A0A077Z3P1_TRITR Loading...

Patched family protein

AlphaFold DB , UniProt , Accession A0A077Z3P1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 848 aa.

						>A0A077Z3P1_TRITR|A0A077Z3P1
MSKSHSIWSSLFWLSSSDSGFADVLENAFQRYGEFVGRHPTPFVLGPIVFTLLIVFGTVNMHVVDDMRELYTPPGSLSLKEHQLHSRFSTAGNDSASEAFFVGVALNDNGNLMQYNYTTAIDRINDYVLKNLTLNIHGTNVSFDREICSKSVLCRESNHALGLIIDAYFDPKLRNNKEVNLTYPVANVFGNKIYLGGLFGGVAVCNGRIKEVKLIHLMYNYPTFNNATIIKTFEKALRRYLSSLESTGLQFNSFSSDILKSEISRTATYALPYFPVSVALLTALLLSVLYTADPVTSKPVEGLMGLANSLLAIGAAFGFMSLLNIPFNNTVTVVPFITLALAVDDTFILLAAWQQTNPSLCPERRLGLTLKEAGTAITITVMTDIFSFVIGTFSSTPAISSFCLFTVAAILFDYVFQLTFFCAITVLGGRREAAGRHCLWYRIRPASKSSLLRPKVALTSDRDVQPVSASSNLQRVNPGQRMLKLWYKAFWTTPGSRWIAMTIYVLYLGISFYGTCKIRINLTPGHLLVADSPLKRYVWLAENFVYPQGFVAYVYILNAPDFRNRTQTLRFRNFLAELESSTHAVGSDSTTLWLDDFSKHLEHLGAEDEEFYDYLYDFLKLSSKAHWRSHLHINEKADKPVQQFYFTTGFRVNEWVLRADMVSQWRSISAKYEELQPVVYDEYNFIADQVLSLKTTTLQEVGVAFCCMFLVCAVFIRKSDLLFWVLWSLFSMDMGVIGLLTLWGLDMDPTTVISILMSIGLTVDFTIHMAYHYYRCPVQQTERKMLLLFDLAGWPLIEGGMCTLLAMLSLVFVPSNVATVFFRTVVLVVTLGLFHALFVLPVLFTLTK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	35	Very low	37.9	Very low	245 Å²	245	136.3 Å²	136.3	100%	1.207	73%	0.727	S	S	*	*				0	51.7	0	-67	167.7	81.1	0	0	111.9
2	S	42.5	Very low	37.7	Very low	115 Å²	115	136.5 Å²	136.5	80%	0.804	72%	0.717	S	S	*	*			trans	-140.4	38.3	-174.3	-176.3	0	0	0	0	113.4
3	K	40.8	Very low	37	Very low	200 Å²	200	143.5 Å²	143.5	87%	0.87	73%	0.728	S	S	*	*			trans	-115.1	4.8	176.5	-85.6	-170.5	175.2	-176.7	0	114.9
4	S	44.2	Very low	36.8	Very low	94 Å²	94	142.9 Å²	142.9	66%	0.657	73%	0.727	S	S	*	*	S	Bend	trans	-92.1	-8	177.9	64.3	0	0	0	0	115.2
5	H	40.7	Very low	36.2	Very low	156 Å²	156	139.1 Å²	139.1	72%	0.722	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	0.4	177.6	-85.3	-68.9	0	0	0	114.9
6	S	43.7	Very low	36	Very low	85 Å²	85	138.6 Å²	138.6	59%	0.594	73%	0.731	S	S	*	*	H	α-helix	trans	-84.6	-13.6	-175.8	173.7	0	0	0	0	115.1	S9	S6-S9 PolarHBondContact O-OG 3.19Å
7	I	41.4	Very low	36.1	Very low	121 Å²	121	134.2 Å²	134.2	62%	0.621	71%	0.714	S	S	*	*	H	α-helix	trans	-85.2	-28.6	-176.9	-61.5	172.4	0	0	0	111.1	S10	I7-S10 PolarHBondContact O-OG 2.86Å
8	W	30.3	Very low	36.8	Very low	192 Å²	192	136.5 Å²	136.5	73%	0.727	73%	0.727	S	S	*	*	H	α-helix	trans	-80.5	-25.8	-180	-74.7	90.7	0	0	0	113.5	F12	W8-F12 HydrophobicContact CE3-CE2 4.43Å
9	S	30.7	Very low	37.5	Very low	63 Å²	63	132.2 Å²	132.2	44%	0.441	71%	0.709	S	S	.	*	H	α-helix	trans	-78.4	-22.9	179.9	55.6	0	0	0	0	114	S6	S6-S9 PolarHBondContact O-OG 3.19Å
10	S	33.2	Very low	39	Very low	91 Å²	91	126.8 Å²	126.8	64%	0.636	69%	0.685	S	S	*	*	H	α-helix	trans	-83.2	-19.4	-178	55.9	0	0	0	0	113.9	I7	I7-S10 PolarHBondContact O-OG 2.86Å
11	L	34.4	Very low	40.8	Very low	137 Å²	137	126.2 Å²	126.2	72%	0.717	68%	0.677	S	S	*	*	H	α-helix	trans	-83.4	-22.2	179.1	-98	140.7	0	0	0	113.6
12	F	35.3	Very low	42.8	Very low	139 Å²	139	115.5 Å²	115.5	61%	0.61	63%	0.627	S	S	*	*	H	α-helix	trans	-114.4	-2.7	-169.6	-74.7	-73	0	0	0	116.3	W8 L14	W8-F12 HydrophobicContact CE3-CE2 4.43Å; F12-L14 PolarHBondContact O-N 3.16Å; F12-L14 VanDerWaalsContact O-N 3.15Å
13	W	29.3	Very low	44.6	Very low	228 Å²	228	112.7 Å²	112.7	86%	0.864	60%	0.603	S	S	*	*			trans	-90	86.3	171.9	-82.6	91.6	0	0	0	111.8	S15	W13-S15 PolarHBondContact O-N 3.27Å
14	L	33	Very low	46.8	Very low	135 Å²	135	107 Å²	107	71%	0.707	59%	0.585	S	S	*	*			trans	-38.9	119.5	154.8	-75.3	138	0	0	0	111.3	F12	F12-L14 PolarHBondContact O-N 3.16Å; F12-L14 VanDerWaalsContact O-N 3.15Å
15	S	29.1	Very low	48.8	Very low	86 Å²	86	104.1 Å²	104.1	60%	0.601	56%	0.562	S	S	*	*			trans	-39.5	133.9	158	159.1	0	0	0	0	111.4	W13 S17	W13-S15 PolarHBondContact O-N 3.27Å; S15-S17 PolarHBondContact O-N 3.22Å; S15-S17 PolarHBondContact OG-N 3.41Å; S15-S17 PolarHBondContact OG-OG 3.33Å
16	S	32.7	Very low	51.1	Low	131 Å²	131	96.9 Å²	96.9	92%	0.916	53%	0.529	S	S	*	.	S	Bend	trans	-68.1	31.4	174.5	57.3	0	0	0	0	114.3
17	S	38	Very low	53.3	Low	64 Å²	64	96.4 Å²	96.4	45%	0.448	52%	0.519	S	S	.	.	S	Bend	trans	-97.3	118.6	163.8	61.2	0	0	0	0	107.4	S15 S19	S15-S17 PolarHBondContact O-N 3.22Å; S15-S17 PolarHBondContact OG-N 3.41Å; S15-S17 PolarHBondContact OG-OG 3.33Å; S17-S19 PolarHBondContact O-N 3.15Å
18	D	47.6	Very low	55.8	Low	175 Å²	175	93.1 Å²	93.1	94%	0.936	51%	0.51	S	S	*	.	S	Bend	trans	-56.7	26.1	-177.3	-82.2	-34.1	0	0	0	116.8
19	S	50.5	Low	58.8	Low	55 Å²	55	84.6 Å²	84.6	39%	0.385	48%	0.478	S	S	.	.			trans	-110.3	100.6	173.2	60.6	0	0	0	0	110.2	S17	S17-S19 PolarHBondContact O-N 3.15Å
20	G	66.8	Low	61.8	Low	24 Å²	24	82.5 Å²	82.5	25%	0.247	46%	0.462	C	S	.	.			trans	-65.5	166.4	169.4	0	0	0	0	0	111.5	A22 D23 V24	G20-A22 PolarHBondContact O-N 3.25Å; G20-D23 PolarHBondContact N-OD2 2.92Å; G20-D23 PolarHBondContact O-N 3.03Å; G20-V24 PolarHBondContact O-N 2.93Å; G20-V24 VanDerWaalsContact O-N 3.11Å
21	F	77.2	Confident	64.7	Low	114 Å²	114	87.4 Å²	87.4	50%	0.5	47%	0.466	S	S	.	.	H	α-helix	trans	-53	-39.9	174.1	177.5	-102.5	0	0	0	111.8	D23 V24 L25 V714 F715	F21-D23 PolarHBondContact O-N 3.3Å; F21-V24 PolarHBondContact O-N 3.42Å; F21-L25 HydrophobicContact CE1-CD2 4.4Å; F21-L25 WeakPolarHBondContact O-CB 3.3Å; F21-L25 PolarHBondContact O-N 3.05Å; F21-V714 HydrophobicContact CD1-CG1 3.79Å; F21-V714 HydrophobicContact CE1-CG1 4.31Å; F21-V714 HydrophobicContact CG-CG1 4.27Å; F21-F715 HydrophobicContact CD1-CD1 4.37Å; F21-F715 AromaticContact CD1-CE1 3.99Å; F21-F715 HydrophobicContact CD1-CE1 3.99Å; F21-F715 HydrophobicContact CD1-CZ 4.15Å; F21-F715 AromaticContact CE1-CE1 3.79Å; F21-F715 HydrophobicContact CE1-CE1 3.79Å; F21-F715 HydrophobicContact CE1-CE2 4.24Å; F21-F715 AromaticContact CE1-CZ 3.6Å; F21-F715 HydrophobicContact CE1-CZ 3.6Å
22	A	76.4	Confident	67.6	Low	20 Å²	20	84.2 Å²	84.2	17%	0.165	45%	0.445	C	S	.	.	H	α-helix	trans	-56.7	-48.1	173	0	0	0	0	0	112.2	G20 V24 L25 E26	G20-A22 PolarHBondContact O-N 3.25Å; A22-V24 VanDerWaalsContact C-N 3.32Å; A22-V24 PolarHBondContact O-N 3.18Å; A22-L25 WeakPolarHBondContact O-CB 3.4Å; A22-L25 PolarHBondContact O-N 3.33Å; A22-E26 WeakPolarHBondContact O-CB 3.39Å; A22-E26 VanDerWaalsContact O-CG 3.25Å; A22-E26 WeakPolarHBondContact O-CG 3.47Å; A22-E26 PolarHBondContact O-N 3.14Å
23	D	81.7	Confident	70.4	Confident	57 Å²	57	77.6 Å²	77.6	31%	0.305	42%	0.416	S	S	.	.	H	α-helix	trans	-66.2	-34.7	-178.4	-57.2	-47.9	0	0	0	112.6	G20 F21 N27 R775	G20-D23 PolarHBondContact N-OD2 2.92Å; G20-D23 PolarHBondContact O-N 3.03Å; F21-D23 PolarHBondContact O-N 3.3Å; D23-N27 VanDerWaalsContact O-CG 3.3Å; D23-N27 PolarHBondContact O-N 3.18Å; D23-N27 VanDerWaalsContact O-N 3.1Å; D23-N27 PolarHBondContact O-ND2 3.02Å; D23-R775 IonicContact OD1-NH2 3.64Å
24	V	86.6	Confident	73.5	Confident	81 Å²	81	68.3 Å²	68.3	49%	0.491	38%	0.382	S	S	.	.	H	α-helix	trans	-64.8	-47.4	173.4	176.4	0	0	0	0	110.2	G20 F21 A22 E26 N27 A28	G20-V24 PolarHBondContact O-N 2.93Å; G20-V24 VanDerWaalsContact O-N 3.11Å; F21-V24 PolarHBondContact O-N 3.42Å; A22-V24 VanDerWaalsContact C-N 3.32Å; A22-V24 PolarHBondContact O-N 3.18Å; V24-E26 VanDerWaalsContact C-N 3.33Å; V24-E26 PolarHBondContact O-N 3.08Å; V24-N27 PolarHBondContact O-N 2.91Å; V24-A28 PolarHBondContact O-N 3.1Å
25	L	87.2	Confident	76.5	Confident	32 Å²	32	67 Å²	67	17%	0.168	37%	0.371	C	S	.	.	H	α-helix	trans	-62.7	-40.9	178.9	-174.1	64.3	0	0	0	111.5	F21 A22 N27 A28 F29 T375 T378 F715	F21-L25 HydrophobicContact CE1-CD2 4.4Å; F21-L25 WeakPolarHBondContact O-CB 3.3Å; F21-L25 PolarHBondContact O-N 3.05Å; A22-L25 WeakPolarHBondContact O-CB 3.4Å; A22-L25 PolarHBondContact O-N 3.33Å; L25-N27 PolarHBondContact O-N 2.94Å; L25-A28 WeakPolarHBondContact O-CB 3.48Å; L25-A28 PolarHBondContact O-N 3.43Å; L25-F29 HydrophobicContact CD1-CD2 4.04Å; L25-F29 HydrophobicContact CD1-CE2 3.55Å; L25-F29 HydrophobicContact CD1-CZ 4.01Å; L25-F29 HydrophobicContact CD2-CD2 4.42Å; L25-F29 HydrophobicContact CD2-CE2 3.75Å; L25-F29 HydrophobicContact CG-CD2 3.69Å; L25-F29 HydrophobicContact CG-CE2 3.38Å; L25-F29 HydrophobicContact CG-CZ 4.32Å; L25-F29 WeakPolarHBondContact O-CB 3.26Å; L25-F29 VanDerWaalsContact O-CD2 3.29Å; L25-F29 WeakPolarHBondContact O-CD2 3.22Å; L25-F29 PolarHBondContact O-N 2.89Å; L25-T375 HydrophobicContact CB-CG2 4.32Å; L25-T375 HydrophobicContact CD2-CG2 3.99Å; L25-T375 HydrophobicContact CG-CG2 4.03Å; L25-T378 HydrophobicContact CD2-CG2 4.27Å; L25-F715 HydrophobicContact CD2-CE1 3.7Å; L25-F715 HydrophobicContact CD2-CZ 4.27Å
26	E	87.8	Confident	79.6	Confident	5 Å²	5	62.9 Å²	62.9	2%	0.023	34%	0.342	C	S	.	.	H	α-helix	trans	-58.9	-46.9	174.6	-79.4	-168.6	-167.4	0	0	112.9	A22 V24 A28 F29 Q30 K371 T375 Y771 R775	A22-E26 WeakPolarHBondContact O-CB 3.39Å; A22-E26 VanDerWaalsContact O-CG 3.25Å; A22-E26 WeakPolarHBondContact O-CG 3.47Å; A22-E26 PolarHBondContact O-N 3.14Å; V24-E26 VanDerWaalsContact C-N 3.33Å; V24-E26 PolarHBondContact O-N 3.08Å; E26-A28 VanDerWaalsContact C-N 3.3Å; E26-A28 PolarHBondContact O-N 3.4Å; E26-F29 PolarHBondContact O-N 3.21Å; E26-Q30 WeakPolarHBondContact O-CB 3.44Å; E26-Q30 PolarHBondContact O-N 3.21Å; E26-K371 HydrophobicContact CB-CG 3.76Å; E26-K371 HydrophobicContact CG-CG 4.12Å; E26-K371 WeakPolarHBondContact CG-O 3.45Å; E26-K371 WeakPolarHBondContact OE2-CE 3.39Å; E26-T375 HydrophobicContact CB-CG2 4.35Å; E26-T375 HydrophobicContact CG-CG2 3.37Å; E26-Y771 PolarHBondContact OE1-OH 2.84Å; E26-R775 VanDerWaalsContact CD-CZ 3.44Å; E26-R775 VanDerWaalsContact CD-NH1 3.25Å; E26-R775 IonicContact OE1-CZ 2.85Å; E26-R775 IonicContact OE1-NE 3.2Å; E26-R775 IonicContact OE1-NH1 3.94Å; E26-R775 PolarHBondContact OE1-NH1 3.07Å; E26-R775 IonicContact OE1-NH2 3.32Å; E26-R775 PolarHBondContact OE1-NH2 3.01Å; E26-R775 IonicContact OE2-CZ 2.61Å; E26-R775 IonicContact OE2-NH1 3.34Å; E26-R775 PolarHBondContact OE2-NH1 3.05Å; E26-R775 IonicContact OE2-NH2 3.08Å; E26-R775 PolarHBondContact OE2-NH2 2.97Å
27	N	90.3	Very high	82.4	Confident	75 Å²	75	56.6 Å²	56.6	40%	0.401	30%	0.299	S	S	.	.	H	α-helix	trans	-67.4	-34.7	178	-71.4	-38.5	0	0	0	111.6	D23 V24 L25 R31	D23-N27 VanDerWaalsContact O-CG 3.3Å; D23-N27 PolarHBondContact O-N 3.18Å; D23-N27 VanDerWaalsContact O-N 3.1Å; D23-N27 PolarHBondContact O-ND2 3.02Å; V24-N27 PolarHBondContact O-N 2.91Å; L25-N27 PolarHBondContact O-N 2.94Å; N27-R31 WeakPolarHBondContact O-CG 3.23Å; N27-R31 PolarHBondContact O-N 2.78Å; N27-R31 VanDerWaalsContact O-N 3.17Å
28	A	92.8	Very high	85	Confident	52 Å²	52	61 Å²	61	43%	0.43	31%	0.305	S	S	.	.	H	α-helix	trans	-65.1	-47.5	173.7	0	0	0	0	0	111.2	V24 L25 E26 Q30 R31 Y32	V24-A28 PolarHBondContact O-N 3.1Å; L25-A28 WeakPolarHBondContact O-CB 3.48Å; L25-A28 PolarHBondContact O-N 3.43Å; E26-A28 VanDerWaalsContact C-N 3.3Å; E26-A28 PolarHBondContact O-N 3.4Å; A28-Q30 VanDerWaalsContact C-N 3.32Å; A28-Q30 PolarHBondContact O-N 3.33Å; A28-R31 PolarHBondContact O-N 3.35Å; A28-Y32 WeakPolarHBondContact O-CB 3.39Å; A28-Y32 PolarHBondContact O-N 3.24Å
