4.34Å; F1148-L1154 HydrophobicContact CD2-CB 4.27Å; F1148-L1154 HydrophobicContact CD2-CD1 3.71Å; F1148-L1154 HydrophobicContact CE2-CD1 3.55Å; F1148-L1154 HydrophobicContact CG-CB 4.1Å; F1148-L1154 HydrophobicContact CG-CD1 4.31Å; F1148-L1154 HydrophobicContact CZ-CD1 4.05Å; S1150-L1154 PolarHBondContact O-N 3.08Å; K1151-L1154 WeakPolarHBondContact O-CB 3.29Å; K1151-L1154 PolarHBondContact O-N 3.25Å; N1152-L1154 VanDerWaalsContact C-N 3.33Å; L1154-A1156 VanDerWaalsContact C-N 3.32Å; L1154-A1156 PolarHBondContact O-N 3.04Å; L1154-Y1157 HydrophobicContact CD1-CD1 4.49Å; L1154-Y1157 WeakPolarHBondContact O-CB 3.39Å; L1154-Y1157 PolarHBondContact O-N 3.21Å; L1154-Y1157 VanDerWaalsContact O-N 3.15Å; L1154-L1158 HydrophobicContact CD1-CD1 4.35Å; L1154-L1158 HydrophobicContact CD1-CD2 4.44Å; L1154-L1158 HydrophobicContact CD1-CG 4.18Å; L1154-L1158 HydrophobicContact CG-CD1 4.12Å; L1154-L1158 HydrophobicContact CG-CG 4.38Å; L1154-L1158 VanDerWaalsContact O-CG 3.27Å; L1154-L1158 WeakPolarHBondContact O-CG 3.26Å; L1154-L1158 PolarHBondContact O-N 2.98Å
1155	E	91.1	Very high	88.6	Confident	80 Å²	80	64.7 Å²	64.7	37%	0.374	36%	0.356	S	S	.	.	H	α-helix	trans	-60.8	-41.2	178.5	-71.8	177.3	173.8	0	0	112	Y964 K1151 N1152 L1158 Y1159	Y964-E1155 HydrophobicContact CE1-CG 3.99Å; Y964-E1155 PolarHBondContact OH-OE1 3.42Å; K1151-E1155 WeakPolarHBondContact CE-OE1 3.26Å; K1151-E1155 IonicContact NZ-OE1 3.06Å; K1151-E1155 PolarHBondContact O-N 3.19Å; N1152-E1155 PolarHBondContact O-N 3.21Å; E1155-L1158 PolarHBondContact O-N 3Å; E1155-Y1159 PolarHBondContact O-N 3.38Å
1156	A	92.6	Very high	88.9	Confident	60 Å²	60	62 Å²	62	50%	0.496	34%	0.342	S	S	.	.	H	α-helix	trans	-62.2	-42.1	173.9	0	0	0	0	0	112.1	N1152 L1154 S1160	N1152-A1156 VanDerWaalsContact O-CB 3.3Å; N1152-A1156 WeakPolarHBondContact O-CB 2.89Å; N1152-A1156 PolarHBondContact O-N 3.1Å; L1154-A1156 VanDerWaalsContact C-N 3.32Å; L1154-A1156 PolarHBondContact O-N 3.04Å; A1156-S1160 VanDerWaalsContact O-CB 3.3Å; A1156-S1160 WeakPolarHBondContact O-CB 3.14Å; A1156-S1160 PolarHBondContact O-N 3.39Å
1157	Y	93.3	Very high	89.1	Confident	57 Å²	57	58 Å²	58	22%	0.224	33%	0.328	C	S	.	.	H	α-helix	trans	-62.6	-46.5	173.8	167.3	-98.1	0	0	0	112.2	E972 F1148 D1153 L1154 Y1159 S1160 R1161	E972-Y1157 PolarHBondContact OE1-OH 3.32Å; F1148-Y1157 VanDerWaalsContact CE1-CB 3.45Å; F1148-Y1157 AromaticContact CE1-CD1 3.87Å; F1148-Y1157 HydrophobicContact CE1-CD1 3.87Å; F1148-Y1157 HydrophobicContact CE1-CD2 4.01Å; F1148-Y1157 AromaticContact CE1-CG 3.5Å; F1148-Y1157 HydrophobicContact CE1-CG 3.5Å; F1148-Y1157 VanDerWaalsContact CE1-CG 3.5Å; F1148-Y1157 HydrophobicContact CE2-CD1 4.35Å; F1148-Y1157 AromaticContact CZ-CD1 3.4Å; F1148-Y1157 HydrophobicContact CZ-CD1 3.4Å; F1148-Y1157 HydrophobicContact CZ-CD2 4.07Å; F1148-Y1157 AromaticContact CZ-CE1 3.84Å; F1148-Y1157 HydrophobicContact CZ-CE1 3.84Å; F1148-Y1157 HydrophobicContact CZ-CE2 4.45Å; F1148-Y1157 AromaticContact CZ-CG 3.52Å; F1148-Y1157 HydrophobicContact CZ-CG 3.52Å; D1153-Y1157 WeakPolarHBondContact O-CB 3.38Å; D1153-Y1157 PolarHBondContact O-N 2.59Å; L1154-Y1157 HydrophobicContact CD1-CD1 4.49Å; L1154-Y1157 WeakPolarHBondContact O-CB 3.39Å; L1154-Y1157 PolarHBondContact O-N 3.21Å; L1154-Y1157 VanDerWaalsContact O-N 3.15Å; Y1157-Y1159 VanDerWaalsContact C-N 3.32Å; Y1157-Y1159 PolarHBondContact O-N 3.17Å; Y1157-S1160 PolarHBondContact O-N 3.11Å; Y1157-R1161 HydrophobicContact CD1-CG 4.41Å; Y1157-R1161 HydrophobicContact CD2-CG 4.01Å; Y1157-R1161 HydrophobicContact CE1-CG 3.99Å; Y1157-R1161 HydrophobicContact CE2-CG 3.54Å; Y1157-R1161 HydrophobicContact CG-CG 4.43Å; Y1157-R1161 WeakPolarHBondContact O-CB 3.27Å; Y1157-R1161 WeakPolarHBondContact O-CG 3.21Å; Y1157-R1161 PolarHBondContact O-N 3.09Å; Y1157-R1161 PolarHBondContact OH-NE 3.31Å
1158	L	93	Very high	89.5	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.01	32%	0.315	C	S	.	.	H	α-helix	trans	-59	-45.4	179.4	-67.5	172.7	0	0	0	110.8	Y964 E967 K968 V971 A1013 L1154 E1155 R1161 S1162	Y964-L1158 HydrophobicContact CD1-CD1 3.96Å; Y964-L1158 HydrophobicContact CE1-CD1 4.47Å; E967-L1158 HydrophobicContact CB-CD1 4.09Å; E967-L1158 HydrophobicContact CB-CD2 4.41Å; K968-L1158 HydrophobicContact CB-CD2 4.13Å; V971-L1158 HydrophobicContact CG2-CD2 3.51Å; A1013-L1158 HydrophobicContact CB-CB 4.21Å; L1154-L1158 HydrophobicContact CD1-CD1 4.35Å; L1154-L1158 HydrophobicContact CD1-CD2 4.44Å; L1154-L1158 HydrophobicContact CD1-CG 4.18Å; L1154-L1158 HydrophobicContact CG-CD1 4.12Å; L1154-L1158 HydrophobicContact CG-CG 4.38Å; L1154-L1158 VanDerWaalsContact O-CG 3.27Å; L1154-L1158 WeakPolarHBondContact O-CG 3.26Å; L1154-L1158 PolarHBondContact O-N 2.98Å; E1155-L1158 PolarHBondContact O-N 3Å; L1158-R1161 PolarHBondContact O-N 3.08Å; L1158-S1162 PolarHBondContact O-N 3.06Å
1159	Y	93.8	Very high	89	Confident	90 Å²	90	66 Å²	66	35%	0.353	35%	0.348	S	S	.	.	H	α-helix	trans	-68	-40.7	176.9	-171.4	-96.4	0	0	0	112.7	E1155 Y1157 S1162 M1163	E1155-Y1159 PolarHBondContact O-N 3.38Å; Y1157-Y1159 VanDerWaalsContact C-N 3.32Å; Y1157-Y1159 PolarHBondContact O-N 3.17Å; Y1159-S1162 WeakPolarHBondContact O-CB 3.18Å; Y1159-S1162 PolarHBondContact O-N 3.37Å; Y1159-M1163 HydrophobicContact CD1-CG 4.18Å; Y1159-M1163 HydrophobicContact CE1-CG 3.82Å; Y1159-M1163 HydrophobicContact CE1-SD 4.3Å; Y1159-M1163 WeakPolarHBondContact O-CG 3.46Å; Y1159-M1163 PolarHBondContact O-N 3.1Å