29	F	94.1	Very high	87.2	Confident	13 Å²	13	57.6 Å²	57.6	6%	0.057	28%	0.283	C	S	.	.	H	α-helix	trans	-61.4	-39.3	175.9	-83.5	-47.4	0	0	0	112.7	L25 E26 R31 Y32 G33 L370 T375 T378 L418	L25-F29 HydrophobicContact CD1-CD2 4.04Å; L25-F29 HydrophobicContact CD1-CE2 3.55Å; L25-F29 HydrophobicContact CD1-CZ 4.01Å; L25-F29 HydrophobicContact CD2-CD2 4.42Å; L25-F29 HydrophobicContact CD2-CE2 3.75Å; L25-F29 HydrophobicContact CG-CD2 3.69Å; L25-F29 HydrophobicContact CG-CE2 3.38Å; L25-F29 HydrophobicContact CG-CZ 4.32Å; L25-F29 WeakPolarHBondContact O-CB 3.26Å; L25-F29 VanDerWaalsContact O-CD2 3.29Å; L25-F29 WeakPolarHBondContact O-CD2 3.22Å; L25-F29 PolarHBondContact O-N 2.89Å; E26-F29 PolarHBondContact O-N 3.21Å; F29-R31 PolarHBondContact O-N 2.66Å; F29-Y32 PolarHBondContact O-N 3.31Å; F29-G33 PolarHBondContact O-N 3.12Å; F29-L370 HydrophobicContact CB-CB 4.33Å; F29-L370 HydrophobicContact CB-CD2 4.18Å; F29-L370 HydrophobicContact CB-CG 3.84Å; F29-L370 WeakPolarHBondContact CB-O 3.29Å; F29-L370 HydrophobicContact CD1-CD1 4.26Å; F29-L370 HydrophobicContact CD1-CD2 3.6Å; F29-L370 HydrophobicContact CD1-CG 3.62Å; F29-L370 HydrophobicContact CE1-CD2 4.45Å; F29-L370 HydrophobicContact CE1-CG 4.45Å; F29-L370 HydrophobicContact CG-CD2 4.27Å; F29-L370 HydrophobicContact CG-CG 3.92Å; F29-T375 HydrophobicContact CD2-CG2 3.85Å; F29-T375 HydrophobicContact CE2-CG2 4.15Å; F29-T378 WeakPolarHBondContact CE2-OG1 3.2Å; F29-T378 WeakPolarHBondContact CZ-OG1 3.48Å; F29-L418 HydrophobicContact CD1-CD2 4.49Å; F29-L418 HydrophobicContact CE1-CD1 4.34Å; F29-L418 HydrophobicContact CE1-CD2 3.9Å
30	Q	93.8	Very high	89.2	Confident	19 Å²	19	55.1 Å²	55.1	9%	0.089	27%	0.266	C	S	.	.	H	α-helix	trans	-60.7	-46.8	175.9	-174.3	168.6	11.6	0	0	112.2	E26 A28 E34 R364 G367 K371	E26-Q30 WeakPolarHBondContact O-CB 3.44Å; E26-Q30 PolarHBondContact O-N 3.21Å; A28-Q30 VanDerWaalsContact C-N 3.32Å; A28-Q30 PolarHBondContact O-N 3.33Å; Q30-E34 WeakPolarHBondContact O-CG 3.46Å; Q30-E34 PolarHBondContact O-N 2.94Å; Q30-E34 VanDerWaalsContact O-N 3.14Å; Q30-R364 VanDerWaalsContact NE2-NH2 3.15Å; Q30-G367 WeakPolarHBondContact CA-O 3.44Å; Q30-G367 WeakPolarHBondContact O-CA 3.42Å; Q30-K371 HydrophobicContact CB-CB 4.22Å; Q30-K371 HydrophobicContact CB-CD 4.48Å
31	R	94.8	Very high	90.4	Very high	193 Å²	193	58.7 Å²	58.7	73%	0.728	28%	0.283	S	S	*	.	H	α-helix	trans	-65.7	-40.9	177.3	-70.2	175.4	-176.9	174.7	2.5	111.8	N27 A28 F29 E34 F35	N27-R31 WeakPolarHBondContact O-CG 3.23Å; N27-R31 PolarHBondContact O-N 2.78Å; N27-R31 VanDerWaalsContact O-N 3.17Å; A28-R31 PolarHBondContact O-N 3.35Å; F29-R31 PolarHBondContact O-N 2.66Å; R31-E34 PolarHBondContact O-N 3.09Å; R31-F35 PolarHBondContact O-N 3.03Å
32	Y	95.4	Very high	91.2	Very high	71 Å²	71	56.7 Å²	56.7	28%	0.278	28%	0.282	S	S	.	.	H	α-helix	trans	-65.5	-46	178.6	179.7	-99.6	0	0	0	111.8	A28 F29 E34 F35 V36 L370 L418	A28-Y32 WeakPolarHBondContact O-CB 3.39Å; A28-Y32 PolarHBondContact O-N 3.24Å; F29-Y32 PolarHBondContact O-N 3.31Å; Y32-E34 VanDerWaalsContact C-N 3.32Å; Y32-E34 PolarHBondContact O-N 3.44Å; Y32-F35 WeakPolarHBondContact O-CA 3.44Å; Y32-F35 WeakPolarHBondContact O-CB 3.47Å; Y32-F35 PolarHBondContact O-N 2.9Å; Y32-V36 HydrophobicContact CD1-CG2 4.07Å; Y32-V36 HydrophobicContact CD2-CG2 4.48Å; Y32-V36 HydrophobicContact CE1-CG2 3.6Å; Y32-V36 HydrophobicContact CE2-CG2 4.04Å; Y32-V36 HydrophobicContact CG-CG2 4.5Å; Y32-V36 WeakPolarHBondContact O-CG2 3.28Å; Y32-V36 PolarHBondContact O-N 3.36Å; Y32-L370 HydrophobicContact CD1-CD2 3.64Å; Y32-L370 HydrophobicContact CE1-CD2 4.35Å; Y32-L418 HydrophobicContact CE1-CB 4.21Å; Y32-L418 WeakPolarHBondContact CE1-O 3.36Å; Y32-L418 PolarHBondContact OH-O 3.02Å
33	G	94.1	Very high	92	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59.7	-40.8	176.2	0	0	0	0	0	112.2	F29 F35 G37 L366	F29-G33 PolarHBondContact O-N 3.12Å; G33-F35 VanDerWaalsContact C-N 3.33Å; G33-F35 PolarHBondContact O-N 2.91Å; G33-G37 PolarHBondContact O-N 3.18Å; G33-L366 WeakPolarHBondContact O-CD2 3.39Å
34	E	94.3	Very high	92.6	Very high	33 Å²	33	56 Å²	56	15%	0.154	28%	0.275	C	S	.	.	H	α-helix	trans	-64.6	-36.4	173.4	-76	176.4	-157.5	0	0	113.2	Q30 R31 Y32 G37 R38 R364	Q30-E34 WeakPolarHBondContact O-CG 3.46Å; Q30-E34 PolarHBondContact O-N 2.94Å; Q30-E34 VanDerWaalsContact O-N 3.14Å; R31-E34 PolarHBondContact O-N 3.09Å; Y32-E34 VanDerWaalsContact C-N 3.32Å; Y32-E34 PolarHBondContact O-N 3.44Å; E34-G37 PolarHBondContact O-N 2.86Å; E34-R38 WeakPolarHBondContact O-CG 3.37Å; E34-R38 PolarHBondContact O-N 3.41Å; E34-R38 VanDerWaalsContact O-N 3.1Å; E34-R364 WeakPolarHBondContact OE1-CD 3.45Å; E34-R364 IonicContact OE1-CZ 2.73Å; E34-R364 IonicContact OE1-NE 3.33Å; E34-R364 IonicContact OE1-NH1 2.93Å; E34-R364 PolarHBondContact OE1-NH1 2.88Å
35	F	95.1	Very high	93	Very high	106 Å²	106	57.5 Å²	57.5	47%	0.465	28%	0.279	S	S	.	.	H	α-helix	trans	-67	-50.2	177.3	178	-107.4	0	0	0	111.9	R31 Y32 G33 G37 R38 H39 F43	R31-F35 PolarHBondContact O-N 3.03Å; Y32-F35 WeakPolarHBondContact O-CA 3.44Å; Y32-F35 WeakPolarHBondContact O-CB 3.47Å; Y32-F35 PolarHBondContact O-N 2.9Å; G33-F35 VanDerWaalsContact C-N 3.33Å; G33-F35 PolarHBondContact O-N 2.91Å; F35-G37 PolarHBondContact O-N 3.44Å; F35-R38 PolarHBondContact O-N 3.04Å; F35-R38 VanDerWaalsContact O-N 3.14Å; F35-H39 PolarHBondContact O-N 2.95Å; F35-F43 HydrophobicContact CD1-CE2 4.22Å; F35-F43 HydrophobicContact CD1-CZ 4.05Å; F35-F43 HydrophobicContact CE1-CE2 4.03Å; F35-F43 AromaticContact CE1-CZ 3.76Å; F35-F43 HydrophobicContact CE1-CZ 3.76Å
36	V	94.2	Very high	93.3	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-57.8	-40.9	174.4	174.7	0	0	0	0	110.2	Y32 R38 H39 P40 F43 L366 C422 A423	Y32-V36 HydrophobicContact CD1-CG2 4.07Å; Y32-V36 HydrophobicContact CD2-CG2 4.48Å; Y32-V36 HydrophobicContact CE1-CG2 3.6Å; Y32-V36 HydrophobicContact CE2-CG2 4.04Å; Y32-V36 HydrophobicContact CG-CG2 4.5Å; Y32-V36 WeakPolarHBondContact O-CG2 3.28Å; Y32-V36 PolarHBondContact O-N 3.36Å; V36-R38 VanDerWaalsContact C-N 3.31Å; V36-R38 PolarHBondContact O-N 2.77Å; V36-H39 CarbonylContact O-C 3.25Å; V36-H39 VanDerWaalsContact O-C 3.25Å; V36-H39 PolarHBondContact O-N 3.32Å; V36-P40 WeakPolarHBondContact O-CA 3.37Å; V36-F43 HydrophobicContact CB-CD2 4.19Å; V36-F43 HydrophobicContact CB-CE2 4.25Å; V36-F43 HydrophobicContact CG1-CB 4.36Å; V36-F43 HydrophobicContact CG1-CD2 3.9Å; V36-F43 HydrophobicContact CG1-CE2 4.46Å; V36-F43 HydrophobicContact CG1-CG 4.15Å; V36-F43 HydrophobicContact CG2-CD1 4.43Å; V36-F43 HydrophobicContact CG2-CD2 4.05Å; V36-F43 HydrophobicContact CG2-CE1 4.21Å; V36-F43 HydrophobicContact CG2-CE2 3.85Å; V36-F43 HydrophobicContact CG2-CG 4.36Å; V36-F43 HydrophobicContact CG2-CZ 3.92Å; V36-L366 HydrophobicContact CB-CD2 4.13Å; V36-L366 HydrophobicContact CG1-CD2 4.1Å; V36-C422 HydrophobicContact CG1-CB 4.08Å; V36-A423 HydrophobicContact CG1-CB 4.22Å
37	G	91.2	Very high	93.7	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-62.5	-34.8	178.3	0	0	0	0	0	114.1	G33 E34 F35 R430	G33-G37 PolarHBondContact O-N 3.18Å; E34-G37 PolarHBondContact O-N 2.86Å; F35-G37 PolarHBondContact O-N 3.44Å; G37-R430 PolarHBondContact O-NH2 3.25Å
38	R	93.1	Very high	93.9	Very high	155 Å²	155	57 Å²	57	59%	0.585	29%	0.285	S	S	*	.	H	α-helix	trans	-70.2	-37.8	175.6	-71.7	174.4	-166.6	178	7	112	E34 F35 V36 P40 E363	E34-R38 WeakPolarHBondContact O-CG 3.37Å; E34-R38 PolarHBondContact O-N 3.41Å; E34-R38 VanDerWaalsContact O-N 3.1Å; F35-R38 PolarHBondContact O-N 3.04Å; F35-R38 VanDerWaalsContact O-N 3.14Å; V36-R38 VanDerWaalsContact C-N 3.31Å; V36-R38 PolarHBondContact O-N 2.77Å; R38-P40 VanDerWaalsContact C-CD 3.48Å; R38-P40 WeakPolarHBondContact O-CD 3.41Å; R38-E363 HydrophobicContact CG-CG 4.24Å
39	H	93.6	Very high	94.1	Very high	104 Å²	104	58.4 Å²	58.4	48%	0.481	29%	0.288	S	S	.	.			trans	-125.6	64	-173.7	-59.9	-66.8	0	0	0	113.3	F35 V36 T41 P42 F43	F35-H39 PolarHBondContact O-N 2.95Å; V36-H39 CarbonylContact O-C 3.25Å; V36-H39 VanDerWaalsContact O-C 3.25Å; V36-H39 PolarHBondContact O-N 3.32Å; H39-T41 PolarHBondContact O-N 3.23Å; H39-P42 HydrophobicContact CB-CG 4.44Å; H39-P42 VanDerWaalsContact O-CD 3.24Å; H39-P42 WeakPolarHBondContact O-CD 3.45Å; H39-P42 WeakPolarHBondContact O-CG 3.41Å; H39-F43 WeakPolarHBondContact O-CD2 3.41Å
40	P	92.4	Very high	94.1	Very high	4 Å²	4	61.8 Å²	61.8	3%	0.026	30%	0.303	C	S	.	.	H	α-helix	trans	-71.4	-26.3	-172.8	27.1	-35	0	0	0	114.1	V36 R38 F43 V44 A423 L427	V36-P40 WeakPolarHBondContact O-CA 3.37Å; R38-P40 VanDerWaalsContact C-CD 3.48Å; R38-P40 WeakPolarHBondContact O-CD 3.41Å; P40-F43 PolarHBondContact O-N 3.47Å; P40-V44 WeakPolarHBondContact O-CG2 3.47Å; P40-V44 PolarHBondContact O-N 3.26Å; P40-A423 HydrophobicContact CB-CB 4Å; P40-L427 HydrophobicContact CB-CD2 4.4Å; P40-L427 HydrophobicContact CB-CG 4.37Å; P40-L427 HydrophobicContact CG-CD2 4.04Å
41	T	92.4	Very high	94.2	Very high	98 Å²	98	61.2 Å²	61.2	60%	0.601	30%	0.301	S	S	*	.	H	α-helix	trans	-58.9	-48.9	-173.6	47.1	0	0	0	0	115.1	H39 F43 V44 L45	H39-T41 PolarHBondContact O-N 3.23Å; T41-F43 VanDerWaalsContact C-N 3.27Å; T41-F43 PolarHBondContact O-N 2.96Å; T41-V44 PolarHBondContact O-N 2.86Å; T41-L45 PolarHBondContact O-N 3.32Å; T41-L45 VanDerWaalsContact O-N 3.17Å
42	P	93.6	Very high	94.1	Very high	73 Å²	73	58 Å²	58	47%	0.474	30%	0.297	S	S	.	.	H	α-helix	trans	-63.4	-33.2	175.7	25.3	-36.8	0	0	0	112.7	H39 G46	H39-P42 HydrophobicContact CB-CG 4.44Å; H39-P42 VanDerWaalsContact O-CD 3.24Å; H39-P42 WeakPolarHBondContact O-CD 3.45Å; H39-P42 WeakPolarHBondContact O-CG 3.41Å; P42-G46 PolarHBondContact O-N 2.82Å
43	F	94.5	Very high	94.1	Very high	38 Å²	38	60.7 Å²	60.7	17%	0.167	32%	0.316	C	S	.	.	H	α-helix	trans	-75	-22.1	-179.2	-68.2	-69.8	0	0	0	113.6	F35 V36 H39 P40 T41 P47 T419 F420 A423	F35-F43 HydrophobicContact CD1-CE2 4.22Å; F35-F43 HydrophobicContact CD1-CZ 4.05Å; F35-F43 HydrophobicContact CE1-CE2 4.03Å; F35-F43 AromaticContact CE1-CZ 3.76Å; F35-F43 HydrophobicContact CE1-CZ 3.76Å; V36-F43 HydrophobicContact CB-CD2 4.19Å; V36-F43 HydrophobicContact CB-CE2 4.25Å; V36-F43 HydrophobicContact CG1-CB 4.36Å; V36-F43 HydrophobicContact CG1-CD2 3.9Å; V36-F43 HydrophobicContact CG1-CE2 4.46Å; V36-F43 HydrophobicContact CG1-CG 4.15Å; V36-F43 HydrophobicContact CG2-CD1 4.43Å; V36-F43 HydrophobicContact CG2-CD2 4.05Å; V36-F43 HydrophobicContact CG2-CE1 4.21Å; V36-F43 HydrophobicContact CG2-CE2 3.85Å; V36-F43 HydrophobicContact CG2-CG 4.36Å; V36-F43 HydrophobicContact CG2-CZ 3.92Å; H39-F43 WeakPolarHBondContact O-CD2 3.41Å; P40-F43 PolarHBondContact O-N 3.47Å; T41-F43 VanDerWaalsContact C-N 3.27Å; T41-F43 PolarHBondContact O-N 2.96Å; F43-P47 WeakPolarHBondContact O-CD 3.15Å; F43-P47 WeakPolarHBondContact O-CG 3.48Å; F43-T419 HydrophobicContact CD1-CG2 3.86Å; F43-T419 HydrophobicContact CE1-CG2 4.3Å; F43-F420 WeakPolarHBondContact O-CA 3.4Å; F43-F420 PolarHBondContact O-N 3.4Å; F43-A423 HydrophobicContact CB-CB 3.77Å
44	V	93.7	Very high	94.1	Very high	25 Å²	25	61.7 Å²	61.7	15%	0.152	32%	0.321	C	S	.	.	H	α-helix	trans	-80.1	-47.6	169.7	176.7	0	0	0	0	111	P40 T41 I48 F420 A423 I424 L427	P40-V44 WeakPolarHBondContact O-CG2 3.47Å; P40-V44 PolarHBondContact O-N 3.26Å; T41-V44 PolarHBondContact O-N 2.86Å; V44-I48 HydrophobicContact CG1-CD1 4.29Å; V44-I48 WeakPolarHBondContact O-CD1 3.43Å; V44-I48 WeakPolarHBondContact O-CG1 3.31Å; V44-F420 HydrophobicContact CG1-CD2 4.3Å; V44-F420 HydrophobicContact CG1-CE2 4.01Å; V44-A423 HydrophobicContact CG2-CB 3.58Å; V44-I424 HydrophobicContact CG1-CD1 4.27Å; V44-I424 HydrophobicContact CG2-CD1 3.9Å; V44-I424 HydrophobicContact CG2-CG1 4.49Å; V44-L427 HydrophobicContact CG2-CD1 4.27Å
45	L	94.6	Very high	94	Very high	111 Å²	111	62.5 Å²	62.5	58%	0.581	33%	0.328	S	S	*	.	H	α-helix	trans	-74.5	-35.6	-173.9	-67.6	175.6	0	0	0	113	T41 I48 V49	T41-L45 PolarHBondContact O-N 3.32Å; T41-L45 VanDerWaalsContact O-N 3.17Å; L45-I48 PolarHBondContact O-N 3.01Å; L45-V49 WeakPolarHBondContact O-CG2 3.36Å; L45-V49 PolarHBondContact O-N 2.7Å
46	G	94.1	Very high	93.7	Very high	35 Å²	35	65.1 Å²	65.1	36%	0.361	34%	0.34	S	S	.	.	H	α-helix	trans	-56.4	-57.2	-176.6	0	0	0	0	0	113.2	P42 I48 V49 F50	P42-G46 PolarHBondContact O-N 2.82Å; G46-I48 VanDerWaalsContact C-N 3.33Å; G46-I48 PolarHBondContact O-N 2.98Å; G46-V49 PolarHBondContact O-N 3.35Å; G46-F50 VanDerWaalsContact O-CB 3.26Å; G46-F50 WeakPolarHBondContact O-CB 3.49Å; G46-F50 PolarHBondContact O-N 2.81Å
47	P	95.5	Very high	93.2	Very high	10 Å²	10	65.3 Å²	65.3	7%	0.065	34%	0.341	C	S	.	.	H	α-helix	trans	-59.4	-38.1	178.2	-30.4	40.8	0	0	0	113.9	F43 T51 F416 T419 F420	F43-P47 WeakPolarHBondContact O-CD 3.15Å; F43-P47 WeakPolarHBondContact O-CG 3.48Å; P47-T51 VanDerWaalsContact O-CB 3.3Å; P47-T51 WeakPolarHBondContact O-CB 3.36Å; P47-T51 PolarHBondContact O-N 2.9Å; P47-T51 PolarHBondContact O-OG1 3.16Å; P47-F416 HydrophobicContact CB-CD1 3.76Å; P47-F416 HydrophobicContact CB-CE1 3.86Å; P47-F416 HydrophobicContact CB-CG 4.12Å; P47-F416 HydrophobicContact CB-CZ 4.29Å; P47-F416 HydrophobicContact CG-CD1 4.19Å; P47-F416 HydrophobicContact CG-CE1 4.5Å; P47-T419 WeakPolarHBondContact CG-OG1 3.49Å; P47-F420 HydrophobicContact CB-CB 4.07Å; P47-F420 HydrophobicContact CB-CD2 4.48Å; P47-F420 HydrophobicContact CG-CB 3.96Å
48	I	95.1	Very high	93	Very high	57 Å²	57	67.9 Å²	67.9	29%	0.292	36%	0.357	S	S	.	.	H	α-helix	trans	-62.7	-52.3	176	-63.3	171.1	0	0	0	110.4	V44 L45 G46 F50 T51 L52 L311 F420	V44-I48 HydrophobicContact CG1-CD1 4.29Å; V44-I48 WeakPolarHBondContact O-CD1 3.43Å; V44-I48 WeakPolarHBondContact O-CG1 3.31Å; L45-I48 PolarHBondContact O-N 3.01Å; G46-I48 VanDerWaalsContact C-N 3.33Å; G46-I48 PolarHBondContact O-N 2.98Å; I48-F50 VanDerWaalsContact C-N 3.35Å; I48-F50 PolarHBondContact O-N 2.74Å; I48-T51 PolarHBondContact O-N 3.25Å; I48-L52 HydrophobicContact CG2-CD1 4.04Å; I48-L52 WeakPolarHBondContact O-CG 3.25Å; I48-L52 PolarHBondContact O-N 3.39Å; I48-L311 HydrophobicContact CG1-CD1 4.15Å; I48-F420 HydrophobicContact CD1-CE2 3.89Å; I48-F420 HydrophobicContact CG1-CD2 4.39Å; I48-F420 HydrophobicContact CG1-CE2 3.87Å
49	V	95.8	Very high	92.6	Very high	81 Å²	81	65.6 Å²	65.6	49%	0.491	36%	0.36	S	S	.	.	H	α-helix	trans	-62.6	-44.6	-178.8	172.1	0	0	0	0	110.6	L45 G46 T51 L52 L53	L45-V49 WeakPolarHBondContact O-CG2 3.36Å; L45-V49 PolarHBondContact O-N 2.7Å; G46-V49 PolarHBondContact O-N 3.35Å; V49-T51 PolarHBondContact O-N 3.16Å; V49-L52 PolarHBondContact O-N 3.06Å; V49-L53 HydrophobicContact CG1-CD1 4.18Å; V49-L53 WeakPolarHBondContact O-CG 3.43Å; V49-L53 PolarHBondContact O-N 3.23Å; V49-L53 VanDerWaalsContact O-N 3.07Å
50	F	95.7	Very high	92.1	Very high	84 Å²	84	65.9 Å²	65.9	37%	0.368	37%	0.365	S	S	.	.	H	α-helix	trans	-59.3	-45.7	177.3	176.7	-94.7	0	0	0	111.9	G46 I48 L53 I54 A315 F412 F416	G46-F50 VanDerWaalsContact O-CB 3.26Å; G46-F50 WeakPolarHBondContact O-CB 3.49Å; G46-F50 PolarHBondContact O-N 2.81Å; I48-F50 VanDerWaalsContact C-N 3.35Å; I48-F50 PolarHBondContact O-N 2.74Å; F50-L53 PolarHBondContact O-N 3.42Å; F50-I54 HydrophobicContact CD1-CD1 4.14Å; F50-I54 HydrophobicContact CD2-CD1 4.21Å; F50-I54 HydrophobicContact CE1-CD1 3.45Å; F50-I54 VanDerWaalsContact CE1-CD1 3.45Å; F50-I54 HydrophobicContact CE1-CG1 4.46Å; F50-I54 HydrophobicContact CE2-CD1 3.51Å; F50-I54 HydrophobicContact CE2-CG1 4.42Å; F50-I54 HydrophobicContact CZ-CD1 3.1Å; F50-I54 HydrophobicContact CZ-CG1 4.3Å; F50-I54 PolarHBondContact O-N 3.24Å; F50-A315 HydrophobicContact CE1-CB 4.5Å; F50-F412 AromaticContact CE1-CD1 3.91Å; F50-F412 HydrophobicContact CE1-CD1 3.91Å; F50-F412 AromaticContact CE1-CE1 3.47Å; F50-F412 HydrophobicContact CE1-CE1 3.47Å; F50-F412 VanDerWaalsContact CE1-CE1 3.47Å; F50-F412 HydrophobicContact CE1-CZ 4.3Å; F50-F412 HydrophobicContact CZ-CD1 4.49Å; F50-F412 AromaticContact CZ-CE1 3.67Å; F50-F412 HydrophobicContact CZ-CE1 3.67Å; F50-F412 HydrophobicContact CZ-CZ 4.36Å; F50-F416 HydrophobicContact CD1-CE1 4.03Å; F50-F416 AromaticContact CD1-CZ 3.78Å; F50-F416 HydrophobicContact CD1-CZ 3.78Å; F50-F416 HydrophobicContact CE1-CE1 4.38Å; F50-F416 HydrophobicContact CE1-CZ 4.18Å
51	T	95.4	Very high	91.9	Very high	7 Å²	7	69.1 Å²	69.1	4%	0.043	38%	0.381	C	S	.	.	H	α-helix	trans	-62.4	-45.7	177.4	-56.8	0	0	0	0	111.2	P47 I48 V49 L53 I54 V55 L311 A315 F416	P47-T51 VanDerWaalsContact O-CB 3.3Å; P47-T51 WeakPolarHBondContact O-CB 3.36Å; P47-T51 PolarHBondContact O-N 2.9Å; P47-T51 PolarHBondContact O-OG1 3.16Å; I48-T51 PolarHBondContact O-N 3.25Å; V49-T51 PolarHBondContact O-N 3.16Å; T51-L53 VanDerWaalsContact C-N 3.26Å; T51-L53 PolarHBondContact O-N 3.34Å; T51-I54 PolarHBondContact O-N 3.37Å; T51-V55 HydrophobicContact CG2-CG2 3.68Å; T51-V55 VanDerWaalsContact O-CB 3.29Å; T51-V55 WeakPolarHBondContact O-CB 3.26Å; T51-V55 WeakPolarHBondContact O-CG2 3.36Å; T51-V55 PolarHBondContact O-N 3.31Å; T51-L311 HydrophobicContact CG2-CB 4.22Å; T51-L311 HydrophobicContact CG2-CD2 3.78Å; T51-L311 VanDerWaalsContact CG2-O 3.29Å; T51-L311 WeakPolarHBondContact CG2-O 3.36Å; T51-A315 HydrophobicContact CG2-CB 4.33Å; T51-F416 VanDerWaalsContact OG1-CE2 3.27Å; T51-F416 WeakPolarHBondContact OG1-CE2 3.38Å; T51-F416 WeakPolarHBondContact OG1-CZ 3.38Å
52	L	93.3	Very high	91.6	Very high	125 Å²	125	69.7 Å²	69.7	65%	0.654	38%	0.376	S	S	*	.	H	α-helix	trans	-59.8	-35.5	178.1	-72.2	172.6	0	0	0	112.7	I48 V49	I48-L52 HydrophobicContact CG2-CD1 4.04Å; I48-L52 WeakPolarHBondContact O-CG 3.25Å; I48-L52 PolarHBondContact O-N 3.39Å; V49-L52 PolarHBondContact O-N 3.06Å
53	L	93.9	Very high	91.2	Very high	129 Å²	129	69.4 Å²	69.4	68%	0.675	37%	0.373	S	S	*	.	H	α-helix	trans	-70.6	-43.3	176.7	-69.6	172.3	0	0	0	112.3	V49 F50 T51	V49-L53 HydrophobicContact CG1-CD1 4.18Å; V49-L53 WeakPolarHBondContact O-CG 3.43Å; V49-L53 PolarHBondContact O-N 3.23Å; V49-L53 VanDerWaalsContact O-N 3.07Å; F50-L53 PolarHBondContact O-N 3.42Å; T51-L53 VanDerWaalsContact C-N 3.26Å; T51-L53 PolarHBondContact O-N 3.34Å
54	I	94.1	Very high	90.7	Very high	21 Å²	21	68.5 Å²	68.5	11%	0.108	37%	0.371	C	S	.	.	H	α-helix	trans	-79	-36	-175.9	-69.8	-170.8	0	0	0	112.4	F50 T51 F56 G57 A315 G318 F319 L322	F50-I54 HydrophobicContact CD1-CD1 4.14Å; F50-I54 HydrophobicContact CD2-CD1 4.21Å; F50-I54 HydrophobicContact CE1-CD1 3.45Å; F50-I54 VanDerWaalsContact CE1-CD1 3.45Å; F50-I54 HydrophobicContact CE1-CG1 4.46Å; F50-I54 HydrophobicContact CE2-CD1 3.51Å; F50-I54 HydrophobicContact CE2-CG1 4.42Å; F50-I54 HydrophobicContact CZ-CD1 3.1Å; F50-I54 HydrophobicContact CZ-CG1 4.3Å; F50-I54 PolarHBondContact O-N 3.24Å; T51-I54 PolarHBondContact O-N 3.37Å; I54-F56 PolarHBondContact O-N 2.83Å; I54-F56 VanDerWaalsContact O-N 3.16Å; I54-G57 WeakPolarHBondContact O-CA 3.39Å; I54-G57 PolarHBondContact O-N 2.93Å; I54-A315 VanDerWaalsContact CG2-O 3.23Å; I54-A315 WeakPolarHBondContact CG2-O 3.27Å; I54-G318 WeakPolarHBondContact O-CA 3.19Å; I54-F319 HydrophobicContact CG2-CB 3.95Å; I54-L322 HydrophobicContact CG2-CD1 4.46Å
55	V	92.8	Very high	90.1	Very high	50 Å²	50	68.6 Å²	68.6	30%	0.303	37%	0.371	S	S	.	.	H	α-helix	trans	-58.5	-29.3	178.3	167.7	0	0	0	0	111.4	T51 G57 T58 G314	T51-V55 HydrophobicContact CG2-CG2 3.68Å; T51-V55 VanDerWaalsContact O-CB 3.29Å; T51-V55 WeakPolarHBondContact O-CB 3.26Å; T51-V55 WeakPolarHBondContact O-CG2 3.36Å; T51-V55 PolarHBondContact O-N 3.31Å; V55-G57 PolarHBondContact O-N 2.86Å; V55-G57 VanDerWaalsContact O-N 3.11Å; V55-T58 WeakPolarHBondContact O-CB 3.18Å; V55-T58 WeakPolarHBondContact O-CG2 3.09Å; V55-T58 PolarHBondContact O-N 2.72Å; V55-T58 PolarHBondContact O-OG1 3.3Å; V55-G314 VanDerWaalsContact CG2-C 3.46Å; V55-G314 WeakPolarHBondContact CG2-O 3.18Å
56	F	89.7	Confident	89.5	Confident	161 Å²	161	65.6 Å²	65.6	71%	0.706	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-55.4	-28.9	172.2	-174.4	-100	0	0	0	112.8	I54 T58 V59	I54-F56 PolarHBondContact O-N 2.83Å; I54-F56 VanDerWaalsContact O-N 3.16Å; F56-T58 PolarHBondContact O-N 2.78Å; F56-V59 WeakPolarHBondContact O-CG2 3.39Å; F56-V59 PolarHBondContact O-N 3.21Å
57	G	83.5	Confident	89	Confident	3 Å²	3	64.5 Å²	64.5	3%	0.031	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-61.9	-20.8	174.4	0	0	0	0	0	115.1	I54 V55 V59 N60 S321	I54-G57 WeakPolarHBondContact O-CA 3.39Å; I54-G57 PolarHBondContact O-N 2.93Å; V55-G57 PolarHBondContact O-N 2.86Å; V55-G57 VanDerWaalsContact O-N 3.11Å; G57-V59 PolarHBondContact O-N 3.19Å; G57-N60 PolarHBondContact O-N 2.64Å; G57-N60 VanDerWaalsContact O-N 3.15Å; G57-S321 WeakPolarHBondContact O-CB 3.24Å; G57-S321 PolarHBondContact O-OG 3.26Å
58	T	85.7	Confident	88.5	Confident	54 Å²	54	65.5 Å²	65.5	33%	0.331	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-63.3	-18.2	176.2	60.1	0	0	0	0	113.5	V55 F56 N60 M61 F317	V55-T58 WeakPolarHBondContact O-CB 3.18Å; V55-T58 WeakPolarHBondContact O-CG2 3.09Å; V55-T58 PolarHBondContact O-N 2.72Å; V55-T58 PolarHBondContact O-OG1 3.3Å; F56-T58 PolarHBondContact O-N 2.78Å; T58-N60 PolarHBondContact O-N 2.77Å; T58-M61 VanDerWaalsContact O-CB 3.29Å; T58-M61 WeakPolarHBondContact O-CB 3.38Å; T58-M61 PolarHBondContact O-N 2.65Å; T58-F317 HydrophobicContact CG2-CB 4.34Å
59	V	85.9	Confident	88	Confident	107 Å²	107	68.4 Å²	68.4	65%	0.648	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-62.4	-28.9	175.2	177	0	0	0	0	111.7	F56 G57 M61	F56-V59 WeakPolarHBondContact O-CG2 3.39Å; F56-V59 PolarHBondContact O-N 3.21Å; G57-V59 PolarHBondContact O-N 3.19Å; V59-M61 VanDerWaalsContact C-N 3.32Å; V59-M61 PolarHBondContact O-N 3.42Å
60	N	83.5	Confident	87.5	Confident	111 Å²	111	65 Å²	65	59%	0.594	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-93.5	22.3	179.5	-70.7	-6.9	0	0	0	113.2	G57 T58 H62	G57-N60 PolarHBondContact O-N 2.64Å; G57-N60 VanDerWaalsContact O-N 3.15Å; T58-N60 PolarHBondContact O-N 2.77Å; N60-H62 PolarHBondContact O-N 2.99Å; N60-H62 VanDerWaalsContact O-N 3.09Å
61	M	86.7	Confident	87	Confident	71 Å²	71	61.5 Å²	61.5	35%	0.35	32%	0.319	S	S	.	.			trans	-66.4	113.6	-175.4	-170.2	173.7	77.9	0	0	111.3	T58 V59 V63 S321 F327	T58-M61 VanDerWaalsContact O-CB 3.29Å; T58-M61 WeakPolarHBondContact O-CB 3.38Å; T58-M61 PolarHBondContact O-N 2.65Å; V59-M61 VanDerWaalsContact C-N 3.32Å; V59-M61 PolarHBondContact O-N 3.42Å; M61-V63 HydrophobicContact CE-CG2 4Å; M61-S321 VanDerWaalsContact CA-OG 3.26Å; M61-S321 WeakPolarHBondContact CA-OG 3.49Å; M61-S321 PolarHBondContact N-OG 3.16Å; M61-S321 VanDerWaalsContact N-OG 3.16Å; M61-F327 HydrophobicContact CE-CB 4.17Å; M61-F327 HydrophobicContact CE-CD1 3.96Å; M61-F327 HydrophobicContact CE-CD2 4.27Å; M61-F327 HydrophobicContact CE-CE1 4.43Å; M61-F327 HydrophobicContact CE-CG 3.86Å; M61-F327 HydrophobicContact CG-CB 3.73Å; M61-F327 HydrophobicContact CG-CG 4.37Å; M61-F327 HydrophobicContact SD-CB 3.72Å; M61-F327 HydrophobicContact SD-CD1 4.42Å; M61-F327 HydrophobicContact SD-CD2 3.79Å; M61-F327 HydrophobicContact SD-CG 3.71Å