1160	S	92.8	Very high	88.5	Confident	56 Å²	56	63 Å²	63	39%	0.392	33%	0.325	S	S	.	.	H	α-helix	trans	-60.6	-45.5	174.8	-172.1	0	0	0	0	111.5	A1156 Y1157 S1162 M1163 E1164	A1156-S1160 VanDerWaalsContact O-CB 3.3Å; A1156-S1160 WeakPolarHBondContact O-CB 3.14Å; A1156-S1160 PolarHBondContact O-N 3.39Å; Y1157-S1160 PolarHBondContact O-N 3.11Å; S1160-S1162 VanDerWaalsContact C-N 3.33Å; S1160-S1162 PolarHBondContact O-N 2.97Å; S1160-M1163 WeakPolarHBondContact O-CB 3.45Å; S1160-M1163 PolarHBondContact O-N 3.31Å; S1160-M1163 VanDerWaalsContact O-N 3.16Å; S1160-E1164 WeakPolarHBondContact O-CG 3.49Å; S1160-E1164 PolarHBondContact O-N 3.28Å
1161	R	91.4	Very high	87.6	Confident	86 Å²	86	68.2 Å²	68.2	33%	0.325	35%	0.35	S	S	.	.	H	α-helix	trans	-62.2	-40.5	175.8	-75.4	-55.1	-136.1	165.4	10.1	112.3	V971 Y1157 L1158 M1163 E1164 I1165	V971-R1161 HydrophobicContact CB-CB 4.1Å; V971-R1161 HydrophobicContact CG2-CB 4.13Å; Y1157-R1161 HydrophobicContact CD1-CG 4.41Å; Y1157-R1161 HydrophobicContact CD2-CG 4.01Å; Y1157-R1161 HydrophobicContact CE1-CG 3.99Å; Y1157-R1161 HydrophobicContact CE2-CG 3.54Å; Y1157-R1161 HydrophobicContact CG-CG 4.43Å; Y1157-R1161 WeakPolarHBondContact O-CB 3.27Å; Y1157-R1161 WeakPolarHBondContact O-CG 3.21Å; Y1157-R1161 PolarHBondContact O-N 3.09Å; Y1157-R1161 PolarHBondContact OH-NE 3.31Å; L1158-R1161 PolarHBondContact O-N 3.08Å; R1161-M1163 VanDerWaalsContact C-N 3.32Å; R1161-M1163 PolarHBondContact O-N 3.35Å; R1161-E1164 WeakPolarHBondContact CD-OE2 3.35Å; R1161-E1164 IonicContact CZ-OE2 3.75Å; R1161-E1164 IonicContact NE-OE2 3.98Å; R1161-E1164 IonicContact NH1-OE2 2.73Å; R1161-E1164 PolarHBondContact NH1-OE2 3.45Å; R1161-E1164 WeakPolarHBondContact O-CB 2.91Å; R1161-E1164 PolarHBondContact O-N 3.01Å; R1161-I1165 WeakPolarHBondContact O-CG1 3.41Å; R1161-I1165 WeakPolarHBondContact O-CG2 3.37Å; R1161-I1165 PolarHBondContact O-N 3.3Å
1162	S	92.6	Very high	86.8	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-57.1	-44.9	172.5	178.7	0	0	0	0	112.2	A1013 R1016 L1017 L1158 Y1159 S1160 E1164 I1165 E1166	A1013-S1162 WeakPolarHBondContact O-CB 3.34Å; A1013-S1162 PolarHBondContact O-OG 3.15Å; R1016-S1162 VanDerWaalsContact CD-OG 3.29Å; R1016-S1162 WeakPolarHBondContact CD-OG 3.41Å; R1016-S1162 WeakPolarHBondContact CG-OG 3.28Å; R1016-S1162 PolarHBondContact NH1-O 3.1Å; R1016-S1162 PolarHBondContact NH1-OG 3.49Å; L1017-S1162 WeakPolarHBondContact CD2-OG 3.43Å; L1158-S1162 PolarHBondContact O-N 3.06Å; Y1159-S1162 WeakPolarHBondContact O-CB 3.18Å; Y1159-S1162 PolarHBondContact O-N 3.37Å; S1160-S1162 VanDerWaalsContact C-N 3.33Å; S1160-S1162 PolarHBondContact O-N 2.97Å; S1162-E1164 VanDerWaalsContact C-N 3.31Å; S1162-E1164 PolarHBondContact O-N 3.3Å; S1162-I1165 VanDerWaalsContact O-CG1 3.3Å; S1162-I1165 WeakPolarHBondContact O-CG1 3.46Å; S1162-I1165 PolarHBondContact O-N 3.15Å; S1162-E1166 PolarHBondContact O-N 2.99Å
1163	M	90.5	Very high	85.7	Confident	54 Å²	54	66.6 Å²	66.6	27%	0.266	34%	0.339	S	S	.	.	H	α-helix	trans	-66.3	-31	177.2	-72.1	-71.8	-54.9	0	0	112.8	R1016 Y1159 S1160 R1161 E1166 P1167 K1168	R1016-M1163 PolarHBondContact NH2-SD 3.04Å; Y1159-M1163 HydrophobicContact CD1-CG 4.18Å; Y1159-M1163 HydrophobicContact CE1-CG 3.82Å; Y1159-M1163 HydrophobicContact CE1-SD 4.3Å; Y1159-M1163 WeakPolarHBondContact O-CG 3.46Å; Y1159-M1163 PolarHBondContact O-N 3.1Å; S1160-M1163 WeakPolarHBondContact O-CB 3.45Å; S1160-M1163 PolarHBondContact O-N 3.31Å; S1160-M1163 VanDerWaalsContact O-N 3.16Å; R1161-M1163 VanDerWaalsContact C-N 3.32Å; R1161-M1163 PolarHBondContact O-N 3.35Å; M1163-E1166 CarbonylContact O-C 3.56Å; M1163-P1167 VanDerWaalsContact O-CA 3.28Å; M1163-P1167 WeakPolarHBondContact O-CA 3.42Å; M1163-P1167 WeakPolarHBondContact O-CG 3.47Å; M1163-K1168 HydrophobicContact CE-CD 4.1Å; M1163-K1168 HydrophobicContact CE-CG 3.85Å; M1163-K1168 HydrophobicContact SD-CG 4.14Å
1164	E	88.6	Confident	84.9	Confident	86 Å²	86	65.6 Å²	65.6	40%	0.402	34%	0.337	S	S	.	.	H	α-helix	trans	-71.1	-42.9	174.2	-71.4	167.9	-155.1	0	0	112.2	S1160 R1161 S1162	S1160-E1164 WeakPolarHBondContact O-CG 3.49Å; S1160-E1164 PolarHBondContact O-N 3.28Å; R1161-E1164 WeakPolarHBondContact CD-OE2 3.35Å; R1161-E1164 IonicContact CZ-OE2 3.75Å; R1161-E1164 IonicContact NE-OE2 3.98Å; R1161-E1164 IonicContact NH1-OE2 2.73Å; R1161-E1164 PolarHBondContact NH1-OE2 3.45Å; R1161-E1164 WeakPolarHBondContact O-CB 2.91Å; R1161-E1164 PolarHBondContact O-N 3.01Å; S1162-E1164 VanDerWaalsContact C-N 3.31Å; S1162-E1164 PolarHBondContact O-N 3.3Å
1165	I	89.3	Confident	83.7	Confident	5 Å²	5	72.6 Å²	72.6	3%	0.026	37%	0.374	C	S	.	.	H	α-helix	trans	-77.9	-31.2	-176.9	66	-177.2	0	0	0	113.2	V971 L1017 R1161 S1162 P1174 F1176	V971-I1165 HydrophobicContact CB-CD1 4.47Å; L1017-I1165 HydrophobicContact CD1-CD1 4.15Å; L1017-I1165 HydrophobicContact CD2-CD1 3.89Å; L1017-I1165 HydrophobicContact CD2-CG1 3.89Å; R1161-I1165 WeakPolarHBondContact O-CG1 3.41Å; R1161-I1165 WeakPolarHBondContact O-CG2 3.37Å; R1161-I1165 PolarHBondContact O-N 3.3Å; S1162-I1165 VanDerWaalsContact O-CG1 3.3Å; S1162-I1165 WeakPolarHBondContact O-CG1 3.46Å; S1162-I1165 PolarHBondContact O-N 3.15Å; I1165-P1174 WeakPolarHBondContact O-CD 3.3Å; I1165-F1176 HydrophobicContact CB-CE2 4.41Å; I1165-F1176 HydrophobicContact CG2-CE2 4.4Å