62	H	85.6	Confident	86.7	Confident	110 Å²	110	61.2 Å²	61.2	51%	0.509	32%	0.317	S	S	.	.			trans	-83.9	114.6	175.8	-176	-99.8	0	0	0	110.2	N60 V64 P326 F327	N60-H62 PolarHBondContact O-N 2.99Å; N60-H62 VanDerWaalsContact O-N 3.09Å; H62-V64 WeakPolarHBondContact CE1-CG2 3.37Å; H62-V64 WeakPolarHBondContact ND1-CG2 3.48Å; H62-P326 WeakPolarHBondContact O-CA 3.47Å; H62-F327 PolarHBondContact O-N 3.03Å
63	V	85.9	Confident	86.3	Confident	68 Å²	68	56.1 Å²	56.1	41%	0.412	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-94.8	124	179.9	-178.3	0	0	0	0	110.1	M61 D65 F327	M61-V63 HydrophobicContact CE-CG2 4Å; V63-D65 WeakPolarHBondContact CG1-OD1 3.48Å; V63-F327 WeakPolarHBondContact CA-O 3.21Å; V63-F327 HydrophobicContact CG1-CD1 4.31Å; V63-F327 HydrophobicContact CG2-CB 4.43Å; V63-F327 HydrophobicContact CG2-CD1 4.12Å
64	V	84.5	Confident	85.9	Confident	18 Å²	18	55 Å²	55	11%	0.109	29%	0.292	C	S	.	.			trans	-116.7	120.2	173.3	-179.7	0	0	0	0	108.2	H62 E69 L70 P326 F327 N328	H62-V64 WeakPolarHBondContact CE1-CG2 3.37Å; H62-V64 WeakPolarHBondContact ND1-CG2 3.48Å; V64-E69 HydrophobicContact CG1-CB 4.42Å; V64-L70 HydrophobicContact CB-CD2 4.36Å; V64-L70 HydrophobicContact CG1-CD2 4Å; V64-L70 HydrophobicContact CG1-CG 4.02Å; V64-L70 WeakPolarHBondContact O-CD1 3.5Å; V64-P326 HydrophobicContact CB-CB 3.9Å; V64-P326 HydrophobicContact CG2-CB 3.46Å; V64-P326 VanDerWaalsContact CG2-CB 3.46Å; V64-F327 PolarHBondContact N-O 3.45Å; V64-N328 WeakPolarHBondContact O-CB 3.38Å
65	D	80.7	Confident	85.4	Confident	28 Å²	28	57 Å²	57	15%	0.15	32%	0.318	C	S	.	.			trans	-119.5	0.3	-179.3	-58.8	-45.3	0	0	0	112.6	V63 M67 K260	V63-D65 WeakPolarHBondContact CG1-OD1 3.48Å; D65-M67 PolarHBondContact O-N 3.1Å; D65-K260 HydrophobicContact CB-CD 4.26Å; D65-K260 HydrophobicContact CB-CG 3.53Å
66	D	83	Confident	85.1	Confident	48 Å²	48	55.3 Å²	55.3	26%	0.257	31%	0.308	S	S	.	.			trans	-75.6	120.6	-179.2	-169.2	-19.1	0	0	0	110.8	R68 E69 L70	D66-R68 VanDerWaalsContact C-N 3.31Å; D66-R68 PolarHBondContact O-N 3.45Å; D66-R68 WeakPolarHBondContact OD1-CB 3.23Å; D66-R68 PolarHBondContact OD1-N 3.1Å; D66-E69 HydrophobicContact CB-CB 4.26Å; D66-E69 HydrophobicContact CB-CG 4.14Å; D66-E69 PolarHBondContact O-N 3.11Å; D66-L70 VanDerWaalsContact O-CB 3.29Å; D66-L70 WeakPolarHBondContact O-CB 3.17Å; D66-L70 WeakPolarHBondContact O-CG 3.25Å; D66-L70 PolarHBondContact O-N 3.41Å
67	M	81.6	Confident	85.1	Confident	12 Å²	12	52 Å²	52	6%	0.059	30%	0.297	C	S	.	.	H	α-helix	trans	-65	-33.9	178.5	-73.2	-151.2	-57.9	0	0	113.7	D65 E69 L70 Y71 L259 I263 L527 F685	D65-M67 PolarHBondContact O-N 3.1Å; M67-E69 PolarHBondContact O-N 3.32Å; M67-L70 PolarHBondContact O-N 2.88Å; M67-Y71 HydrophobicContact CB-CD2 3.97Å; M67-Y71 HydrophobicContact CG-CD2 3.93Å; M67-Y71 HydrophobicContact CG-CE2 4.02Å; M67-Y71 WeakPolarHBondContact O-CB 3.22Å; M67-Y71 PolarHBondContact O-N 3.21Å; M67-Y71 HydrophobicContact SD-CD2 4.23Å; M67-Y71 HydrophobicContact SD-CE2 4.21Å; M67-L259 HydrophobicContact CE-CD1 3.71Å; M67-L259 HydrophobicContact CE-CD2 3.08Å; M67-L259 HydrophobicContact CE-CG 3.4Å; M67-L259 VanDerWaalsContact CE-CG 3.4Å; M67-L259 HydrophobicContact SD-CG 4.5Å; M67-I263 HydrophobicContact CE-CD1 4.06Å; M67-I263 HydrophobicContact CG-CD1 3.42Å; M67-I263 VanDerWaalsContact CG-CD1 3.42Å; M67-I263 HydrophobicContact SD-CD1 3.24Å; M67-I263 WeakPolarHBondContact SD-CD1 3.39Å; M67-L527 HydrophobicContact SD-CD1 3.45Å; M67-L527 WeakPolarHBondContact SD-CD1 3.1Å; M67-F685 HydrophobicContact CB-CE2 4.31Å; M67-F685 HydrophobicContact CE-CZ 4.44Å
68	R	85.1	Confident	85.3	Confident	31 Å²	31	52.1 Å²	52.1	12%	0.117	30%	0.298	C	S	.	.	H	α-helix	trans	-65.8	-31.8	178.8	-175.4	176.9	-69.4	139.3	-0.8	110.5	D66 T72 L79 H82 E682 F685	D66-R68 VanDerWaalsContact C-N 3.31Å; D66-R68 PolarHBondContact O-N 3.45Å; D66-R68 WeakPolarHBondContact OD1-CB 3.23Å; D66-R68 PolarHBondContact OD1-N 3.1Å; R68-T72 WeakPolarHBondContact O-CB 3.25Å; R68-T72 PolarHBondContact O-OG1 3.28Å; R68-L79 HydrophobicContact CG-CD2 3.68Å; R68-H82 PolarHBondContact NH1-CD2 3.47Å; R68-H82 PolarHBondContact NH1-CE1 2.83Å; R68-H82 PolarHBondContact NH1-ND1 2.79Å; R68-H82 PolarHBondContact NH1-NE2 3.29Å; R68-E682 IonicContact CZ-OE1 3.78Å; R68-E682 PolarHBondContact NH2-O 3.19Å; R68-E682 IonicContact NH2-OE1 2.9Å; R68-E682 PolarHBondContact NH2-OE1 2.9Å; R68-E682 IonicContact NH2-OE2 3.85Å; R68-F685 HydrophobicContact CG-CB 4.38Å; R68-F685 HydrophobicContact CG-CG 4.48Å
69	E	84.7	Confident	85.4	Confident	118 Å²	118	52 Å²	52	55%	0.551	29%	0.294	S	S	*	.	H	α-helix	trans	-81.7	-38.4	174.3	-62.6	-174.2	165.6	0	0	112.3	V64 D66 M67 P397	V64-E69 HydrophobicContact CG1-CB 4.42Å; D66-E69 HydrophobicContact CB-CB 4.26Å; D66-E69 HydrophobicContact CB-CG 4.14Å; D66-E69 PolarHBondContact O-N 3.11Å; M67-E69 PolarHBondContact O-N 3.32Å; E69-P397 WeakPolarHBondContact O-CG 3.21Å
70	L	86.2	Confident	85.5	Confident	8 Å²	8	53 Å²	53	4%	0.042	29%	0.29	C	S	.	.	H	α-helix	trans	-79.9	-34.4	-172.8	-74.2	172.9	0	0	0	114.8	V64 D66 M67 N328 P397 A398	V64-L70 HydrophobicContact CB-CD2 4.36Å; V64-L70 HydrophobicContact CG1-CD2 4Å; V64-L70 HydrophobicContact CG1-CG 4.02Å; V64-L70 WeakPolarHBondContact O-CD1 3.5Å; D66-L70 VanDerWaalsContact O-CB 3.29Å; D66-L70 WeakPolarHBondContact O-CB 3.17Å; D66-L70 WeakPolarHBondContact O-CG 3.25Å; D66-L70 PolarHBondContact O-N 3.41Å; M67-L70 PolarHBondContact O-N 2.88Å; L70-N328 HydrophobicContact CD1-CB 4.06Å; L70-N328 HydrophobicContact CD2-CB 3.76Å; L70-P397 VanDerWaalsContact O-CD 3.29Å; L70-P397 WeakPolarHBondContact O-CD 3.2Å; L70-A398 HydrophobicContact CB-CB 4.24Å; L70-A398 WeakPolarHBondContact O-CB 3.33Å; L70-A398 PolarHBondContact O-N 2.83Å
71	Y	86	Confident	85.8	Confident	11 Å²	11	48.3 Å²	48.3	4%	0.043	27%	0.265	C	S	.	.	S	Bend	trans	-113.1	2.8	-171.7	-66.5	-80.8	0	0	0	113.6	M67 T396 A398 L527 Q689 P749	M67-Y71 HydrophobicContact CB-CD2 3.97Å; M67-Y71 HydrophobicContact CG-CD2 3.93Å; M67-Y71 HydrophobicContact CG-CE2 4.02Å; M67-Y71 WeakPolarHBondContact O-CB 3.22Å; M67-Y71 PolarHBondContact O-N 3.21Å; M67-Y71 HydrophobicContact SD-CD2 4.23Å; M67-Y71 HydrophobicContact SD-CE2 4.21Å; Y71-T396 HydrophobicContact CD1-CG2 4.17Å; Y71-A398 HydrophobicContact CD1-CB 4.43Å; Y71-A398 HydrophobicContact CE1-CB 4.11Å; Y71-L527 HydrophobicContact CD2-CD1 4.41Å; Y71-L527 HydrophobicContact CE1-CD1 4.34Å; Y71-L527 HydrophobicContact CE2-CD1 3.8Å; Y71-L527 WeakPolarHBondContact OH-CD2 3.45Å; Y71-Q689 WeakPolarHBondContact O-CB 3.46Å; Y71-Q689 VanDerWaalsContact O-CG 3.31Å; Y71-Q689 WeakPolarHBondContact O-CG 3.07Å; Y71-Q689 PolarHBondContact O-OE1 2.97Å; Y71-P749 HydrophobicContact CD1-CB 4.14Å; Y71-P749 HydrophobicContact CD1-CG 4.02Å; Y71-P749 HydrophobicContact CE1-CB 4.04Å; Y71-P749 HydrophobicContact CE1-CG 4.31Å
72	T	87.5	Confident	85.8	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.012	26%	0.255	C	S	.	.	S	Bend	trans	-103.3	134.6	176.9	-42.1	0	0	0	0	109.8	R68 S76 S78 L79 P397 F685 D688	R68-T72 WeakPolarHBondContact O-CB 3.25Å; R68-T72 PolarHBondContact O-OG1 3.28Å; T72-S76 WeakPolarHBondContact CG2-OG 3.47Å; T72-S78 WeakPolarHBondContact CG2-OG 3.43Å; T72-L79 HydrophobicContact CG2-CG 4.31Å; T72-P397 WeakPolarHBondContact O-CD 3.37Å; T72-F685 HydrophobicContact CG2-CB 4.11Å; T72-F685 WeakPolarHBondContact OG1-CB 3.25Å; T72-D688 HydrophobicContact CG2-CB 4.45Å
73	P	86.2	Confident	85.8	Confident	18 Å²	18	46.5 Å²	46.5	12%	0.117	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-57.2	139.4	175	-27.1	35.7	0	0	0	112.8	G75 S76 S395	P73-G75 PolarHBondContact O-N 3.21Å; P73-S76 WeakPolarHBondContact O-CB 2.98Å; P73-S76 PolarHBondContact O-N 3.44Å; P73-S76 VanDerWaalsContact O-N 3.13Å; P73-S76 PolarHBondContact O-OG 3.49Å; P73-S395 VanDerWaalsContact CA-O 3.31Å; P73-S395 WeakPolarHBondContact CA-O 3.31Å
74	P	84.9	Confident	85.7	Confident	105 Å²	105	44.8 Å²	44.8	68%	0.682	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	130.3	177	25.4	-32.9	0	0	0	110.2	S76 S395	P74-S76 VanDerWaalsContact C-N 3.35Å; P74-S395 WeakPolarHBondContact CD-O 3.29Å
75	G	84.4	Confident	85.8	Confident	63 Å²	63	44.2 Å²	44.2	65%	0.649	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	82	8.1	-178.1	0	0	0	0	0	115.2	P73	P73-G75 PolarHBondContact O-N 3.21Å
76	S	86.6	Confident	85.8	Confident	14 Å²	14	43.6 Å²	43.6	10%	0.098	24%	0.238	C	C	.	.			trans	-56	154	172.3	64.4	0	0	0	0	113	T72 P73 P74 S78 L79 D688	T72-S76 WeakPolarHBondContact CG2-OG 3.47Å; P73-S76 WeakPolarHBondContact O-CB 2.98Å; P73-S76 PolarHBondContact O-N 3.44Å; P73-S76 VanDerWaalsContact O-N 3.13Å; P73-S76 PolarHBondContact O-OG 3.49Å; P74-S76 VanDerWaalsContact C-N 3.35Å; S76-S78 PolarHBondContact OG-OG 3.21Å; S76-L79 WeakPolarHBondContact OG-CG 3.3Å; S76-D688 WeakPolarHBondContact CB-OD2 3.21Å
77	L	88.3	Confident	85.7	Confident	92 Å²	92	47.5 Å²	47.5	48%	0.482	25%	0.249	S	C	.	.	H	α-helix	trans	-70.9	-34.5	179	-68.6	172	0	0	0	111.5	L79 K80 E81	L77-L79 VanDerWaalsContact C-N 3.27Å; L77-L79 PolarHBondContact O-N 3.06Å; L77-K80 PolarHBondContact O-N 3.18Å; L77-E81 VanDerWaalsContact O-CG 3.27Å; L77-E81 WeakPolarHBondContact O-CG 3.24Å; L77-E81 PolarHBondContact O-N 3.44Å
78	S	88.2	Confident	85.6	Confident	5 Å²	5	48.5 Å²	48.5	4%	0.035	25%	0.253	C	S	.	.	H	α-helix	trans	-57.3	-34.8	179.1	53.2	0	0	0	0	114.2	T72 S76 E81 H82 D688	T72-S78 WeakPolarHBondContact CG2-OG 3.43Å; S76-S78 PolarHBondContact OG-OG 3.21Å; S78-E81 WeakPolarHBondContact CA-OE2 3.1Å; S78-E81 PolarHBondContact O-N 3.33Å; S78-H82 WeakPolarHBondContact O-CB 3.15Å; S78-H82 PolarHBondContact O-N 3.17Å; S78-D688 WeakPolarHBondContact CB-OD2 3.2Å; S78-D688 PolarHBondContact N-OD2 2.95Å; S78-D688 VanDerWaalsContact N-OD2 3.13Å; S78-D688 PolarHBondContact OG-OD2 3.14Å
79	L	87.8	Confident	85.1	Confident	51 Å²	51	47.5 Å²	47.5	27%	0.267	25%	0.251	S	S	.	.	H	α-helix	trans	-65.1	-40.1	175.7	-68.5	173.3	0	0	0	112	R68 T72 S76 L77 Q83	R68-L79 HydrophobicContact CG-CD2 3.68Å; T72-L79 HydrophobicContact CG2-CG 4.31Å; S76-L79 WeakPolarHBondContact OG-CG 3.3Å; L77-L79 VanDerWaalsContact C-N 3.27Å; L77-L79 PolarHBondContact O-N 3.06Å; L79-Q83 WeakPolarHBondContact O-CG 3.36Å; L79-Q83 PolarHBondContact O-N 3.13Å
80	K	88.3	Confident	84.5	Confident	130 Å²	130	42 Å²	42	57%	0.565	23%	0.225	S	C	*	.	H	α-helix	trans	-72.9	-41.1	176.5	-64.9	178.5	-178.4	173.5	0	111.5	L77 H82 Q83 L84	L77-K80 PolarHBondContact O-N 3.18Å; K80-H82 VanDerWaalsContact C-N 3.28Å; K80-H82 PolarHBondContact O-N 3.26Å; K80-Q83 PolarHBondContact O-N 3.07Å; K80-L84 WeakPolarHBondContact O-CB 3.49Å; K80-L84 PolarHBondContact O-N 3.21Å