1166	E	89	Confident	82.5	Confident	5 Å²	5	72.9 Å²	72.9	2%	0.023	37%	0.374	C	S	.	.	S	Bend	trans	-140.3	88	173.4	-67	-170.6	-157.1	0	0	110.2	R979 R1016 L1017 Y1018 H1019 T1020 S1162 M1163 P1173	R979-E1166 IonicContact CZ-OE1 2.71Å; R979-E1166 IonicContact NE-OE1 3.85Å; R979-E1166 IonicContact NH2-OE1 2.81Å; R979-E1166 PolarHBondContact NH2-OE1 3.17Å; R1016-E1166 VanDerWaalsContact CZ-O 3.26Å; R1016-E1166 PolarHBondContact NH1-O 3.22Å; R1016-E1166 PolarHBondContact NH2-O 3.14Å; L1017-E1166 VanDerWaalsContact CA-OE2 3.24Å; L1017-E1166 WeakPolarHBondContact CA-OE2 3.36Å; L1017-E1166 HydrophobicContact CD2-CB 3.85Å; L1017-E1166 HydrophobicContact CD2-CG 3.93Å; Y1018-E1166 PolarHBondContact N-OE2 3.14Å; H1019-E1166 IonicContact CD2-OE2 2.64Å; H1019-E1166 IonicContact CG-OE2 3.47Å; H1019-E1166 PolarHBondContact N-OE2 3.32Å; T1020-E1166 PolarHBondContact N-OE1 2.93Å; T1020-E1166 PolarHBondContact OG1-OE1 2.94Å; S1162-E1166 PolarHBondContact O-N 2.99Å; M1163-E1166 CarbonylContact O-C 3.56Å; E1166-P1173 HydrophobicContact CG-CB 4.35Å
1167	P	87	Confident	80.3	Confident	51 Å²	51	81.2 Å²	81.2	33%	0.331	39%	0.393	S	S	.	.			trans	-61.6	158	177	-23.1	33.9	0	0	0	113.2	M1163 P1174	M1163-P1167 VanDerWaalsContact O-CA 3.28Å; M1163-P1167 WeakPolarHBondContact O-CA 3.42Å; M1163-P1167 WeakPolarHBondContact O-CG 3.47Å; P1167-P1174 HydrophobicContact CG-CG 4.13Å
1168	K	84.4	Confident	77.8	Confident	130 Å²	130	80.3 Å²	80.3	57%	0.565	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	145.4	173.1	-70.8	179.5	180	-173.1	0	110.6	M1163 C1170	M1163-K1168 HydrophobicContact CE-CD 4.1Å; M1163-K1168 HydrophobicContact CE-CG 3.85Å; M1163-K1168 HydrophobicContact SD-CG 4.14Å; K1168-C1170 PolarHBondContact O-N 2.95Å
1169	D	75.5	Confident	75.1	Confident	169 Å²	169	84 Å²	84	90%	0.904	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	26.9	172.4	-46.9	-44.3	0	0	0	115.3
1170	C	70.4	Confident	72.3	Confident	58 Å²	58	86.5 Å²	86.5	39%	0.392	44%	0.437	S	S	.	.			trans	-102.4	117.8	177.1	-148.6	0	0	0	0	111.1	H1019 K1168 K1172	H1019-C1170 PolarHBondContact NE2-O 3.43Å; K1168-C1170 PolarHBondContact O-N 2.95Å; C1170-K1172 PolarHBondContact O-N 3.5Å; C1170-K1172 PolarHBondContact SG-O 2.6Å
1171	D	68.5	Low	69.4	Low	155 Å²	155	91.2 Å²	91.2	83%	0.829	46%	0.457	S	S	*	.	S	Bend	trans	-62	-24.3	179.2	-68.4	-30.9	0	0	0	113.2	H1019	H1019-D1171 PolarHBondContact CE1-O 3.23Å; H1019-D1171 VanDerWaalsContact CE1-O 3.29Å
1172	K	68.9	Low	66.5	Low	165 Å²	165	90.3 Å²	90.3	72%	0.717	48%	0.475	S	S	*	.	S	Bend	trans	-139.9	136.1	179.2	-64.7	-178.4	-176.5	174.4	0	110	C1170	C1170-K1172 PolarHBondContact O-N 3.5Å; C1170-K1172 PolarHBondContact SG-O 2.6Å
1173	P	67.6	Low	63.6	Low	17 Å²	17	95.8 Å²	95.8	11%	0.11	51%	0.513	C	S	.	.			trans	-64.4	147.6	178.5	26.7	-33.1	0	0	0	110.4	I976 H1019 E1166 N1175	I976-P1173 HydrophobicContact CD1-CG 3.75Å; H1019-P1173 HydrophobicContact CB-CG 4.15Å; E1166-P1173 HydrophobicContact CG-CB 4.35Å; P1173-N1175 PolarHBondContact O-N 2.76Å
1174	P	71.7	Confident	60.9	Low	51 Å²	51	100.5 Å²	100.5	33%	0.331	53%	0.534	S	S	.	.			trans	-53.8	130.3	173.3	-13.8	20.8	0	0	0	110.2	I1165 P1167 F1176	I1165-P1174 WeakPolarHBondContact O-CD 3.3Å; P1167-P1174 HydrophobicContact CG-CG 4.13Å; P1174-F1176 VanDerWaalsContact C-N 3.3Å; P1174-F1176 HydrophobicContact CB-CD2 4.19Å; P1174-F1176 HydrophobicContact CB-CE2 3.68Å; P1174-F1176 HydrophobicContact CB-CZ 4.17Å; P1174-F1176 HydrophobicContact CG-CE2 3.95Å; P1174-F1176 HydrophobicContact CG-CZ 4.44Å; P1174-F1176 VanDerWaalsContact O-CD2 3.28Å; P1174-F1176 WeakPolarHBondContact O-CD2 3.28Å; P1174-F1176 PolarHBondContact O-N 2.9Å
1175	N	66.9	Low	58.4	Low	148 Å²	148	99.9 Å²	99.9	79%	0.791	53%	0.534	S	S	*	.			trans	-75.3	85.8	175.3	-94.7	-24.4	0	0	0	109.8	P1173 R1177	P1173-N1175 PolarHBondContact O-N 2.76Å; N1175-R1177 VanDerWaalsContact C-N 3.34Å; N1175-R1177 PolarHBondContact O-N 3.28Å
1176	F	65.6	Low	55.9	Low	86 Å²	86	101.5 Å²	101.5	38%	0.377	54%	0.544	S	S	.	.			trans	-65.9	96.8	162.7	-64.8	-82.4	0	0	0	107.8	G974 N975 I1165 P1174 C1178	G974-F1176 WeakPolarHBondContact O-CD2 3.46Å; N975-F1176 PolarHBondContact ND2-O 3.46Å; N975-F1176 VanDerWaalsContact ND2-O 3.08Å; I1165-F1176 HydrophobicContact CB-CE2 4.41Å; I1165-F1176 HydrophobicContact CG2-CE2 4.4Å; P1174-F1176 VanDerWaalsContact C-N 3.3Å; P1174-F1176 HydrophobicContact CB-CD2 4.19Å; P1174-F1176 HydrophobicContact CB-CE2 3.68Å; P1174-F1176 HydrophobicContact CB-CZ 4.17Å; P1174-F1176 HydrophobicContact CG-CE2 3.95Å; P1174-F1176 HydrophobicContact CG-CZ 4.44Å; P1174-F1176 VanDerWaalsContact O-CD2 3.28Å; P1174-F1176 WeakPolarHBondContact O-CD2 3.28Å; P1174-F1176 PolarHBondContact O-N 2.9Å; F1176-C1178 PolarHBondContact O-N 3.38Å; F1176-C1178 VanDerWaalsContact O-N 3.14Å
1177	R	45.3	Very low	53.4	Low	235 Å²	235	104 Å²	104	89%	0.887	56%	0.557	S	S	*	*			trans	-58.2	119.3	-174.3	-70.1	-170.3	-161.7	-159.2	5.1	110.2	N1175	N1175-R1177 VanDerWaalsContact C-N 3.34Å; N1175-R1177 PolarHBondContact O-N 3.28Å
1178	C	41.6	Very low	50.8	Low	37 Å²	37	110.6 Å²	110.6	25%	0.25	58%	0.575	C	S	.	*			trans	-69.7	126.3	157.5	-162.2	0	0	0	0	106.7	F1176 I1180	F1176-C1178 PolarHBondContact O-N 3.38Å; F1176-C1178 VanDerWaalsContact O-N 3.14Å; C1178-I1180 PolarHBondContact O-N 2.97Å
1179	P	36.7	Very low	48.5	Very low	79 Å²	79	111.5 Å²	111.5	51%	0.513	58%	0.581	S	S	.	*	S	Bend	trans	-66.5	106.8	-178.8	-17.4	29.8	0	0	0	111.9
1180	I	35.1	Very low	46.9	Very low	144 Å²	144	108 Å²	108	74%	0.738	56%	0.558	S	S	*	*	S	Bend	trans	80.2	117	147.3	-47.1	167	0	0	0	117.3	C1178	C1178-I1180 PolarHBondContact O-N 2.97Å
1181	D	31.5	Very low	45.1	Very low	154 Å²	154	110.6 Å²	110.6	82%	0.824	58%	0.577	S	S	*	*			trans	34.3	124.3	150.4	-62.6	-26.4	0	0	0	121.2
1182	G	31	Very low	43.4	Very low	67 Å²	67	109.6 Å²	109.6	69%	0.691	57%	0.565	S	S	*	*	S	Bend	trans	70	96.1	145.1	0	0	0	0	0	115.2
1183	S	31.5	Very low	41.5	Very low	115 Å²	115	113 Å²	113	80%	0.804	57%	0.573	S	S	*	*	S	Bend	trans	60.2	62.9	159.7	51.6	0	0	0	0	116.3
1184	Q	34	Very low	39.6	Very low	153 Å²	153	121.1 Å²	121.1	72%	0.715	61%	0.607	S	S	*	*			trans	171.4	114	147.6	-95	154	38	0	0	108.9
1185	L	35.3	Very low	37.7	Very low	74 Å²	74	121 Å²	121	39%	0.387	61%	0.61	S	S	.	*			trans	-77.2	130.3	178.3	-72.1	163	0	0	0	110.5	N977 L1202	N977-L1185 HydrophobicContact CB-CD1 4Å; N977-L1185 HydrophobicContact CB-CD2 4.37Å; L1185-L1202 HydrophobicContact CB-CD1 3.39Å; L1185-L1202 HydrophobicContact CB-CG 4.13Å; L1185-L1202 HydrophobicContact CD1-CD1 3.78Å; L1185-L1202 HydrophobicContact CG-CD1 4.19Å
1186	V	36.5	Very low	36	Very low	39 Å²	39	120.1 Å²	120.1	24%	0.236	61%	0.613	C	S	.	*			trans	-121.6	107	-170.8	179.5	0	0	0	0	110.8	R1188 K1199	V1186-R1188 PolarHBondContact O-N 3.45Å; V1186-K1199 HydrophobicContact CG2-CG 4.18Å
1187	L	36.3	Very low	34.5	Very low	57 Å²	57	120.6 Å²	120.6	30%	0.298	62%	0.619	S	S	.	*			trans	-68	92.9	167.2	-92.8	163.1	0	0	0	110.2	F908 E978 L1202	F908-L1187 HydrophobicContact CD2-CD1 3.87Å; F908-L1187 HydrophobicContact CE2-CD1 3.75Å; E978-L1187 HydrophobicContact CB-CD2 3.92Å; E978-L1187 HydrophobicContact CB-CG 4.07Å; E978-L1187 HydrophobicContact CG-CD2 4.08Å; E978-L1187 HydrophobicContact CG-CG 3.86Å; E978-L1187 WeakPolarHBondContact OE1-CA 3.33Å; E978-L1187 PolarHBondContact OE1-N 3.18Å; E978-L1187 WeakPolarHBondContact OE2-CD2 3.21Å; L1187-L1202 HydrophobicContact CD1-CD2 3.65Å; L1187-L1202 HydrophobicContact CG-CD2 4.19Å
1188	R	33.5	Very low	34.2	Very low	190 Å²	190	119.6 Å²	119.6	72%	0.717	62%	0.615	S	S	*	*			trans	-100.1	97.3	155.3	-93.9	-177.4	164.9	167.5	-3.2	105.8	V1186	V1186-R1188 PolarHBondContact O-N 3.45Å
1189	H	36.1	Very low	34.5	Very low	149 Å²	149	125 Å²	125	69%	0.69	63%	0.634	S	S	*	*			trans	175.3	78.9	152.2	-91.4	100.2	0	0	0	108.6
1190	F	40.2	Very low	35.5	Very low	96 Å²	96	124 Å²	124	42%	0.421	62%	0.621	S	S	.	*	S	Bend	trans	-121	126	145.2	-92.2	-80.5	0	0	0	105.5	T906 F1192	T906-F1190 HydrophobicContact CG2-CD2 4.39Å; F1190-F1192 PolarHBondContact O-N 2.96Å
1191	S	33.6	Very low	37	Very low	112 Å²	112	121.1 Å²	121.1	78%	0.783	61%	0.61	S	S	*	*	S	Bend	trans	-63.7	78.3	-178	-83.5	0	0	0	0	111.8
1192	F	33.2	Very low	38.8	Very low	133 Å²	133	115.1 Å²	115.1	58%	0.583	58%	0.578	S	S	*	*			trans	-133	91.2	151.1	-83.3	-82.7	0	0	0	106.5	F1190 K1194	F1190-F1192 PolarHBondContact O-N 2.96Å; F1192-K1194 PolarHBondContact O-N 2.97Å
1193	R	28	Very low	40.9	Very low	236 Å²	236	120 Å²	120	89%	0.891	58%	0.58	S	S	*	*			trans	-56	124.7	170.4	-78.9	-176.1	174.5	-166.7	-0.7	107.7
1194	K	28.7	Very low	43.1	Very low	188 Å²	188	116 Å²	116	82%	0.817	55%	0.552	S	S	*	*	S	Bend	trans	98.6	61	169.8	-53.8	177.4	179.2	-177.8	0	117.1	F1192	F1192-K1194 PolarHBondContact O-N 2.97Å
1195	A	30.1	Very low	45.1	Very low	48 Å²	48	111.8 Å²	111.8	40%	0.397	54%	0.538	S	S	.	.			trans	-157	138.6	143.8	0	0	0	0	0	110.7	I897 L1197	I897-A1195 HydrophobicContact CD1-CB 4.05Å; A1195-L1197 PolarHBondContact O-N 2.95Å; A1195-L1197 VanDerWaalsContact O-N 3.11Å
1196	P	33	Very low	47	Very low	130 Å²	130	109.3 Å²	109.3	84%	0.844	53%	0.53	S	S	*	.			trans	-80.7	89.8	175	31.9	-28.7	0	0	0	109.5	R1198	P1196-R1198 PolarHBondContact O-N 3.44Å
1197	L	33.5	Very low	48.9	Very low	97 Å²	97	109.8 Å²	109.8	51%	0.508	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-70.5	123.9	171.2	-81.1	156.8	0	0	0	109.8	I897 A1195 Y1200	I897-L1197 HydrophobicContact CD1-CD2 3.39Å; I897-L1197 HydrophobicContact CD1-CG 3.74Å; I897-L1197 HydrophobicContact CG1-CD2 4.14Å; A1195-L1197 PolarHBondContact O-N 2.95Å; A1195-L1197 VanDerWaalsContact O-N 3.11Å; L1197-Y1200 HydrophobicContact CB-CE2 4.38Å; L1197-Y1200 HydrophobicContact CD2-CE2 4.15Å; L1197-Y1200 VanDerWaalsContact CD2-OH 3.29Å; L1197-Y1200 WeakPolarHBondContact CD2-OH 3.37Å
1198	R	37.8	Very low	50.7	Low	213 Å²	213	115.7 Å²	115.7	80%	0.804	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-60.6	148.4	172.7	-83.5	-177.4	173.5	-175.7	-1.2	110.5	P1196 Y1200	P1196-R1198 PolarHBondContact O-N 3.44Å; R1198-Y1200 WeakPolarHBondContact O-CD2 3.42Å; R1198-Y1200 VanDerWaalsContact O-CE2 3.26Å; R1198-Y1200 WeakPolarHBondContact O-CE2 3.42Å
1199	K	49.2	Very low	52	Low	150 Å²	150	110.1 Å²	110.1	65%	0.652	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-52.3	130.3	-178.5	-55.7	174.5	-179.9	-175.6	0	111.6	V1186	V1186-K1199 HydrophobicContact CG2-CG 4.18Å
1200	Y	56.9	Low	52.7	Low	60 Å²	60	110.2 Å²	110.2	24%	0.235	54%	0.544	C	S	.	.			trans	-113.2	152.3	174.2	-57.1	-65.7	0	0	0	110.9	V891 Q909 L1197 R1198	V891-Y1200 HydrophobicContact CB-CD1 4.5Å; V891-Y1200 HydrophobicContact CB-CE1 4.31Å; V891-Y1200 HydrophobicContact CG1-CD1 4.38Å; V891-Y1200 HydrophobicContact CG1-CE1 3.92Å; V891-Y1200 HydrophobicContact CG2-CD1 3.37Å; V891-Y1200 HydrophobicContact CG2-CE1 3.56Å; V891-Y1200 HydrophobicContact CG2-CG 4.47Å; Q909-Y1200 PolarHBondContact NE2-OH 3.28Å; L1197-Y1200 HydrophobicContact CB-CE2 4.38Å; L1197-Y1200 HydrophobicContact CD2-CE2 4.15Å; L1197-Y1200 VanDerWaalsContact CD2-OH 3.29Å; L1197-Y1200 WeakPolarHBondContact CD2-OH 3.37Å; R1198-Y1200 WeakPolarHBondContact O-CD2 3.42Å; R1198-Y1200 VanDerWaalsContact O-CE2 3.26Å; R1198-Y1200 WeakPolarHBondContact O-CE2 3.42Å