81	E	90	Very high	83.6	Confident	11 Å²	11	45 Å²	45	5%	0.051	25%	0.251	C	S	.	.	H	α-helix	trans	-55.5	-44.4	174.3	-69.8	163.2	-173	0	0	110.4	L77 S78 L84 H85 R666 V678 V679 Y680 N684	L77-E81 VanDerWaalsContact O-CG 3.27Å; L77-E81 WeakPolarHBondContact O-CG 3.24Å; L77-E81 PolarHBondContact O-N 3.44Å; S78-E81 WeakPolarHBondContact CA-OE2 3.1Å; S78-E81 PolarHBondContact O-N 3.33Å; E81-L84 PolarHBondContact O-N 3.38Å; E81-H85 WeakPolarHBondContact O-CB 3.5Å; E81-H85 PolarHBondContact O-N 3.11Å; E81-R666 IonicContact OE1-CZ 3.8Å; E81-R666 IonicContact OE1-NE 3.24Å; E81-R666 PolarHBondContact OE1-NE 3.38Å; E81-R666 IonicContact OE1-NH2 2.73Å; E81-R666 PolarHBondContact OE1-NH2 3.42Å; E81-R666 VanDerWaalsContact OE1-NH2 3.08Å; E81-R666 IonicContact OE2-CZ 2.72Å; E81-R666 IonicContact OE2-NH2 2.9Å; E81-R666 PolarHBondContact OE2-NH2 3.09Å; E81-V678 HydrophobicContact CB-CG1 4.13Å; E81-V678 HydrophobicContact CG-CG1 3.58Å; E81-V679 WeakPolarHBondContact CG-O 3.4Å; E81-Y680 HydrophobicContact CB-CD2 4.08Å; E81-N684 PolarHBondContact OE2-ND2 3.07Å
82	H	86.6	Confident	82.6	Confident	31 Å²	31	46.8 Å²	46.8	14%	0.144	27%	0.273	C	S	.	.	H	α-helix	trans	-66.7	-45.9	177.7	-178.4	66.7	0	0	0	113.6	R68 S78 K80 L84 H85 S86 Y680	R68-H82 PolarHBondContact NH1-CD2 3.47Å; R68-H82 PolarHBondContact NH1-CE1 2.83Å; R68-H82 PolarHBondContact NH1-ND1 2.79Å; R68-H82 PolarHBondContact NH1-NE2 3.29Å; S78-H82 WeakPolarHBondContact O-CB 3.15Å; S78-H82 PolarHBondContact O-N 3.17Å; K80-H82 VanDerWaalsContact C-N 3.28Å; K80-H82 PolarHBondContact O-N 3.26Å; H82-L84 PolarHBondContact O-N 3.36Å; H82-H85 PolarHBondContact O-N 3.11Å; H82-S86 PolarHBondContact O-N 3.01Å; H82-S86 PolarHBondContact O-OG 3.28Å; H82-Y680 VanDerWaalsContact CA-CE2 3.48Å; H82-Y680 HydrophobicContact CB-CE2 3.86Å; H82-Y680 AromaticContact ND1-CE2 3.79Å; H82-Y680 AromaticContact ND1-CZ 3.77Å; H82-Y680 PolarHBondContact ND1-OH 3.07Å
83	Q	84.6	Confident	81.6	Confident	113 Å²	113	52.5 Å²	52.5	53%	0.528	30%	0.304	S	S	.	.	H	α-helix	trans	-60.7	-34.3	175.9	-73.2	176.7	-4.1	0	0	112.3	L79 K80 S86 R87	L79-Q83 WeakPolarHBondContact O-CG 3.36Å; L79-Q83 PolarHBondContact O-N 3.13Å; K80-Q83 PolarHBondContact O-N 3.07Å; Q83-S86 PolarHBondContact O-OG 2.93Å; Q83-R87 WeakPolarHBondContact O-CB 3.31Å; Q83-R87 WeakPolarHBondContact O-CG 3.41Å; Q83-R87 PolarHBondContact O-N 3.33Å; Q83-R87 VanDerWaalsContact O-N 3.16Å
84	L	85.2	Confident	80.4	Confident	31 Å²	31	56.5 Å²	56.5	16%	0.162	32%	0.324	C	S	.	.	H	α-helix	trans	-70	-47	175.4	-178.9	72.9	0	0	0	111.5	K80 E81 H82 S86 R87 F88 Y555 L557 V678	K80-L84 WeakPolarHBondContact O-CB 3.49Å; K80-L84 PolarHBondContact O-N 3.21Å; E81-L84 PolarHBondContact O-N 3.38Å; H82-L84 PolarHBondContact O-N 3.36Å; L84-S86 VanDerWaalsContact C-N 3.3Å; L84-S86 PolarHBondContact O-N 2.97Å; L84-R87 PolarHBondContact O-N 3.24Å; L84-F88 PolarHBondContact O-N 3.35Å; L84-Y555 HydrophobicContact CD2-CG 4.42Å; L84-L557 HydrophobicContact CD1-CD1 4.18Å; L84-L557 HydrophobicContact CD1-CD2 3.48Å; L84-L557 VanDerWaalsContact CD1-CD2 3.48Å; L84-L557 HydrophobicContact CD1-CG 4.43Å; L84-L557 HydrophobicContact CD2-CD1 3.97Å; L84-L557 HydrophobicContact CD2-CD2 3.86Å; L84-L557 HydrophobicContact CD2-CG 4.19Å; L84-L557 HydrophobicContact CG-CD2 4.15Å; L84-V678 HydrophobicContact CD2-CB 3.63Å; L84-V678 HydrophobicContact CD2-CG1 3.66Å; L84-V678 HydrophobicContact CD2-CG2 3.71Å
85	H	85.7	Confident	79.7	Confident	7 Å²	7	51.9 Å²	51.9	3%	0.032	29%	0.294	C	S	.	.	H	α-helix	trans	-55.8	-44.6	175.5	170	74.8	0	0	0	111.7	E81 H82 F88 S89 Y555 Y680	E81-H85 WeakPolarHBondContact O-CB 3.5Å; E81-H85 PolarHBondContact O-N 3.11Å; H82-H85 PolarHBondContact O-N 3.11Å; H85-F88 PolarHBondContact O-N 3.41Å; H85-S89 WeakPolarHBondContact O-CB 3.29Å; H85-S89 PolarHBondContact O-N 3.22Å; H85-S89 PolarHBondContact O-OG 2.67Å; H85-Y555 HydrophobicContact CB-CE2 4.13Å; H85-Y555 AromaticContact ND1-CE2 3.89Å; H85-Y555 AromaticContact ND1-CZ 3.65Å; H85-Y555 PolarHBondContact ND1-OH 3.12Å; H85-Y680 HydrophobicContact CB-CD1 3.73Å; H85-Y680 HydrophobicContact CB-CD2 3.83Å; H85-Y680 HydrophobicContact CB-CE1 3.79Å; H85-Y680 HydrophobicContact CB-CE2 3.88Å; H85-Y680 HydrophobicContact CB-CG 3.74Å; H85-Y680 AromaticContact CD2-CE1 3.31Å; H85-Y680 WeakPolarHBondContact CD2-CE1 3.07Å; H85-Y680 AromaticContact CD2-CZ 3.47Å; H85-Y680 VanDerWaalsContact CD2-CZ 3.47Å; H85-Y680 AromaticContact CE1-CE1 3.66Å; H85-Y680 AromaticContact CG-CD1 3.44Å; H85-Y680 VanDerWaalsContact CG-CD1 3.44Å; H85-Y680 AromaticContact CG-CE1 3.2Å; H85-Y680 AromaticContact CG-CG 4Å; H85-Y680 AromaticContact CG-CZ 3.58Å; H85-Y680 AromaticContact ND1-CD1 3.42Å; H85-Y680 WeakPolarHBondContact ND1-CD1 3.46Å; H85-Y680 AromaticContact ND1-CE1 3.43Å; H85-Y680 WeakPolarHBondContact ND1-CE1 3.44Å; H85-Y680 AromaticContact NE2-CE1 3.62Å
86	S	81.2	Confident	79.1	Confident	14 Å²	14	50.2 Å²	50.2	10%	0.098	27%	0.274	C	S	.	.	H	α-helix	trans	-64.8	-43.2	178.8	68.2	0	0	0	0	112.2	H82 Q83 L84 F88 S89 T90	H82-S86 PolarHBondContact O-N 3.01Å; H82-S86 PolarHBondContact O-OG 3.28Å; Q83-S86 PolarHBondContact O-OG 2.93Å; L84-S86 VanDerWaalsContact C-N 3.3Å; L84-S86 PolarHBondContact O-N 2.97Å; S86-F88 PolarHBondContact O-N 3.45Å; S86-S89 PolarHBondContact O-N 3.36Å; S86-T90 WeakPolarHBondContact O-CG2 3.43Å; S86-T90 PolarHBondContact O-N 2.83Å; S86-T90 PolarHBondContact O-OG1 3.45Å
87	R	79.9	Confident	78.7	Confident	130 Å²	130	49.7 Å²	49.7	49%	0.491	27%	0.27	S	S	.	.	H	α-helix	trans	-60.4	-45.6	175.7	-80.1	177.5	167.7	159.8	4.6	112.7	Q83 L84 T90 G92 D94	Q83-R87 WeakPolarHBondContact O-CB 3.31Å; Q83-R87 WeakPolarHBondContact O-CG 3.41Å; Q83-R87 PolarHBondContact O-N 3.33Å; Q83-R87 VanDerWaalsContact O-N 3.16Å; L84-R87 PolarHBondContact O-N 3.24Å; R87-T90 PolarHBondContact O-N 3.01Å; R87-T90 PolarHBondContact O-OG1 2.86Å; R87-G92 PolarHBondContact O-N 3.21Å; R87-G92 VanDerWaalsContact O-N 3.14Å; R87-D94 IonicContact CZ-OD1 3.66Å; R87-D94 IonicContact NE-OD1 2.91Å; R87-D94 PolarHBondContact NE-OD1 3.2Å; R87-D94 IonicContact NH2-OD1 3.77Å
88	F	79.5	Confident	78.4	Confident	34 Å²	34	47.4 Å²	47.4	15%	0.149	26%	0.257	C	S	.	.	H	α-helix	trans	-63.9	-43.6	178.5	-159.3	-73.1	0	0	0	111.2	L84 H85 S86 T90 A91 Y555 H632 Q643 Y645	L84-F88 PolarHBondContact O-N 3.35Å; H85-F88 PolarHBondContact O-N 3.41Å; S86-F88 PolarHBondContact O-N 3.45Å; F88-T90 PolarHBondContact O-N 3.37Å; F88-A91 PolarHBondContact O-N 2.82Å; F88-Y555 HydrophobicContact CB-CD1 4.18Å; F88-Y555 HydrophobicContact CB-CE1 3.7Å; F88-Y555 HydrophobicContact CD1-CD1 4.46Å; F88-Y555 AromaticContact CD1-CE1 3.84Å; F88-Y555 HydrophobicContact CD1-CE1 3.84Å; F88-Y555 AromaticContact CD2-CD1 3.81Å; F88-Y555 HydrophobicContact CD2-CD1 3.81Å; F88-Y555 AromaticContact CD2-CE1 3.98Å; F88-Y555 HydrophobicContact CD2-CE1 3.98Å; F88-Y555 HydrophobicContact CE2-CD1 4.34Å; F88-Y555 AromaticContact CG-CD1 3.87Å; F88-Y555 HydrophobicContact CG-CD1 3.87Å; F88-Y555 AromaticContact CG-CE1 3.54Å; F88-Y555 HydrophobicContact CG-CE1 3.54Å; F88-H632 HydrophobicContact CE2-CB 4.42Å; F88-Q643 HydrophobicContact CE2-CB 4.04Å; F88-Y645 AromaticContact CD1-CD1 3.73Å; F88-Y645 HydrophobicContact CD1-CD1 3.73Å; F88-Y645 AromaticContact CD1-CE1 3.95Å; F88-Y645 HydrophobicContact CD1-CE1 3.95Å; F88-Y645 AromaticContact CE1-CD1 3.24Å; F88-Y645 HydrophobicContact CE1-CD1 3.24Å; F88-Y645 AromaticContact CE1-CE1 3.48Å; F88-Y645 HydrophobicContact CE1-CE1 3.48Å; F88-Y645 VanDerWaalsContact CE1-CE1 3.48Å; F88-Y645 HydrophobicContact CE1-CG 4.5Å; F88-Y645 AromaticContact CZ-CD1 3.72Å; F88-Y645 HydrophobicContact CZ-CD1 3.72Å; F88-Y645 HydrophobicContact CZ-CE1 4.32Å
89	S	75.6	Confident	78.2	Confident	10 Å²	10	47.6 Å²	47.6	7%	0.07	26%	0.259	C	S	.	.	H	α-helix	trans	-65.1	-22.4	-178.3	-60.7	0	0	0	0	114.2	H85 S86 S151	H85-S89 WeakPolarHBondContact O-CB 3.29Å; H85-S89 PolarHBondContact O-N 3.22Å; H85-S89 PolarHBondContact O-OG 2.67Å; S86-S89 PolarHBondContact O-N 3.36Å; S89-S151 PolarHBondContact O-OG 3.07Å
90	T	71.5	Confident	78.3	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.012	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	15.7	179.9	61.4	0	0	0	0	113.9	S86 R87 F88 G92 N93 S95 P222	S86-T90 WeakPolarHBondContact O-CG2 3.43Å; S86-T90 PolarHBondContact O-N 2.83Å; S86-T90 PolarHBondContact O-OG1 3.45Å; R87-T90 PolarHBondContact O-N 3.01Å; R87-T90 PolarHBondContact O-OG1 2.86Å; F88-T90 PolarHBondContact O-N 3.37Å; T90-G92 PolarHBondContact O-N 2.72Å; T90-G92 VanDerWaalsContact O-N 3.11Å; T90-N93 PolarHBondContact O-N 3.05Å; T90-S95 WeakPolarHBondContact CB-OG 3.29Å; T90-S95 WeakPolarHBondContact CG2-O 3.21Å; T90-S95 VanDerWaalsContact CG2-OG 3.27Å; T90-S95 WeakPolarHBondContact CG2-OG 3.42Å; T90-S95 PolarHBondContact OG1-O 3.17Å; T90-P222 HydrophobicContact CG2-CB 4.19Å
91	A	68.2	Low	78.4	Confident	70 Å²	70	39.3 Å²	39.3	58%	0.579	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	31.7	179.8	0	0	0	0	0	113.6	F88	F88-A91 PolarHBondContact O-N 2.82Å
92	G	64.9	Low	78.5	Confident	50 Å²	50	38.8 Å²	38.8	52%	0.515	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.5	2.2	176.4	0	0	0	0	0	116.2	R87 T90 D94	R87-G92 PolarHBondContact O-N 3.21Å; R87-G92 VanDerWaalsContact O-N 3.14Å; T90-G92 PolarHBondContact O-N 2.72Å; T90-G92 VanDerWaalsContact O-N 3.11Å; G92-D94 PolarHBondContact O-N 3.32Å
93	N	66.2	Low	78.8	Confident	122 Å²	122	37.4 Å²	37.4	65%	0.652	21%	0.213	S	C	*	.	S	Bend	trans	-72.6	16	178.1	-80.9	-17.7	0	0	0	114.6	T90 S95	T90-N93 PolarHBondContact O-N 3.05Å; N93-S95 PolarHBondContact O-N 3.06Å
94	D	61.8	Low	79.2	Confident	102 Å²	102	32 Å²	32	55%	0.545	19%	0.187	S	C	.	.			trans	45.9	30.8	-177.2	-87.9	-28.8	0	0	0	114.1	R87 G92	R87-D94 IonicContact CZ-OD1 3.66Å; R87-D94 IonicContact NE-OD1 2.91Å; R87-D94 PolarHBondContact NE-OD1 3.2Å; R87-D94 IonicContact NH2-OD1 3.77Å; G92-D94 PolarHBondContact O-N 3.32Å
95	S	68.3	Low	79.5	Confident	7 Å²	7	30.5 Å²	30.5	5%	0.049	18%	0.18	C	C	.	.			trans	-96	142	178.1	28.7	0	0	0	0	110.3	T90 N93	T90-S95 WeakPolarHBondContact CB-OG 3.29Å; T90-S95 WeakPolarHBondContact CG2-O 3.21Å; T90-S95 VanDerWaalsContact CG2-OG 3.27Å; T90-S95 WeakPolarHBondContact CG2-OG 3.42Å; T90-S95 PolarHBondContact OG1-O 3.17Å; N93-S95 PolarHBondContact O-N 3.06Å
96	A	73.4	Confident	79.7	Confident	28 Å²	28	31 Å²	31	23%	0.231	18%	0.183	C	C	.	.			trans	-65.6	143.7	169.6	0	0	0	0	0	110.4	T223 N225	A96-T223 WeakPolarHBondContact CB-OG1 3.43Å; A96-T223 PolarHBondContact O-N 3.27Å; A96-T223 PolarHBondContact O-OG1 2.75Å; A96-N225 PolarHBondContact N-OD1 3.23Å
97	S	76.6	Confident	79.9	Confident	3 Å²	3	34.7 Å²	34.7	2%	0.021	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	136.6	174.4	-175.3	0	0	0	0	107.7