1201	T	66.2	Low	52.9	Low	83 Å²	83	115.3 Å²	115.3	51%	0.509	57%	0.566	S	S	.	*			trans	-80.3	134.6	175.6	-177.9	0	0	0	0	111	K1203	T1201-K1203 WeakPolarHBondContact OG1-CB 3.46Å; T1201-K1203 PolarHBondContact OG1-N 2.99Å
1202	L	70.4	Confident	53.1	Low	28 Å²	28	113.5 Å²	113.5	15%	0.147	55%	0.55	C	S	.	.			trans	-78.6	-9.7	170.9	-61.8	-178.8	0	0	0	112.8	F908 E978 A981 L1185 L1187 S1204	F908-L1202 HydrophobicContact CE1-CD2 4.32Å; F908-L1202 HydrophobicContact CE2-CD2 4.29Å; F908-L1202 HydrophobicContact CZ-CD2 4.17Å; E978-L1202 HydrophobicContact CG-CD1 3.87Å; A981-L1202 HydrophobicContact CB-CB 4.13Å; A981-L1202 HydrophobicContact CB-CD1 4.36Å; L1185-L1202 HydrophobicContact CB-CD1 3.39Å; L1185-L1202 HydrophobicContact CB-CG 4.13Å; L1185-L1202 HydrophobicContact CD1-CD1 3.78Å; L1185-L1202 HydrophobicContact CG-CD1 4.19Å; L1187-L1202 HydrophobicContact CD1-CD2 3.65Å; L1187-L1202 HydrophobicContact CG-CD2 4.19Å; L1202-S1204 PolarHBondContact O-N 3.45Å
1203	K	74.9	Confident	53.1	Low	168 Å²	168	112.7 Å²	112.7	73%	0.73	56%	0.558	S	S	*	*	S	Bend	trans	-70.7	125.4	-178.5	-168.4	175.7	-179.8	179.8	0	109.6	T1201	T1201-K1203 WeakPolarHBondContact OG1-CB 3.46Å; T1201-K1203 PolarHBondContact OG1-N 2.99Å
1204	S	77.7	Confident	53.3	Low	33 Å²	33	109.7 Å²	109.7	23%	0.231	55%	0.554	C	S	.	*			trans	-65.4	142.2	176.2	-173.5	0	0	0	0	111.9	E988 L1202 G1206	E988-S1204 WeakPolarHBondContact OE1-CB 3.42Å; E988-S1204 PolarHBondContact OE1-OG 3.48Å; E988-S1204 VanDerWaalsContact OE2-CB 3.29Å; E988-S1204 WeakPolarHBondContact OE2-CB 3.45Å; E988-S1204 PolarHBondContact OE2-OG 2.99Å; L1202-S1204 PolarHBondContact O-N 3.45Å; S1204-G1206 PolarHBondContact O-N 2.99Å; S1204-G1206 PolarHBondContact OG-N 3.42Å; S1204-G1206 VanDerWaalsContact OG-N 3.12Å
1205	P	76.1	Confident	53.4	Low	63 Å²	63	109.3 Å²	109.3	41%	0.409	56%	0.555	S	S	.	*			trans	-68	-13.9	167.7	31.7	-37.3	0	0	0	112.7	H911 P912	H911-P1205 VanDerWaalsContact CD2-CG 3.45Å; H911-P1205 WeakPolarHBondContact CD2-CG 3.3Å; H911-P1205 WeakPolarHBondContact NE2-CG 3.3Å; P912-P1205 HydrophobicContact CG-CG 4.15Å
1206	G	75.8	Confident	53.4	Low	23 Å²	23	112.7 Å²	112.7	24%	0.237	57%	0.573	C	S	.	*			trans	92.1	172.1	-178.7	0	0	0	0	0	113.6	H911 S1204	H911-G1206 PolarHBondContact CE1-O 3.42Å; H911-G1206 VanDerWaalsContact CE1-O 3.31Å; S1204-G1206 PolarHBondContact O-N 2.99Å; S1204-G1206 PolarHBondContact OG-N 3.42Å; S1204-G1206 VanDerWaalsContact OG-N 3.12Å
1207	I	76.3	Confident	53.2	Low	49 Å²	49	117.3 Å²	117.3	25%	0.251	57%	0.573	S	S	.	*	S	Bend	trans	-102.6	0.3	-175.3	61.4	173	0	0	0	114.1	E988 C991 I992	E988-I1207 HydrophobicContact CB-CG2 3.57Å; E988-I1207 HydrophobicContact CG-CG2 3.81Å; C991-I1207 HydrophobicContact CB-CD1 4.01Å; I992-I1207 HydrophobicContact CD1-CB 4.42Å; I992-I1207 HydrophobicContact CD1-CG2 3.97Å; I992-I1207 HydrophobicContact CG1-CB 4.34Å; I992-I1207 HydrophobicContact CG1-CG2 4.26Å
1208	K	72.8	Confident	53.1	Low	180 Å²	180	120.7 Å²	120.7	78%	0.783	59%	0.586	S	S	*	*	S	Bend	trans	-89.1	126.5	177.6	-68.4	-172.3	179.8	-176.8	0	110	Q1210	K1208-Q1210 PolarHBondContact O-N 3.34Å
1209	P	60.8	Low	52.6	Low	74 Å²	74	120.6 Å²	120.6	48%	0.481	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-60.7	134.9	171.9	23.5	-30.5	0	0	0	110.1	Y886 K1211	Y886-P1209 HydrophobicContact CE1-CB 4.3Å; Y886-P1209 VanDerWaalsContact OH-CB 3.29Å; Y886-P1209 WeakPolarHBondContact OH-CB 3.36Å; P1209-K1211 PolarHBondContact O-N 3.41Å
1210	Q	52.5	Low	51.6	Low	150 Å²	150	122.6 Å²	122.6	70%	0.701	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-68.8	125.4	175.8	-87.2	-178	-36	0	0	109.5	K1208 V1212	K1208-Q1210 PolarHBondContact O-N 3.34Å; Q1210-V1212 PolarHBondContact O-N 2.78Å
1211	K	44.3	Very low	50.4	Low	203 Å²	203	123.5 Å²	123.5	88%	0.883	61%	0.61	S	S	*	*			trans	-79.8	109.8	171.1	-69.5	-175.6	176.8	-174.7	0	108.9	P1209	P1209-K1211 PolarHBondContact O-N 3.41Å
1212	V	36.3	Very low	48.7	Very low	75 Å²	75	124.4 Å²	124.4	46%	0.455	62%	0.619	S	S	.	*			trans	-76.7	137.9	168.4	-175.6	0	0	0	0	109	Q1210 Q1214	Q1210-V1212 PolarHBondContact O-N 2.78Å; V1212-Q1214 PolarHBondContact O-N 3.28Å; V1212-Q1214 VanDerWaalsContact O-N 3.11Å
1213	P	33.3	Very low	46.6	Very low	115 Å²	115	128 Å²	128	75%	0.747	64%	0.642	S	S	*	*			trans	-65.2	111.4	171.6	-12.8	26.7	0	0	0	109.4	H1215	P1213-H1215 PolarHBondContact O-N 2.82Å
1214	Q	33.1	Very low	44.3	Very low	173 Å²	173	123.3 Å²	123.3	81%	0.808	64%	0.635	S	S	*	*			trans	-58.4	120.1	175.6	-71.4	-178.3	-8.5	0	0	110.5	V1212	V1212-Q1214 PolarHBondContact O-N 3.28Å; V1212-Q1214 VanDerWaalsContact O-N 3.11Å
1215	H	29.6	Very low	41.9	Very low	181 Å²	181	126.7 Å²	126.7	84%	0.838	66%	0.656	S	S	*	*			trans	-60.7	135.9	165.6	-96.7	-73.1	0	0	0	109.9	P1213 R1217	P1213-H1215 PolarHBondContact O-N 2.82Å; H1215-R1217 PolarHBondContact O-N 3.31Å
1216	P	30.2	Very low	39.6	Very low	119 Å²	119	128.4 Å²	128.4	77%	0.773	67%	0.67	S	S	*	*			trans	-86.5	82.6	-170.3	33.8	-33.7	0	0	0	111.4
1217	R	29	Very low	37.3	Very low	226 Å²	226	133.9 Å²	133.9	85%	0.853	69%	0.693	S	S	*	*			trans	-150.5	95.3	164.1	-71.4	-166.6	-179.9	170.8	0.4	111.7	H1215	H1215-R1217 PolarHBondContact O-N 3.31Å
1218	H	32.6	Very low	35	Very low	169 Å²	169	138.9 Å²	138.9	78%	0.782	72%	0.719	S	S	*	*				166.1	109.4	128.2	-91.4	-72.1	0	0	0	108.5	Y1220	H1218-Y1220 HydrophobicContact CB-CD2 4.48Å; H1218-Y1220 PolarHBondContact O-N 3.39Å
1219	K	27.4	Very low	32.9	Very low	211 Å²	211	135.8 Å²	135.8	92%	0.917	71%	0.706	S	S	*	*			trans	-72.1	94.2	173.9	-75.7	178.4	175.7	177.5	0	109
1220	Y	28.1	Very low	31.3	Very low	191 Å²	191	138 Å²	138	75%	0.749	72%	0.719	S	S	*	*			trans	-126.6	139.5	154.2	-73.8	-82	0	0	0	107.9	H1218 S1222	H1218-Y1220 HydrophobicContact CB-CD2 4.48Å; H1218-Y1220 PolarHBondContact O-N 3.39Å; Y1220-S1222 VanDerWaalsContact C-N 3.25Å; Y1220-S1222 PolarHBondContact O-N 3.23Å
1221	P	31.1	Very low	30.2	Very low	80 Å²	80	135.8 Å²	135.8	52%	0.519	72%	0.717	S	S	.	*			trans	-73.1	85	178.6	29.1	-29.5	0	0	0	109	T1223 V1284	P1221-T1223 PolarHBondContact O-N 3.24Å; P1221-V1284 HydrophobicContact CB-CG1 4.2Å; P1221-V1284 HydrophobicContact CG-CG1 3.72Å; P1221-V1284 HydrophobicContact CG-CG2 4.42Å
1222	S	30.3	Very low	29.4	Very low	102 Å²	102	129.2 Å²	129.2	71%	0.713	69%	0.691	S	S	*	*			trans	-70.3	107.5	167	165.4	0	0	0	0	108.3	Y1220 A1224	Y1220-S1222 VanDerWaalsContact C-N 3.25Å; Y1220-S1222 PolarHBondContact O-N 3.23Å; S1222-A1224 PolarHBondContact O-N 2.74Å
1223	T	26.6	Very low	29.1	Very low	103 Å²	103	131.8 Å²	131.8	63%	0.632	70%	0.701	S	S	*	*			trans	-84.7	72.8	165.4	-38.2	0	0	0	0	106.3	P1221 P1225	P1221-T1223 PolarHBondContact O-N 3.24Å; T1223-P1225 WeakPolarHBondContact O-CD 3.39Å
1224	A	26.4	Very low	28.8	Very low	69 Å²	69	133.3 Å²	133.3	57%	0.57	70%	0.703	S	S	*	*			trans	-67.5	124.1	174.5	0	0	0	0	0	108.7	S1222 S1226	S1222-A1224 PolarHBondContact O-N 2.74Å; A1224-S1226 PolarHBondContact O-N 3.18Å
1225	P	27.1	Very low	28.6	Very low	104 Å²	104	137.2 Å²	137.2	68%	0.675	71%	0.712	S	S	*	*			trans	-69.1	106.2	169.8	27.7	-28	0	0	0	106.9	T1223 L1227	T1223-P1225 WeakPolarHBondContact O-CD 3.39Å; P1225-L1227 VanDerWaalsContact C-N 3.29Å; P1225-L1227 PolarHBondContact O-N 3.26Å
1226	S	26.9	Very low	28.5	Very low	100 Å²	100	131.9 Å²	131.9	70%	0.699	71%	0.706	S	S	*	*			trans	-61.6	94.8	167.2	49.2	0	0	0	0	108.3	A1224 L1228	A1224-S1226 PolarHBondContact O-N 3.18Å; S1226-L1228 PolarHBondContact O-N 3.32Å
1227	L	29	Very low	28.5	Very low	138 Å²	138	137.7 Å²	137.7	72%	0.723	71%	0.712	S	S	*	*			trans	-66.2	82.3	164.1	-67.3	177	0	0	0	107.6	P1225 F1229	P1225-L1227 VanDerWaalsContact C-N 3.29Å; P1225-L1227 PolarHBondContact O-N 3.26Å; L1227-F1229 HydrophobicContact CB-CD2 4.19Å; L1227-F1229 HydrophobicContact CB-CE2 4.31Å; L1227-F1229 HydrophobicContact CD1-CE2 4.44Å; L1227-F1229 PolarHBondContact O-N 2.86Å
1228	L	27.1	Very low	28.5	Very low	154 Å²	154	134.2 Å²	134.2	81%	0.806	71%	0.711	S	S	*	*			trans	-71.8	85.8	162.8	-82.6	166.5	0	0	0	107.4	S1226 T1230	S1226-L1228 PolarHBondContact O-N 3.32Å; L1228-T1230 PolarHBondContact O-N 3Å; L1228-T1230 VanDerWaalsContact O-N 3.14Å
1229	F	29.9	Very low	28.4	Very low	115 Å²	115	137.7 Å²	137.7	50%	0.504	72%	0.717	S	S	.	*			trans	-62.9	105.9	157	-87.1	-93.5	0	0	0	107.6	L1227	L1227-F1229 HydrophobicContact CB-CD2 4.19Å; L1227-F1229 HydrophobicContact CB-CE2 4.31Å; L1227-F1229 HydrophobicContact CD1-CE2 4.44Å; L1227-F1229 PolarHBondContact O-N 2.86Å
1230	T	27.1	Very low	28.4	Very low	121 Å²	121	135.8 Å²	135.8	74%	0.742	71%	0.711	S	S	*	*			trans	-64.9	124.2	165.4	28	0	0	0	0	108.9	L1228	L1228-T1230 PolarHBondContact O-N 3Å; L1228-T1230 VanDerWaalsContact O-N 3.14Å
1231	P	28.2	Very low	28.6	Very low	102 Å²	102	133.4 Å²	133.4	66%	0.662	71%	0.712	S	S	*	*			trans	-63.8	155.7	170.1	27.7	-31.2	0	0	0	109.6	I1233	P1231-I1233 PolarHBondContact O-N 2.71Å
1232	L	28.2	Very low	28.6	Very low	65 Å²	65	135.1 Å²	135.1	34%	0.34	73%	0.725	S	S	.	*	S	Bend	trans	-59.8	75.3	172.5	-77.6	179.8	0	0	0	111.3	E1034	E1034-L1232 HydrophobicContact CB-CD1 4.39Å
1233	I	29.4	Very low	28.5	Very low	130 Å²	130	134.8 Å²	134.8	67%	0.667	73%	0.729	S	S	*	*			trans	-145.2	115.4	168.7	-55	-179.1	0	0	0	107.4	P1231	P1231-I1233 PolarHBondContact O-N 2.71Å
1234	N	28.4	Very low	28.6	Very low	146 Å²	146	134.3 Å²	134.3	78%	0.781	74%	0.735	S	S	*	*			trans	96.2	69	172.2	-55.7	-23.4	0	0	0	117.9
1235	Y	28.6	Very low	28.8	Very low	255 Å²	255	137.1 Å²	137.1	100%	1	75%	0.746	S	S	*	*	S	Bend	trans	-121.5	91.5	140.2	-94.9	-86.6	0	0	0	108
1236	G	26.6	Very low	28.8	Very low	69 Å²	69	139.6 Å²	139.6	71%	0.711	75%	0.752	S	S	*	*	S	Bend	trans	152.1	53.6	179.7	0	0	0	0	0	114.6
1237	R	30.9	Very low	28.8	Very low	242 Å²	242	140.8 Å²	140.8	91%	0.913	76%	0.758	S	S	*	*			trans	-179.1	133.7	148.6	-105.7	169.2	-163.5	-179.5	5.9	111.5
1238	D	27.6	Very low	28.7	Very low	152 Å²	152	142.1 Å²	142.1	81%	0.813	76%	0.764	S	S	*	*			trans	-45.9	140.6	174.7	-53.9	-71.2	0	0	0	114.2
1239	R	30.8	Very low	28.7	Very low	242 Å²	242	144.8 Å²	144.8	91%	0.913	76%	0.764	S	S	*	*				178.9	140.1	118.9	-99.2	171.4	177.1	-174.6	-0.9	114.4
1240	Q	28.8	Very low	28.5	Very low	172 Å²	172	150.9 Å²	150.9	80%	0.804	78%	0.783	S	S	*	*			trans	-48.1	143.8	171.6	-64.3	158.8	-20.7	0	0	115.6
1241	N	31.4	Very low	28.6	Very low	141 Å²	141	151.2 Å²	151.2	75%	0.754	79%	0.786	S	S	*	*			trans	126.5	117	139.5	-71.9	-20.6	0	0	0	116.9
1242	S	30.9	Very low	28.7	Very low	116 Å²	116	152 Å²	152	81%	0.811	79%	0.791	S	S	*	*			trans	59	133.7	135.7	-53.7	0	0	0	0	119.1
1243	A	29.1	Very low	28.6	Very low	95 Å²	95	156.8 Å²	156.8	79%	0.785	82%	0.817	S	S	*	*			cis	-171.3	165.6	4.6	0	0	0	0	0	108.5