98	E	82.5	Confident	80.1	Confident	44 Å²	44	35.6 Å²	35.6	21%	0.206	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	154.2	177.8	-74.2	-173.7	176.7	0	0	110.9	N220 Y221 T223 I230	E98-N220 WeakPolarHBondContact O-CA 3.27Å; E98-Y221 HydrophobicContact CB-CE1 4.28Å; E98-Y221 HydrophobicContact CB-CE2 4.36Å; E98-Y221 PolarHBondContact N-O 3.17Å; E98-Y221 PolarHBondContact O-N 3.04Å; E98-Y221 PolarHBondContact OE2-OH 3.32Å; E98-Y221 VanDerWaalsContact OE2-OH 3.12Å; E98-T223 HydrophobicContact CB-CG2 3.88Å; E98-T223 HydrophobicContact CG-CG2 3.64Å; E98-I230 VanDerWaalsContact CD-CD1 3.46Å; E98-I230 WeakPolarHBondContact OE1-CD1 3.33Å; E98-I230 VanDerWaalsContact OE2-CD1 3.28Å; E98-I230 WeakPolarHBondContact OE2-CD1 3.34Å; E98-I230 VanDerWaalsContact OE2-CG1 3.29Å; E98-I230 WeakPolarHBondContact OE2-CG1 3.46Å; E98-I230 WeakPolarHBondContact OE2-CG2 3.47Å
99	A	84.4	Confident	80.2	Confident	9 Å²	9	36 Å²	36	7%	0.074	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	128.9	175.1	0	0	0	0	0	110.1	F101 M218 Y219 N220	A99-F101 HydrophobicContact CB-CD2 4.33Å; A99-F101 HydrophobicContact CB-CE2 3.57Å; A99-F101 HydrophobicContact CB-CZ 3.73Å; A99-M218 HydrophobicContact CB-CG 4.46Å; A99-Y219 WeakPolarHBondContact CA-O 3.33Å; A99-N220 WeakPolarHBondContact CB-OD1 3.5Å
100	F	89.8	Confident	80.8	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	121.8	169.8	-161.5	-81.7	0	0	0	109.7	V102 Y219 Y221 F233 E234 L237 I258	F100-V102 HydrophobicContact CD1-CG2 3.77Å; F100-V102 HydrophobicContact CE1-CG2 3.72Å; F100-Y219 PolarHBondContact N-O 3.03Å; F100-Y219 PolarHBondContact O-N 3.14Å; F100-Y221 HydrophobicContact CB-CE1 3.91Å; F100-F233 HydrophobicContact CB-CE1 3.89Å; F100-F233 HydrophobicContact CD2-CD1 4.42Å; F100-F233 HydrophobicContact CD2-CE1 4.24Å; F100-F233 HydrophobicContact CG-CE1 4.03Å; F100-E234 HydrophobicContact CE2-CB 3.95Å; F100-E234 HydrophobicContact CE2-CG 3.82Å; F100-E234 HydrophobicContact CZ-CG 4.26Å; F100-L237 HydrophobicContact CD1-CD2 3.43Å; F100-L237 VanDerWaalsContact CD1-CD2 3.43Å; F100-L237 HydrophobicContact CE1-CD2 3.31Å; F100-L237 HydrophobicContact CE1-CG 4.28Å; F100-L237 HydrophobicContact CG-CD2 4.16Å; F100-L237 HydrophobicContact CZ-CD2 3.96Å; F100-I258 HydrophobicContact CE2-CD1 3.61Å; F100-I258 HydrophobicContact CZ-CD1 3.65Å
101	F	90.6	Very high	81.8	Confident	7 Å²	7	38.5 Å²	38.5	3%	0.031	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	137	-177.5	-61.9	-86.2	0	0	0	110.6	A99 H216 L217 M218 S253 F254 Y537 F550	A99-F101 HydrophobicContact CB-CD2 4.33Å; A99-F101 HydrophobicContact CB-CE2 3.57Å; A99-F101 HydrophobicContact CB-CZ 3.73Å; F101-H216 AromaticContact CD1-CE1 3.39Å; F101-H216 WeakPolarHBondContact CD1-CE1 3.32Å; F101-H216 AromaticContact CD1-NE2 3.4Å; F101-H216 WeakPolarHBondContact CD1-NE2 3.16Å; F101-H216 AromaticContact CE1-CE1 4Å; F101-H216 AromaticContact CG-NE2 3.82Å; F101-L217 CarbonylContact C-O 3.3Å; F101-L217 VanDerWaalsContact CA-O 3.29Å; F101-L217 WeakPolarHBondContact CA-O 3.32Å; F101-M218 HydrophobicContact CD1-CB 4.02Å; F101-M218 HydrophobicContact CD1-CG 3.97Å; F101-M218 HydrophobicContact CE1-CB 4.02Å; F101-M218 HydrophobicContact CE1-CG 3.57Å; F101-M218 HydrophobicContact CE1-SD 3.74Å; F101-M218 HydrophobicContact CZ-CG 4.21Å; F101-M218 HydrophobicContact CZ-SD 4.22Å; F101-S253 CarbonylContact O-C 3.57Å; F101-S253 VanDerWaalsContact O-CA 3.29Å; F101-S253 WeakPolarHBondContact O-CA 3.29Å; F101-F254 HydrophobicContact CB-CB 4.27Å; F101-F254 HydrophobicContact CB-CD1 4.45Å; F101-F254 AromaticContact CD2-CD1 3.75Å; F101-F254 HydrophobicContact CD2-CD1 3.75Å; F101-F254 HydrophobicContact CD2-CE1 4.3Å; F101-F254 HydrophobicContact CE2-CD1 4.47Å; F101-F254 HydrophobicContact CG-CD1 4.47Å; F101-F254 PolarHBondContact N-O 2.9Å; F101-F254 PolarHBondContact O-N 3.39Å; F101-Y537 HydrophobicContact CB-CE2 4.07Å; F101-Y537 WeakPolarHBondContact CB-OH 3.48Å; F101-F550 HydrophobicContact CE1-CZ 4.39Å
102	V	92	Very high	82.9	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	108.7	174.8	-175.2	0	0	0	0	109.1	F100 V104 L217 Y219 L237 L241 F251 N252	F100-V102 HydrophobicContact CD1-CG2 3.77Å; F100-V102 HydrophobicContact CE1-CG2 3.72Å; V102-V104 HydrophobicContact CG1-CG2 4.16Å; V102-L217 HydrophobicContact CB-CB 4.21Å; V102-L217 PolarHBondContact N-O 2.86Å; V102-L217 PolarHBondContact O-N 3.3Å; V102-Y219 HydrophobicContact CG2-CD2 4.34Å; V102-Y219 HydrophobicContact CG2-CE2 4.04Å; V102-L237 HydrophobicContact CG2-CD2 4.27Å; V102-L241 HydrophobicContact CG1-CD1 4.09Å; V102-L241 HydrophobicContact CG2-CD1 4.27Å; V102-F251 HydrophobicContact CG1-CB 4.4Å; V102-F251 HydrophobicContact CG1-CD1 4.27Å; V102-N252 CarbonylContact C-O 3.51Å; V102-N252 WeakPolarHBondContact CA-O 3.38Å
103	G	92.3	Very high	84	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	112.4	169.8	0	0	0	0	0	110.7	N252	G103-N252 PolarHBondContact N-O 3.19Å; G103-N252 PolarHBondContact O-N 3.3Å
104	V	92.8	Very high	85.2	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	120.4	175.8	-168.3	0	0	0	0	109.5	V102 L112 I121 L214 I215 L217 L249 Q250 F251	V102-V104 HydrophobicContact CG1-CG2 4.16Å; V104-L112 WeakPolarHBondContact O-CD1 3.46Å; V104-I121 HydrophobicContact CB-CD1 4.24Å; V104-I121 HydrophobicContact CG1-CD1 3.73Å; V104-I121 HydrophobicContact CG1-CG1 4.02Å; V104-L214 WeakPolarHBondContact O-CA 3.41Å; V104-L214 WeakPolarHBondContact O-CD1 3.2Å; V104-I215 PolarHBondContact N-O 3.14Å; V104-I215 PolarHBondContact O-N 2.64Å; V104-L217 HydrophobicContact CG2-CD1 4.03Å; V104-L217 HydrophobicContact CG2-CG 4.44Å; V104-L249 HydrophobicContact CG1-CB 4.33Å; V104-L249 HydrophobicContact CG1-CD2 4.02Å; V104-Q250 WeakPolarHBondContact CA-O 3.46Å; V104-F251 HydrophobicContact CB-CD1 4.46Å; V104-F251 HydrophobicContact CB-CE1 4.5Å; V104-F251 HydrophobicContact CG1-CD1 4.09Å; V104-F251 HydrophobicContact CG1-CE1 3.79Å; V104-F251 HydrophobicContact CG2-CD1 3.81Å; V104-F251 HydrophobicContact CG2-CE1 3.94Å
105	A	91.5	Very high	86.4	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	158.6	177.6	0	0	0	0	0	110.7	L214 Q250 L540	A105-L214 HydrophobicContact CB-CD1 4Å; A105-Q250 PolarHBondContact N-O 3.17Å; A105-Q250 WeakPolarHBondContact O-CA 3.14Å; A105-Q250 WeakPolarHBondContact O-CB 3.35Å; A105-Q250 PolarHBondContact O-N 3.07Å; A105-L540 HydrophobicContact CB-CD1 4.29Å; A105-L540 HydrophobicContact CB-CD2 4.37Å
106	L	91.2	Very high	87.5	Confident	18 Å²	18	39.2 Å²	39.2	9%	0.094	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	153.3	167.7	-69.4	168.9	0	0	0	110.4	D108 N109 L112 Y117 L249	L106-D108 PolarHBondContact O-N 3.39Å; L106-N109 PolarHBondContact O-N 3.42Å; L106-L112 HydrophobicContact CD1-CD2 4.25Å; L106-L112 HydrophobicContact CD2-CD2 4.21Å; L106-L112 HydrophobicContact CG-CD2 3.72Å; L106-L112 HydrophobicContact CG-CG 4.4Å; L106-Y117 HydrophobicContact CD1-CD2 4.44Å; L106-Y117 HydrophobicContact CD1-CE2 4.23Å; L106-Y117 HydrophobicContact CD2-CD1 4.14Å; L106-Y117 HydrophobicContact CD2-CD2 4.4Å; L106-Y117 HydrophobicContact CD2-CE1 3.83Å; L106-Y117 HydrophobicContact CD2-CE2 4.14Å; L106-Y117 HydrophobicContact CD2-CG 4.43Å; L106-L249 HydrophobicContact CD2-CD2 3.96Å
107	N	85.3	Confident	88.3	Confident	90 Å²	90	40.7 Å²	40.7	48%	0.481	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-41.2	174.9	-71.8	-21.3	0	0	0	112.7	Q250	N107-Q250 WeakPolarHBondContact OD1-CG 3.4Å; N107-Q250 PolarHBondContact OD1-NE2 2.63Å
108	D	84	Confident	88.9	Confident	149 Å²	149	40.5 Å²	40.5	80%	0.797	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90	6	-178.3	-58.6	-26.3	0	0	0	113.6	L106 G110	L106-D108 PolarHBondContact O-N 3.39Å; D108-G110 PolarHBondContact O-N 3.16Å
109	N	81.8	Confident	89.3	Confident	44 Å²	44	39.4 Å²	39.4	24%	0.235	20%	0.201	C	C	.	.			trans	52.6	35	-169.2	-46.3	-61.9	0	0	0	113.5	L106 K213 R536	L106-N109 PolarHBondContact O-N 3.42Å; N109-K213 WeakPolarHBondContact O-CD 3.43Å; N109-R536 PolarHBondContact OD1-NH2 3.29Å
110	G	88.1	Confident	89.5	Confident	25 Å²	25	40.2 Å²	40.2	26%	0.258	21%	0.208	S	C	.	.			trans	-76.9	-171.7	177.3	0	0	0	0	0	114	D108 L112	D108-G110 PolarHBondContact O-N 3.16Å; G110-L112 PolarHBondContact O-N 3.41Å
111	N	91.5	Very high	89.6	Confident	38 Å²	38	40.2 Å²	40.2	20%	0.203	21%	0.208	C	C	.	.			trans	-77.9	119.2	-177.7	-172.9	13.4	0	0	0	113.1	M113 Q114 K210 E211 V212	N111-M113 WeakPolarHBondContact OD1-CB 3.44Å; N111-M113 PolarHBondContact OD1-N 3.46Å; N111-Q114 PolarHBondContact O-NE2 3.16Å; N111-Q114 VanDerWaalsContact O-NE2 3.09Å; N111-K210 PolarHBondContact ND2-O 2.97Å; N111-E211 HydrophobicContact CB-CB 4.31Å; N111-E211 HydrophobicContact CB-CG 3.71Å; N111-E211 VanDerWaalsContact OD1-CA 3.26Å; N111-E211 WeakPolarHBondContact OD1-CA 3.43Å; N111-V212 PolarHBondContact OD1-N 2.87Å; N111-V212 PolarHBondContact OD1-O 3.38Å
112	L	91.3	Very high	89.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.216	C	C	.	.			trans	-80.8	-16.7	173.3	-71.6	169.3	0	0	0	114.1	V104 L106 G110 Q114 T118 I121 V212 K213 I215 L249	V104-L112 WeakPolarHBondContact O-CD1 3.46Å; L106-L112 HydrophobicContact CD1-CD2 4.25Å; L106-L112 HydrophobicContact CD2-CD2 4.21Å; L106-L112 HydrophobicContact CG-CD2 3.72Å; L106-L112 HydrophobicContact CG-CG 4.4Å; G110-L112 PolarHBondContact O-N 3.41Å; L112-Q114 PolarHBondContact O-N 2.93Å; L112-T118 WeakPolarHBondContact O-CG2 3.39Å; L112-I121 HydrophobicContact CD2-CD1 4.24Å; L112-V212 WeakPolarHBondContact CB-O 3.5Å; L112-V212 PolarHBondContact N-O 3.3Å; L112-K213 WeakPolarHBondContact CD1-O 3.46Å; L112-I215 HydrophobicContact CB-CD1 4.19Å; L112-I215 HydrophobicContact CB-CG1 4.47Å; L112-I215 HydrophobicContact CD1-CB 4.37Å; L112-I215 HydrophobicContact CD1-CD1 4.29Å; L112-I215 HydrophobicContact CD1-CG1 3.89Å; L112-L249 HydrophobicContact CD2-CD2 3.78Å
113	M	89.1	Confident	89.6	Confident	10 Å²	10	49.8 Å²	49.8	5%	0.049	25%	0.247	C	C	.	.			trans	-73.3	48.2	178.3	-64.7	-60	-68.3	0	0	112.7	N111 T118 Y168 I209 V212	N111-M113 WeakPolarHBondContact OD1-CB 3.44Å; N111-M113 PolarHBondContact OD1-N 3.46Å; M113-T118 HydrophobicContact SD-CG2 4.3Å; M113-Y168 HydrophobicContact CE-CD1 3.81Å; M113-Y168 HydrophobicContact CE-CD2 3.67Å; M113-Y168 HydrophobicContact CE-CE1 3.99Å; M113-Y168 HydrophobicContact CE-CE2 3.85Å; M113-Y168 HydrophobicContact CE-CG 3.65Å; M113-I209 HydrophobicContact CE-CG2 4.36Å; M113-I209 HydrophobicContact CG-CG2 4.25Å; M113-V212 HydrophobicContact CG-CB 3.69Å; M113-V212 HydrophobicContact CG-CG2 3.39Å; M113-V212 HydrophobicContact SD-CB 4.16Å; M113-V212 HydrophobicContact SD-CG2 3.68Å
114	Q	90.2	Very high	89.6	Confident	92 Å²	92	50.1 Å²	50.1	43%	0.43	25%	0.248	S	C	.	.	S	Bend	trans	-116.4	141	172.2	-53.1	178.7	28.2	0	0	108.4	N111 L112 N116 Y117 T118	N111-Q114 PolarHBondContact O-NE2 3.16Å; N111-Q114 VanDerWaalsContact O-NE2 3.09Å; L112-Q114 PolarHBondContact O-N 2.93Å; Q114-N116 PolarHBondContact O-N 2.89Å; Q114-N116 VanDerWaalsContact O-N 3.11Å; Q114-Y117 HydrophobicContact CB-CD2 3.9Å; Q114-Y117 HydrophobicContact CG-CD2 4.24Å; Q114-Y117 PolarHBondContact O-N 3.39Å; Q114-T118 PolarHBondContact O-N 2.92Å; Q114-T118 PolarHBondContact O-OG1 2.67Å; Q114-T118 VanDerWaalsContact O-OG1 3.1Å