1244	A	28.8	Very low	28.6	Very low	93 Å²	93	157.3 Å²	157.3	77%	0.769	83%	0.826	S	S	*	*			trans	77.2	103.9	162.4	0	0	0	0	0	118.7
1245	T	30	Very low	28.6	Very low	128 Å²	128	155.1 Å²	155.1	79%	0.785	83%	0.829	S	S	*	*				172.6	114.6	118.5	-65.6	0	0	0	0	111.1
1246	L	27.7	Very low	28.7	Very low	156 Å²	156	149 Å²	149	82%	0.817	82%	0.82	S	S	*	*			trans	64.2	125.6	158.3	-61.3	167.6	0	0	0	120.8	L1248	L1246-L1248 PolarHBondContact O-N 3.34Å
1247	P	25.9	Very low	28.7	Very low	125 Å²	125	150.5 Å²	150.5	81%	0.812	83%	0.826	S	S	*	*			trans	-87.1	112.1	-172.9	33.7	-30.6	0	0	0	112.6
1248	L	28	Very low	28.7	Very low	165 Å²	165	144.4 Å²	144.4	86%	0.864	82%	0.82	S	S	*	*			trans	-80.2	110.6	153.3	-92.4	154.8	0	0	0	108	L1246 R1250	L1246-L1248 PolarHBondContact O-N 3.34Å; L1248-R1250 PolarHBondContact O-N 2.85Å
1249	R	27	Very low	28.7	Very low	210 Å²	210	143 Å²	143	79%	0.792	82%	0.819	S	S	*	*			trans	-54	113.5	179	-152.4	178.2	-172.1	175.9	2.8	109.9
1250	R	25.9	Very low	28.6	Very low	243 Å²	243	138.2 Å²	138.2	92%	0.917	82%	0.817	S	S	*	*			trans	-75	131.1	166.3	-73.4	178.6	177	-179	-2	109.1	L1248	L1248-R1250 PolarHBondContact O-N 2.85Å
1251	T	29.1	Very low	28.7	Very low	128 Å²	128	135.7 Å²	135.7	79%	0.785	82%	0.819	S	S	*	*			trans	-104.1	151.9	153.3	45.1	0	0	0	0	109.3
1252	P	29.5	Very low	28.4	Very low	120 Å²	120	138.8 Å²	138.8	78%	0.779	83%	0.825	S	S	*	*			trans	-95.1	133.7	-149.3	2.2	18.3	0	0	0	113.7
1253	N	26.8	Very low	28.3	Very low	165 Å²	165	142.4 Å²	142.4	88%	0.882	83%	0.829	S	S	*	*			trans	-72.3	116.8	158.6	-85.8	-15	0	0	0	109.8
1254	T	29	Very low	28.1	Very low	140 Å²	140	143 Å²	143	86%	0.859	83%	0.834	S	S	*	*			trans	-172.3	115.2	142.8	12	0	0	0	0	111.1
1255	A	29.1	Very low	28.1	Very low	101 Å²	101	143.2 Å²	143.2	84%	0.835	83%	0.831	S	S	*	*			trans	-161.3	149.5	137.9	0	0	0	0	0	109.5
1256	P	30	Very low	28	Very low	125 Å²	125	143.6 Å²	143.6	81%	0.812	83%	0.832	S	S	*	*			trans	-100.3	161.3	-144	24.8	-9.9	0	0	0	115.1
1257	A	26.2	Very low	28	Very low	101 Å²	101	143.9 Å²	143.9	84%	0.835	83%	0.827	S	S	*	*			trans	-61.6	139	176.5	0	0	0	0	0	113.7
1258	S	30	Very low	28.1	Very low	115 Å²	115	142.3 Å²	142.3	80%	0.804	83%	0.825	S	S	*	*			trans	-140.2	138.2	146.7	-32.1	0	0	0	0	109
1259	P	28.7	Very low	28.1	Very low	122 Å²	122	141.2 Å²	141.2	79%	0.792	82%	0.818	S	S	*	*			trans	-105.4	130.5	-165.8	35.1	-24.2	0	0	0	112.3
1260	T	28.2	Very low	28	Very low	141 Å²	141	136.6 Å²	136.6	87%	0.865	81%	0.813	S	S	*	*			trans	-161.9	146.1	154.4	33.7	0	0	0	0	112.4
1261	S	31.3	Very low	28.1	Very low	120 Å²	120	130.2 Å²	130.2	84%	0.839	79%	0.794	S	S	*	*			trans	69.9	102.6	175.7	58.9	0	0	0	0	118.5
1262	K	25	Very low	28.1	Very low	205 Å²	205	131 Å²	131	89%	0.891	79%	0.792	S	S	*	*			trans	-59.1	122.2	164.6	-63.8	164.9	175.1	174.6	0	110.1
1263	E	28.9	Very low	28	Very low	192 Å²	192	131.4 Å²	131.4	90%	0.897	79%	0.787	S	S	*	*			trans	-158.9	131.9	147.7	-111.7	168.2	-153	0	0	109.3	S1265	E1263-S1265 PolarHBondContact O-N 3.15Å
1264	A	25.3	Very low	28	Very low	108 Å²	108	130.1 Å²	130.1	89%	0.893	79%	0.788	S	S	*	*			trans	-73	117.1	-167.9	0	0	0	0	0	111.7
1265	S	27.7	Very low	27.8	Very low	98 Å²	98	126.1 Å²	126.1	69%	0.685	77%	0.774	S	S	*	*			trans	-143.7	105.3	160.8	-174.4	0	0	0	0	110	E1263 F1267	E1263-S1265 PolarHBondContact O-N 3.15Å; S1265-F1267 PolarHBondContact O-N 3.42Å
1266	V	28.6	Very low	27.7	Very low	135 Å²	135	129.9 Å²	129.9	82%	0.818	77%	0.772	S	S	*	*			trans	-85.8	24.2	-178.5	175.7	0	0	0	0	111.5
1267	F	28	Very low	27.5	Very low	162 Å²	162	132.7 Å²	132.7	71%	0.711	78%	0.776	S	S	*	*			trans	-129.1	81.2	178.3	-64.9	-78.3	0	0	0	110.7	S1265 I1269	S1265-F1267 PolarHBondContact O-N 3.42Å; F1267-I1269 PolarHBondContact O-N 2.95Å
1268	A	27	Very low	27.6	Very low	92 Å²	92	136.3 Å²	136.3	76%	0.76	78%	0.776	S	S	*	*			trans	-67.9	114.6	160	0	0	0	0	0	108.6	V1270	A1268-V1270 PolarHBondContact O-N 2.97Å; A1268-V1270 VanDerWaalsContact O-N 3.13Å
1269	I	27.9	Very low	27.4	Very low	143 Å²	143	138.7 Å²	138.7	73%	0.733	77%	0.772	S	S	*	*			trans	-67.6	102.5	168.8	-62.6	166.9	0	0	0	106.4	F1267 E1271	F1267-I1269 PolarHBondContact O-N 2.95Å; I1269-E1271 HydrophobicContact CG2-CG 4.38Å
1270	V	26.6	Very low	27.4	Very low	113 Å²	113	138.1 Å²	138.1	69%	0.685	77%	0.77	S	S	*	*			trans	-93.9	104.5	165.5	179.1	0	0	0	0	106.4	A1268 I1272	A1268-V1270 PolarHBondContact O-N 2.97Å; A1268-V1270 VanDerWaalsContact O-N 3.13Å; V1270-I1272 HydrophobicContact CG1-CG1 4.27Å; V1270-I1272 PolarHBondContact O-N 3.23Å
1271	E	28.1	Very low	27.3	Very low	109 Å²	109	137.9 Å²	137.9	51%	0.509	76%	0.762	S	S	.	*			trans	-63.1	98.8	165	-72.1	-170.9	147.9	0	0	108.6	S687 I1269 N1273	S687-E1271 PolarHBondContact OG-OE2 3.41Å; I1269-E1271 HydrophobicContact CG2-CG 4.38Å; E1271-N1273 PolarHBondContact O-N 3.23Å
1272	I	27.8	Very low	27	Very low	145 Å²	145	136 Å²	136	74%	0.744	75%	0.754	S	S	*	*			trans	-76.2	102.9	165	-58.2	175.9	0	0	0	106	V1270 P1274	V1270-I1272 HydrophobicContact CG1-CG1 4.27Å; V1270-I1272 PolarHBondContact O-N 3.23Å; I1272-P1274 WeakPolarHBondContact O-CD 3.4Å
1273	N	27.1	Very low	27.1	Very low	127 Å²	127	130.3 Å²	130.3	68%	0.679	74%	0.74	S	S	*	*			trans	-40.9	119.8	164.3	-103.8	-52	0	0	0	110	E1271 G1275	E1271-N1273 PolarHBondContact O-N 3.23Å; N1273-G1275 PolarHBondContact O-N 3.44Å
1274	P	26.9	Very low	27.1	Very low	138 Å²	138	124.6 Å²	124.6	90%	0.896	72%	0.718	S	S	*	*	S	Bend	trans	-74.7	77.3	166.1	30.9	-29	0	0	0	106.9	I1272	I1272-P1274 WeakPolarHBondContact O-CD 3.4Å
1275	G	26.1	Very low	27.2	Very low	56 Å²	56	125.1 Å²	125.1	58%	0.577	71%	0.71	S	S	*	*			trans	-162	42.6	-158.7	0	0	0	0	0	115	N1273	N1273-G1275 PolarHBondContact O-N 3.44Å
1276	K	26.7	Very low	27.4	Very low	181 Å²	181	127 Å²	127	79%	0.787	71%	0.712	S	S	*	*			trans	-162.6	88	144.8	-100.6	177.2	-166	179.1	0	106.7	H1278	K1276-H1278 PolarHBondContact O-N 3.21Å
1277	M	26.5	Very low	27.3	Very low	183 Å²	183	131.7 Å²	131.7	90%	0.901	72%	0.715	S	S	*	*			trans	-53.2	117.3	149.7	-89.9	-139	158.1	0	0	106.2	K1279	M1277-K1279 VanDerWaalsContact C-N 3.31Å; M1277-K1279 PolarHBondContact O-N 3.21Å
1278	H	26.7	Very low	27.6	Very low	177 Å²	177	131 Å²	131	82%	0.819	72%	0.719	S	S	*	*			trans	-55.5	105.3	164.6	-105.2	-99.3	0	0	0	106.2	K1276 S1280	K1276-H1278 PolarHBondContact O-N 3.21Å; H1278-S1280 PolarHBondContact O-N 3.4Å
1279	K	26.8	Very low	27.9	Very low	166 Å²	166	130.2 Å²	130.2	72%	0.722	72%	0.72	S	S	*	*			trans	-57.8	92.8	155.3	-75.7	-176.6	173.4	-173.3	0	105.5	M1277 I1281	M1277-K1279 VanDerWaalsContact C-N 3.31Å; M1277-K1279 PolarHBondContact O-N 3.21Å; K1279-I1281 VanDerWaalsContact C-N 3.3Å; K1279-I1281 PolarHBondContact O-N 3.47Å
1280	S	28.1	Very low	27.9	Very low	109 Å²	109	135.8 Å²	135.8	76%	0.762	73%	0.731	S	S	*	*			trans	-57.8	104.6	155.9	173.6	0	0	0	0	105.9	H1278 A1282	H1278-S1280 PolarHBondContact O-N 3.4Å; S1280-A1282 VanDerWaalsContact C-N 3.35Å; S1280-A1282 PolarHBondContact O-N 2.85Å
1281	I	25.6	Very low	28.3	Very low	136 Å²	136	134.8 Å²	134.8	70%	0.697	74%	0.735	S	S	*	*			trans	-66	98.3	172.1	-68.4	163.5	0	0	0	105.8	K1279	K1279-I1281 VanDerWaalsContact C-N 3.3Å; K1279-I1281 PolarHBondContact O-N 3.47Å
1282	A	26.8	Very low	28.5	Very low	80 Å²	80	135.9 Å²	135.9	66%	0.661	75%	0.75	S	S	*	*			trans	-117.2	50.4	158.3	0	0	0	0	0	109.1	S1280 V1284	S1280-A1282 VanDerWaalsContact C-N 3.35Å; S1280-A1282 PolarHBondContact O-N 2.85Å; A1282-V1284 VanDerWaalsContact C-N 3.33Å; A1282-V1284 PolarHBondContact O-N 3.16Å
1283	S	26.2	Very low	28.8	Very low	87 Å²	87	134.4 Å²	134.4	61%	0.608	75%	0.752	S	S	*	*			trans	-85.2	88.1	149.5	55.7	0	0	0	0	107	T1285	S1283-T1285 PolarHBondContact O-N 3.26Å; S1283-T1285 PolarHBondContact O-OG1 2.88Å
1284	V	28.3	Very low	29.2	Very low	71 Å²	71	132.5 Å²	132.5	43%	0.43	75%	0.749	S	S	.	*			trans	-64.5	88	159.7	176.8	0	0	0	0	106.2	P1221 A1282 L1286	P1221-V1284 HydrophobicContact CB-CG1 4.2Å; P1221-V1284 HydrophobicContact CG-CG1 3.72Å; P1221-V1284 HydrophobicContact CG-CG2 4.42Å; A1282-V1284 VanDerWaalsContact C-N 3.33Å; A1282-V1284 PolarHBondContact O-N 3.16Å; V1284-L1286 VanDerWaalsContact C-N 3.32Å; V1284-L1286 HydrophobicContact CG1-CG 4.19Å; V1284-L1286 PolarHBondContact O-N 2.9Å; V1284-L1286 VanDerWaalsContact O-N 3.11Å
1285	T	28.6	Very low	29.4	Very low	119 Å²	119	134 Å²	134	73%	0.73	75%	0.749	S	S	*	*			trans	-71.6	97.3	160.5	-3.6	0	0	0	0	104.9	S1283 R1287	S1283-T1285 PolarHBondContact O-N 3.26Å; S1283-T1285 PolarHBondContact O-OG1 2.88Å; T1285-R1287 PolarHBondContact O-N 3.04Å
1286	L	30.5	Very low	29.9	Very low	138 Å²	138	134.8 Å²	134.8	72%	0.723	75%	0.749	S	S	*	*			trans	-62.1	89.1	160.8	-85.8	163.8	0	0	0	107.3	V1284 N1288	V1284-L1286 VanDerWaalsContact C-N 3.32Å; V1284-L1286 HydrophobicContact CG1-CG 4.19Å; V1284-L1286 PolarHBondContact O-N 2.9Å; V1284-L1286 VanDerWaalsContact O-N 3.11Å; L1286-N1288 PolarHBondContact O-N 2.9Å; L1286-N1288 VanDerWaalsContact O-N 3.15Å
1287	R	28.1	Very low	30.4	Very low	233 Å²	233	134.7 Å²	134.7	88%	0.879	75%	0.752	S	S	*	*			trans	-63.5	103.1	154.6	-90.4	-178.2	171.6	177.2	-1	106.6	T1285	T1285-R1287 PolarHBondContact O-N 3.04Å
1288	N	33.6	Very low	31.1	Very low	149 Å²	149	137.6 Å²	137.6	80%	0.797	77%	0.771	S	S	*	*			trans	-131.7	125	155.7	-99.4	-12.1	0	0	0	109.3	L1286	L1286-N1288 PolarHBondContact O-N 2.9Å; L1286-N1288 VanDerWaalsContact O-N 3.15Å
1289	G	32.2	Very low	31.4	Very low	75 Å²	75	135.6 Å²	135.6	77%	0.773	77%	0.768	S	S	*	*			trans	81.8	87.8	145.5	0	0	0	0	0	117.4	A1291	G1289-A1291 PolarHBondContact O-N 2.68Å
1290	R	29.5	Very low	31.6	Very low	259 Å²	259	134 Å²	134	98%	0.977	77%	0.771	S	S	*	*			trans	-56.9	118.8	137	-96.2	176.6	167.6	169.7	-4.4	108.1
1291	A	34.1	Very low	31.8	Very low	93 Å²	93	135.4 Å²	135.4	77%	0.769	77%	0.771	S	S	*	*			trans	-168.9	119.3	142.7	0	0	0	0	0	110.4	G1289	G1289-A1291 PolarHBondContact O-N 2.68Å
1292	T	32.9	Very low	32.2	Very low	132 Å²	132	135.4 Å²	135.4	81%	0.81	78%	0.775	S	S	*	*			trans	-27.6	156.3	163.2	48.2	0	0	0	0	120.1
1293	S	33.9	Very low	32.5	Very low	114 Å²	114	138.8 Å²	138.8	80%	0.797	78%	0.782	S	S	*	*			trans	80.5	144.1	160.5	83.3	0	0	0	0	115.7
1294	S	34.2	Very low	32.9	Very low	87 Å²	87	142.3 Å²	142.3	61%	0.608	79%	0.794	S	S	*	*			cis	173.2	145	-16.4	46.8	0	0	0	0	103.8
1295	L	33.2	Very low	33.2	Very low	170 Å²	170	147.4 Å²	147.4	89%	0.89	82%	0.82	S	S	*	*			trans	70.6	149.4	167.5	-56	138.9	0	0	0	114.8
1296	A	36.4	Very low	33.6	Very low	71 Å²	71	149.5 Å²	149.5	59%	0.587	83%	0.827	S	S	*	*			cis	-177.1	152.6	-17.4	0	0	0	0	0	104.5
1297	E	35.9	Very low	33.9	Very low	180 Å²	180	150.5 Å²	150.5	84%	0.841	84%	0.836	S	S	*	*			trans	65.4	93.8	150.1	-66.5	168.1	-172.9	0	0	120
1298	N	42.5	Very low	34.4	Very low	243 Å²	243	143 Å²	143	100%	1.299	83%	0.832	S	S	*	*				-169.8	0	103.5	-99.7	-23.7	0	0	0	110.8

Retrieved 1,298 of 1,298 residues in 499.9 ms (Link to these results)

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