115	Y	88.3	Confident	89.6	Confident	148 Å²	148	50.5 Å²	50.5	58%	0.58	25%	0.25	S	C	*	.	H	α-helix	trans	-52	-41.4	-172.6	-177.2	-100.3	0	0	0	113.3	T118 T119 F169	Y115-T118 PolarHBondContact O-OG1 3.32Å; Y115-T119 HydrophobicContact CD1-CG2 4.42Å; Y115-T119 HydrophobicContact CD2-CG2 3.87Å; Y115-T119 HydrophobicContact CE1-CG2 4.18Å; Y115-T119 HydrophobicContact CE2-CG2 3.6Å; Y115-T119 HydrophobicContact CG-CG2 4.28Å; Y115-T119 VanDerWaalsContact O-CB 3.31Å; Y115-T119 WeakPolarHBondContact O-CB 3.26Å; Y115-T119 WeakPolarHBondContact O-CG2 3.45Å; Y115-T119 PolarHBondContact O-N 3.42Å; Y115-T119 VanDerWaalsContact O-N 3.1Å; Y115-T119 PolarHBondContact O-OG1 3.19Å; Y115-F169 HydrophobicContact CD2-CB 4.01Å; Y115-F169 AromaticContact CD2-CD1 3.81Å; Y115-F169 HydrophobicContact CD2-CD1 3.81Å; Y115-F169 HydrophobicContact CD2-CD2 4.23Å; Y115-F169 HydrophobicContact CD2-CE1 4.37Å; Y115-F169 AromaticContact CD2-CG 3.74Å; Y115-F169 HydrophobicContact CD2-CG 3.74Å; Y115-F169 HydrophobicContact CE2-CB 4.39Å; Y115-F169 HydrophobicContact CG-CD1 4.38Å
116	N	89.8	Confident	89.6	Confident	116 Å²	116	53.5 Å²	53.5	62%	0.62	27%	0.266	S	S	*	.	H	α-helix	trans	-63.8	-44	-179.7	-168.3	22.9	0	0	0	112.4	Q114 T119 A120	Q114-N116 PolarHBondContact O-N 2.89Å; Q114-N116 VanDerWaalsContact O-N 3.11Å; N116-T119 PolarHBondContact O-OG1 3.5Å; N116-A120 VanDerWaalsContact O-CB 3.25Å; N116-A120 WeakPolarHBondContact O-CB 3.28Å; N116-A120 PolarHBondContact O-N 3.33Å
117	Y	91.2	Very high	89.6	Confident	59 Å²	59	56.4 Å²	56.4	23%	0.231	28%	0.276	C	S	.	.	H	α-helix	trans	-76.4	-45.5	-177.9	-61.1	-55.9	0	0	0	112.1	L106 Q114 A120 I121 L249	L106-Y117 HydrophobicContact CD1-CD2 4.44Å; L106-Y117 HydrophobicContact CD1-CE2 4.23Å; L106-Y117 HydrophobicContact CD2-CD1 4.14Å; L106-Y117 HydrophobicContact CD2-CD2 4.4Å; L106-Y117 HydrophobicContact CD2-CE1 3.83Å; L106-Y117 HydrophobicContact CD2-CE2 4.14Å; L106-Y117 HydrophobicContact CD2-CG 4.43Å; Q114-Y117 HydrophobicContact CB-CD2 3.9Å; Q114-Y117 HydrophobicContact CG-CD2 4.24Å; Q114-Y117 PolarHBondContact O-N 3.39Å; Y117-A120 PolarHBondContact O-N 3.47Å; Y117-I121 VanDerWaalsContact O-CG1 3.24Å; Y117-I121 WeakPolarHBondContact O-CG1 3.48Å; Y117-I121 PolarHBondContact O-N 2.95Å; Y117-L249 HydrophobicContact CD1-CD2 3.85Å; Y117-L249 HydrophobicContact CD1-CG 4.27Å; Y117-L249 HydrophobicContact CG-CD2 4.39Å
118	T	90.2	Very high	89.8	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63	-45	179.8	52.4	0	0	0	0	111.9	L112 M113 Q114 Y115 A120 I121 D122 I165 F169	L112-T118 WeakPolarHBondContact O-CG2 3.39Å; M113-T118 HydrophobicContact SD-CG2 4.3Å; Q114-T118 PolarHBondContact O-N 2.92Å; Q114-T118 PolarHBondContact O-OG1 2.67Å; Q114-T118 VanDerWaalsContact O-OG1 3.1Å; Y115-T118 PolarHBondContact O-OG1 3.32Å; T118-A120 VanDerWaalsContact C-N 3.31Å; T118-A120 PolarHBondContact O-N 3.26Å; T118-I121 PolarHBondContact O-N 3.28Å; T118-D122 WeakPolarHBondContact O-CB 3.43Å; T118-D122 PolarHBondContact O-N 3.44Å; T118-I165 HydrophobicContact CG2-CG1 4.47Å; T118-F169 HydrophobicContact CG2-CE2 3.82Å; T118-F169 HydrophobicContact CG2-CZ 4.06Å; T118-F169 WeakPolarHBondContact OG1-CE2 3.39Å; T118-F169 WeakPolarHBondContact OG1-CZ 3.4Å
119	T	89.1	Confident	90.1	Very high	20 Å²	20	46 Å²	46	12%	0.123	22%	0.22	C	C	.	.	H	α-helix	trans	-68.1	-31.4	177.5	59.5	0	0	0	0	112.3	Y115 N116 R123	Y115-T119 HydrophobicContact CD1-CG2 4.42Å; Y115-T119 HydrophobicContact CD2-CG2 3.87Å; Y115-T119 HydrophobicContact CE1-CG2 4.18Å; Y115-T119 HydrophobicContact CE2-CG2 3.6Å; Y115-T119 HydrophobicContact CG-CG2 4.28Å; Y115-T119 VanDerWaalsContact O-CB 3.31Å; Y115-T119 WeakPolarHBondContact O-CB 3.26Å; Y115-T119 WeakPolarHBondContact O-CG2 3.45Å; Y115-T119 PolarHBondContact O-N 3.42Å; Y115-T119 VanDerWaalsContact O-N 3.1Å; Y115-T119 PolarHBondContact O-OG1 3.19Å; N116-T119 PolarHBondContact O-OG1 3.5Å; T119-R123 WeakPolarHBondContact O-CB 3.4Å; T119-R123 VanDerWaalsContact O-CG 3.23Å; T119-R123 WeakPolarHBondContact O-CG 3.38Å; T119-R123 PolarHBondContact O-N 3.31Å
120	A	90.2	Very high	90.4	Very high	27 Å²	27	49.1 Å²	49.1	22%	0.223	23%	0.232	C	C	.	.	H	α-helix	trans	-64.9	-44.5	171	0	0	0	0	0	111.4	N116 Y117 T118 R123 I124 L249	N116-A120 VanDerWaalsContact O-CB 3.25Å; N116-A120 WeakPolarHBondContact O-CB 3.28Å; N116-A120 PolarHBondContact O-N 3.33Å; Y117-A120 PolarHBondContact O-N 3.47Å; T118-A120 VanDerWaalsContact C-N 3.31Å; T118-A120 PolarHBondContact O-N 3.26Å; A120-R123 PolarHBondContact O-N 3.4Å; A120-I124 WeakPolarHBondContact O-CG1 3.38Å; A120-I124 PolarHBondContact O-N 2.96Å; A120-L249 HydrophobicContact CB-CD1 4.45Å
121	I	92	Very high	90.5	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.9	-40.7	178.1	-66.1	166.7	0	0	0	111.2	V104 L112 Y117 T118 I124 N125 L161 I215 L217 L249	V104-I121 HydrophobicContact CB-CD1 4.24Å; V104-I121 HydrophobicContact CG1-CD1 3.73Å; V104-I121 HydrophobicContact CG1-CG1 4.02Å; L112-I121 HydrophobicContact CD2-CD1 4.24Å; Y117-I121 VanDerWaalsContact O-CG1 3.24Å; Y117-I121 WeakPolarHBondContact O-CG1 3.48Å; Y117-I121 PolarHBondContact O-N 2.95Å; T118-I121 PolarHBondContact O-N 3.28Å; I121-I124 WeakPolarHBondContact O-CB 3.47Å; I121-I124 PolarHBondContact O-N 2.68Å; I121-N125 PolarHBondContact O-N 3.46Å; I121-L161 HydrophobicContact CG2-CD2 3.99Å; I121-I215 HydrophobicContact CD1-CD1 3.78Å; I121-I215 HydrophobicContact CG2-CG2 4.33Å; I121-L217 HydrophobicContact CG2-CD1 4.22Å; I121-L217 HydrophobicContact CG2-CD2 4.28Å; I121-L249 HydrophobicContact CD1-CD2 4.49Å; I121-L249 HydrophobicContact CG1-CD1 4.22Å
122	D	91.5	Very high	90.5	Very high	36 Å²	36	51.3 Å²	51.3	19%	0.193	24%	0.238	C	C	.	.	H	α-helix	trans	-63.5	-44.2	176	-169.8	57.3	0	0	0	111.7	T118 I124 N125 D126 I165	T118-D122 WeakPolarHBondContact O-CB 3.43Å; T118-D122 PolarHBondContact O-N 3.44Å; D122-I124 VanDerWaalsContact C-N 3.29Å; D122-I124 PolarHBondContact O-N 3.31Å; D122-N125 WeakPolarHBondContact O-CB 3.29Å; D122-N125 PolarHBondContact O-N 3.24Å; D122-N125 VanDerWaalsContact O-N 3.14Å; D122-D126 WeakPolarHBondContact O-CB 3.43Å; D122-D126 PolarHBondContact O-N 2.65Å; D122-I165 HydrophobicContact CB-CD1 3.96Å
123	R	91	Very high	90.5	Very high	173 Å²	173	55 Å²	55	65%	0.653	26%	0.261	S	S	*	.	H	α-helix	trans	-60.4	-36.3	172.1	-73	174.2	-167.4	175.2	6.4	113	T119 A120 Y127	T119-R123 WeakPolarHBondContact O-CB 3.4Å; T119-R123 VanDerWaalsContact O-CG 3.23Å; T119-R123 WeakPolarHBondContact O-CG 3.38Å; T119-R123 PolarHBondContact O-N 3.31Å; A120-R123 PolarHBondContact O-N 3.4Å; R123-Y127 WeakPolarHBondContact O-CB 3.23Å; R123-Y127 PolarHBondContact O-N 2.91Å
124	I	91.5	Very high	90.4	Very high	8 Å²	8	54.6 Å²	54.6	4%	0.041	26%	0.258	C	S	.	.	H	α-helix	trans	-63.7	-47.9	174.6	-71	165.6	0	0	0	109.7	A120 I121 D122 D126 Y127 V128 Y240 L241 L244 F251	A120-I124 WeakPolarHBondContact O-CG1 3.38Å; A120-I124 PolarHBondContact O-N 2.96Å; I121-I124 WeakPolarHBondContact O-CB 3.47Å; I121-I124 PolarHBondContact O-N 2.68Å; D122-I124 VanDerWaalsContact C-N 3.29Å; D122-I124 PolarHBondContact O-N 3.31Å; I124-D126 PolarHBondContact O-N 3.23Å; I124-Y127 PolarHBondContact O-N 3.07Å; I124-V128 VanDerWaalsContact O-CG2 3.3Å; I124-V128 WeakPolarHBondContact O-CG2 3.49Å; I124-V128 PolarHBondContact O-N 3.06Å; I124-Y240 HydrophobicContact CB-CE1 4.47Å; I124-Y240 HydrophobicContact CG1-CE1 4.39Å; I124-Y240 HydrophobicContact CG2-CE1 4.07Å; I124-L241 HydrophobicContact CG2-CD2 4.12Å; I124-L244 HydrophobicContact CD1-CD1 3.65Å; I124-L244 HydrophobicContact CG1-CD1 3.58Å; I124-F251 HydrophobicContact CD1-CE1 3.68Å; I124-F251 HydrophobicContact CD1-CZ 3.52Å
125	N	92.2	Very high	90.1	Very high	7 Å²	7	53.9 Å²	53.9	4%	0.037	26%	0.258	C	S	.	.	H	α-helix	trans	-58.8	-47.6	177.5	-174.4	59.6	0	0	0	111.8	I121 D122 Y127 V128 L129 N158 Y219	I121-N125 PolarHBondContact O-N 3.46Å; D122-N125 WeakPolarHBondContact O-CB 3.29Å; D122-N125 PolarHBondContact O-N 3.24Å; D122-N125 VanDerWaalsContact O-N 3.14Å; N125-Y127 PolarHBondContact O-N 3.03Å; N125-V128 PolarHBondContact O-N 2.68Å; N125-L129 WeakPolarHBondContact O-CG 3.32Å; N125-L129 PolarHBondContact O-N 3.32Å; N125-N158 PolarHBondContact OD1-ND2 2.89Å; N125-Y219 WeakPolarHBondContact OD1-CE1 3.35Å; N125-Y219 PolarHBondContact OD1-OH 3.3Å
126	D	91.4	Very high	89.8	Confident	63 Å²	63	48 Å²	48	34%	0.337	24%	0.236	S	C	.	.	H	α-helix	trans	-62.1	-40.6	177.9	-109	7	0	0	0	112.6	D122 I124 K130	D122-D126 WeakPolarHBondContact O-CB 3.43Å; D122-D126 PolarHBondContact O-N 2.65Å; I124-D126 PolarHBondContact O-N 3.23Å; D126-K130 VanDerWaalsContact O-CB 3.32Å; D126-K130 WeakPolarHBondContact O-CB 3.43Å; D126-K130 PolarHBondContact O-N 3.07Å; D126-K130 WeakPolarHBondContact OD1-CE 3.43Å; D126-K130 IonicContact OD1-NZ 3.16Å; D126-K130 PolarHBondContact OD1-NZ 2.93Å; D126-K130 IonicContact OD2-NZ 4Å; D126-K130 PolarHBondContact OD2-NZ 3.27Å
127	Y	91.6	Very high	89.4	Confident	80 Å²	80	50 Å²	50	31%	0.314	24%	0.241	S	C	.	.	I	π-helix	trans	-63.3	-44.9	175.4	-179.7	-88.5	0	0	0	111.8	R123 I124 N125 N131 L132 Y240	R123-Y127 WeakPolarHBondContact O-CB 3.23Å; R123-Y127 PolarHBondContact O-N 2.91Å; I124-Y127 PolarHBondContact O-N 3.07Å; N125-Y127 PolarHBondContact O-N 3.03Å; Y127-N131 HydrophobicContact CD2-CB 3.74Å; Y127-N131 HydrophobicContact CE2-CB 3.9Å; Y127-N131 HydrophobicContact CG-CB 4.29Å; Y127-N131 CarbonylContact O-C 3.59Å; Y127-N131 WeakPolarHBondContact O-CA 3.46Å; Y127-N131 PolarHBondContact O-N 3.05Å; Y127-L132 HydrophobicContact CE1-CD1 4.09Å; Y127-L132 PolarHBondContact O-N 3.05Å; Y127-Y240 WeakPolarHBondContact CB-OH 3.31Å; Y127-Y240 AromaticContact CD1-CD1 3.71Å; Y127-Y240 HydrophobicContact CD1-CD1 3.71Å; Y127-Y240 AromaticContact CD1-CD2 3.9Å; Y127-Y240 HydrophobicContact CD1-CD2 3.9Å; Y127-Y240 AromaticContact CD1-CE1 3.33Å; Y127-Y240 HydrophobicContact CD1-CE1 3.33Å; Y127-Y240 AromaticContact CD1-CE2 3.56Å; Y127-Y240 HydrophobicContact CD1-CE2 3.56Å; Y127-Y240 AromaticContact CD1-CG 3.96Å; Y127-Y240 HydrophobicContact CD1-CG 3.96Å; Y127-Y240 AromaticContact CD1-CZ 3.25Å; Y127-Y240 HydrophobicContact CD2-CE2 4.35Å; Y127-Y240 AromaticContact CE1-CD1 3.95Å; Y127-Y240 HydrophobicContact CE1-CD1 3.95Å; Y127-Y240 AromaticContact CE1-CD2 3.49Å; Y127-Y240 HydrophobicContact CE1-CD2 3.49Å; Y127-Y240 VanDerWaalsContact CE1-CD2 3.49Å; Y127-Y240 AromaticContact CE1-CE1 3.96Å; Y127-Y240 HydrophobicContact CE1-CE1 3.96Å; Y127-Y240 AromaticContact CE1-CE2 3.51Å; Y127-Y240 HydrophobicContact CE1-CE2 3.51Å; Y127-Y240 AromaticContact CE1-CG 3.72Å; Y127-Y240 HydrophobicContact CE1-CG 3.72Å; Y127-Y240 AromaticContact CE1-CZ 3.75Å; Y127-Y240 HydrophobicContact CE2-CE2 4.32Å; Y127-Y240 AromaticContact CG-CE1 3.95Å; Y127-Y240 HydrophobicContact CG-CE1 3.95Å; Y127-Y240 AromaticContact CG-CE2 3.99Å; Y127-Y240 HydrophobicContact CG-CE2 3.99Å; Y127-Y240 AromaticContact CG-CZ 3.54Å; Y127-Y240 AromaticContact CZ-CE2 3.91Å
128	V	90.7	Very high	88.9	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.26	C	S	.	.	I	π-helix	trans	-62.4	-45.3	-179.7	172.3	0	0	0	0	110.9	I124 N125 L132 F143 Y219 F233 L237 Y240	I124-V128 VanDerWaalsContact O-CG2 3.3Å; I124-V128 WeakPolarHBondContact O-CG2 3.49Å; I124-V128 PolarHBondContact O-N 3.06Å; N125-V128 PolarHBondContact O-N 2.68Å; V128-L132 HydrophobicContact CG1-CD2 4.42Å; V128-L132 VanDerWaalsContact O-CB 3.29Å; V128-L132 WeakPolarHBondContact O-CB 3.49Å; V128-F143 VanDerWaalsContact O-CD1 3.28Å; V128-F143 WeakPolarHBondContact O-CD1 3.24Å; V128-Y219 HydrophobicContact CB-CE1 4.02Å; V128-Y219 HydrophobicContact CG1-CD1 3.9Å; V128-Y219 HydrophobicContact CG1-CE1 3.59Å; V128-Y219 HydrophobicContact CG1-CE2 4.33Å; V128-Y219 HydrophobicContact CG1-CG 4.4Å; V128-F233 HydrophobicContact CG1-CE2 4.47Å; V128-F233 HydrophobicContact CG1-CZ 4.42Å; V128-L237 HydrophobicContact CG1-CD1 4.22Å; V128-L237 HydrophobicContact CG2-CD1 3.48Å; V128-L237 VanDerWaalsContact CG2-CD1 3.48Å; V128-Y240 HydrophobicContact CG2-CD1 4.28Å; V128-Y240 HydrophobicContact CG2-CE1 4.36Å
129	L	88.8	Confident	88.7	Confident	19 Å²	19	54.3 Å²	54.3	10%	0.099	29%	0.286	C	S	.	.	I	π-helix	trans	-73.3	-38.1	-177.6	-67.2	175.4	0	0	0	113.1	N125 F143 D144 Y219	N125-L129 WeakPolarHBondContact O-CG 3.32Å; N125-L129 PolarHBondContact O-N 3.32Å; L129-F143 HydrophobicContact CD2-CE1 4.49Å; L129-D144 VanDerWaalsContact O-CB 3.26Å; L129-D144 WeakPolarHBondContact O-CB 3.21Å; L129-Y219 HydrophobicContact CD2-CD1 4.01Å; L129-Y219 HydrophobicContact CD2-CE1 4.23Å; L129-Y219 HydrophobicContact CG-CE1 4.29Å
130	K	89.6	Confident	88.6	Confident	111 Å²	111	59 Å²	59	48%	0.483	31%	0.311	S	S	.	.	I	π-helix	trans	-103.8	-40	-170.1	-60.5	171.7	-173.9	158.4	0	114.3	D126	D126-K130 VanDerWaalsContact O-CB 3.32Å; D126-K130 WeakPolarHBondContact O-CB 3.43Å; D126-K130 PolarHBondContact O-N 3.07Å; D126-K130 WeakPolarHBondContact OD1-CE 3.43Å; D126-K130 IonicContact OD1-NZ 3.16Å; D126-K130 PolarHBondContact OD1-NZ 2.93Å; D126-K130 IonicContact OD2-NZ 4Å; D126-K130 PolarHBondContact OD2-NZ 3.27Å
131	N	90	Very high	88.4	Confident	104 Å²	104	58.2 Å²	58.2	56%	0.556	30%	0.303	S	S	*	.	I	π-helix	trans	-112.2	-11.3	-165.4	-69.8	-14.1	0	0	0	114.4	Y127 T133	Y127-N131 HydrophobicContact CD2-CB 3.74Å; Y127-N131 HydrophobicContact CE2-CB 3.9Å; Y127-N131 HydrophobicContact CG-CB 4.29Å; Y127-N131 CarbonylContact O-C 3.59Å; Y127-N131 WeakPolarHBondContact O-CA 3.46Å; Y127-N131 PolarHBondContact O-N 3.05Å; N131-T133 PolarHBondContact O-N 2.95Å
132	L	91.5	Very high	88.3	Confident	5 Å²	5	59.9 Å²	59.9	3%	0.026	31%	0.314	C	S	.	.			trans	-63.3	126.9	-178.9	-170.5	71.7	0	0	0	111	Y127 V128 L134 F143 F233 A236	Y127-L132 HydrophobicContact CE1-CD1 4.09Å; Y127-L132 PolarHBondContact O-N 3.05Å; V128-L132 HydrophobicContact CG1-CD2 4.42Å; V128-L132 VanDerWaalsContact O-CB 3.29Å; V128-L132 WeakPolarHBondContact O-CB 3.49Å; L132-L134 HydrophobicContact CD2-CD2 4.07Å; L132-L134 HydrophobicContact CG-CD2 4.25Å; L132-F143 HydrophobicContact CB-CB 4.1Å; L132-F143 WeakPolarHBondContact O-CB 3.43Å; L132-F143 PolarHBondContact O-N 3Å; L132-F233 HydrophobicContact CD2-CD2 3.84Å; L132-F233 HydrophobicContact CD2-CE2 3.64Å; L132-A236 HydrophobicContact CD1-CB 4.14Å; L132-A236 HydrophobicContact CG-CB 4.46Å
133	T	89.9	Confident	88.1	Confident	78 Å²	78	58.1 Å²	58.1	48%	0.479	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	130.6	174.7	58.4	0	0	0	0	110.7	N131 V141	N131-T133 PolarHBondContact O-N 2.95Å; T133-V141 CarbonylContact C-O 3.48Å; T133-V141 WeakPolarHBondContact CA-O 3.43Å
134	L	87.7	Confident	87.9	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	139.3	175.4	-56.5	-167	0	0	0	109.8	L132 I136 N140 V141 F143 I147 T232 F233 A236	L132-L134 HydrophobicContact CD2-CD2 4.07Å; L132-L134 HydrophobicContact CG-CD2 4.25Å; L134-I136 HydrophobicContact CB-CG1 4.25Å; L134-N140 CarbonylContact O-C 3.56Å; L134-N140 WeakPolarHBondContact O-CA 3.5Å; L134-V141 PolarHBondContact N-O 2.94Å; L134-V141 PolarHBondContact O-N 2.97Å; L134-F143 HydrophobicContact CD1-CD2 4.14Å; L134-F143 HydrophobicContact CG-CB 4.45Å; L134-I147 HydrophobicContact CD1-CD1 3.41Å; L134-I147 VanDerWaalsContact CD1-CD1 3.41Å; L134-T232 HydrophobicContact CB-CG2 3.83Å; L134-T232 HydrophobicContact CD2-CG2 4.5Å; L134-F233 HydrophobicContact CD1-CB 4.05Å; L134-F233 HydrophobicContact CD1-CD2 4.38Å; L134-F233 HydrophobicContact CD2-CB 4.3Å; L134-F233 HydrophobicContact CD2-CD2 4.19Å; L134-A236 HydrophobicContact CD2-CB 3.62Å
135	N	85	Confident	87.7	Confident	78 Å²	78	61.1 Å²	61.1	42%	0.417	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	96.3	173.3	-175.8	-17	0	0	0	109.2	G138 T139 T232	N135-G138 VanDerWaalsContact OD1-C 3.28Å; N135-G138 WeakPolarHBondContact OD1-CA 3.41Å; N135-G138 PolarHBondContact OD1-N 3.36Å; N135-T139 CarbonylContact C-O 3.58Å; N135-T139 WeakPolarHBondContact CA-O 3.48Å; N135-T232 WeakPolarHBondContact O-CG2 3.2Å
136	I	80.8	Confident	87.2	Confident	24 Å²	24	65.2 Å²	65.2	12%	0.123	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	115.8	-179	-59.7	173.2	0	0	0	107.4	L134 G138 T139 V141 I229 T232	L134-I136 HydrophobicContact CB-CG1 4.25Å; I136-G138 PolarHBondContact O-N 3.02Å; I136-T139 PolarHBondContact N-O 3.34Å; I136-T139 PolarHBondContact O-N 3.14Å; I136-T139 PolarHBondContact O-OG1 2.87Å; I136-V141 HydrophobicContact CD1-CB 4.27Å; I136-V141 HydrophobicContact CD1-CG1 4.3Å; I136-V141 HydrophobicContact CD1-CG2 4.38Å; I136-I229 HydrophobicContact CD1-CG1 4.26Å; I136-T232 HydrophobicContact CG1-CG2 4.48Å
137	H	81.8	Confident	86.9	Confident	157 Å²	157	62.4 Å²	62.4	73%	0.727	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	30	179.1	-59.3	-65.2	0	0	0	115.4
138	G	81.3	Confident	86.6	Confident	61 Å²	61	58.6 Å²	58.6	63%	0.629	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.3	-10.1	-179.6	0	0	0	0	0	114.7	N135 I136	N135-G138 VanDerWaalsContact OD1-C 3.28Å; N135-G138 WeakPolarHBondContact OD1-CA 3.41Å; N135-G138 PolarHBondContact OD1-N 3.36Å; I136-G138 PolarHBondContact O-N 3.02Å
139	T	85.4	Confident	86.2	Confident	89 Å²	89	60.8 Å²	60.8	55%	0.546	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	132.5	173.9	58.7	0	0	0	0	110.7	N135 I136 V141	N135-T139 CarbonylContact C-O 3.58Å; N135-T139 WeakPolarHBondContact CA-O 3.48Å; I136-T139 PolarHBondContact N-O 3.34Å; I136-T139 PolarHBondContact O-N 3.14Å; I136-T139 PolarHBondContact O-OG1 2.87Å; T139-V141 PolarHBondContact O-N 2.84Å
140	N	86.9	Confident	85.8	Confident	120 Å²	120	65 Å²	65	64%	0.642	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.1	112.9	173.8	-74.2	-21.1	0	0	0	109.5	L134	L134-N140 CarbonylContact O-C 3.56Å; L134-N140 WeakPolarHBondContact O-CA 3.5Å
141	V	86.8	Confident	85.2	Confident	9 Å²	9	59.9 Å²	59.9	6%	0.055	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	134.4	-178.3	160.8	0	0	0	0	109.1	T133 L134 I136 T139 E146	T133-V141 CarbonylContact C-O 3.48Å; T133-V141 WeakPolarHBondContact CA-O 3.43Å; L134-V141 PolarHBondContact N-O 2.94Å; L134-V141 PolarHBondContact O-N 2.97Å; I136-V141 HydrophobicContact CD1-CB 4.27Å; I136-V141 HydrophobicContact CD1-CG1 4.3Å; I136-V141 HydrophobicContact CD1-CG2 4.38Å; T139-V141 PolarHBondContact O-N 2.84Å; V141-E146 HydrophobicContact CG1-CB 3.51Å; V141-E146 HydrophobicContact CG1-CG 3.74Å; V141-E146 WeakPolarHBondContact CG1-OE2 3.41Å; V141-E146 VanDerWaalsContact CG2-OE2 3.27Å; V141-E146 WeakPolarHBondContact CG2-OE2 3.39Å
142	S	88.2	Confident	84.4	Confident	35 Å²	35	58.5 Å²	58.5	25%	0.245	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	127.4	173.1	59.2	0	0	0	0	110.9	D144 R145 E146	S142-D144 PolarHBondContact O-N 3.17Å; S142-R145 WeakPolarHBondContact OG-CB 3.42Å; S142-E146 PolarHBondContact O-N 3.03Å
143	F	88.2	Confident	83.7	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-58.2	-45.6	179.3	177.4	-107.6	0	0	0	112.2	V128 L129 L132 L134 I147 C148 Y221 F233	V128-F143 VanDerWaalsContact O-CD1 3.28Å; V128-F143 WeakPolarHBondContact O-CD1 3.24Å; L129-F143 HydrophobicContact CD2-CE1 4.49Å; L132-F143 HydrophobicContact CB-CB 4.1Å; L132-F143 WeakPolarHBondContact O-CB 3.43Å; L132-F143 PolarHBondContact O-N 3Å; L134-F143 HydrophobicContact CD1-CD2 4.14Å; L134-F143 HydrophobicContact CG-CB 4.45Å; F143-I147 HydrophobicContact CD2-CB 4.11Å; F143-I147 HydrophobicContact CD2-CD1 4.13Å; F143-I147 HydrophobicContact CD2-CG2 4.16Å; F143-I147 HydrophobicContact CE2-CB 4.29Å; F143-I147 HydrophobicContact CE2-CG2 3.83Å; F143-I147 WeakPolarHBondContact O-CB 3.32Å; F143-I147 PolarHBondContact O-N 3.04Å; F143-I147 VanDerWaalsContact O-N 3.15Å; F143-C148 HydrophobicContact CD1-CB 4.26Å; F143-C148 HydrophobicContact CE1-CB 4Å; F143-C148 HydrophobicContact CZ-CB 4.4Å; F143-C148 PolarHBondContact O-N 2.78Å; F143-Y221 HydrophobicContact CE2-CG 4.49Å; F143-F233 HydrophobicContact CD1-CE2 4.32Å; F143-F233 AromaticContact CD2-CD2 3.6Å; F143-F233 HydrophobicContact CD2-CD2 3.6Å; F143-F233 AromaticContact CD2-CE2 3.72Å; F143-F233 HydrophobicContact CD2-CE2 3.72Å; F143-F233 AromaticContact CE1-CE2 3.98Å; F143-F233 HydrophobicContact CE1-CE2 3.98Å; F143-F233 AromaticContact CE2-CD2 3.42Å; F143-F233 HydrophobicContact CE2-CD2 3.42Å; F143-F233 VanDerWaalsContact CE2-CD2 3.42Å; F143-F233 AromaticContact CE2-CE2 3.32Å; F143-F233 HydrophobicContact CE2-CE2 3.32Å; F143-F233 HydrophobicContact CE2-CG 4.34Å; F143-F233 HydrophobicContact CE2-CZ 4.19Å; F143-F233 HydrophobicContact CG-CD2 4.36Å; F143-F233 HydrophobicContact CG-CE2 4.2Å; F143-F233 HydrophobicContact CZ-CD2 4.07Å; F143-F233 AromaticContact CZ-CE2 3.46Å; F143-F233 HydrophobicContact CZ-CE2 3.46Å; F143-F233 VanDerWaalsContact CZ-CE2 3.46Å; F143-F233 HydrophobicContact CZ-CZ 4.03Å
144	D	87.3	Confident	83.4	Confident	48 Å²	48	55.4 Å²	55.4	26%	0.257	30%	0.295	S	S	.	.	H	α-helix	trans	-54.5	-63.2	178	179.6	27.9	0	0	0	112	L129 S142 E146 C148 S149	L129-D144 VanDerWaalsContact O-CB 3.26Å; L129-D144 WeakPolarHBondContact O-CB 3.21Å; S142-D144 PolarHBondContact O-N 3.17Å; D144-E146 PolarHBondContact O-N 2.82Å; D144-C148 PolarHBondContact O-N 2.81Å; D144-S149 WeakPolarHBondContact O-CB 3.22Å; D144-S149 PolarHBondContact O-N 2.97Å
145	R	85.8	Confident	83	Confident	196 Å²	196	62.2 Å²	62.2	74%	0.74	32%	0.32	S	S	*	.	H	α-helix	trans	-72.5	-32.8	-167.7	-58	-178.9	173.2	-174.7	-2.1	113.7	S142 S149	S142-R145 WeakPolarHBondContact OG-CB 3.42Å; R145-S149 WeakPolarHBondContact O-CB 3.32Å; R145-S149 PolarHBondContact O-OG 2.91Å
146	E	83.5	Confident	82.7	Confident	92 Å²	92	61.9 Å²	61.9	43%	0.43	32%	0.316	S	S	.	.	H	α-helix	trans	-100.9	-25.1	-171.3	-68.5	-166.2	-151	0	0	114.4	V141 S142 D144 K150	V141-E146 HydrophobicContact CG1-CB 3.51Å; V141-E146 HydrophobicContact CG1-CG 3.74Å; V141-E146 WeakPolarHBondContact CG1-OE2 3.41Å; V141-E146 VanDerWaalsContact CG2-OE2 3.27Å; V141-E146 WeakPolarHBondContact CG2-OE2 3.39Å; S142-E146 PolarHBondContact O-N 3.03Å; D144-E146 PolarHBondContact O-N 2.82Å; E146-K150 VanDerWaalsContact O-CD 3.31Å; E146-K150 WeakPolarHBondContact O-CD 3.48Å; E146-K150 VanDerWaalsContact O-CE 3.22Å; E146-K150 WeakPolarHBondContact O-CE 3.12Å; E146-K150 PolarHBondContact O-NZ 3.21Å
147	I	85	Confident	82.7	Confident	4 Å²	4	60.9 Å²	60.9	2%	0.021	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	-59.8	-175	-63.3	165.8	0	0	0	110.1	L134 F143 S149 K150 P222 F224 I229	L134-I147 HydrophobicContact CD1-CD1 3.41Å; L134-I147 VanDerWaalsContact CD1-CD1 3.41Å; F143-I147 HydrophobicContact CD2-CB 4.11Å; F143-I147 HydrophobicContact CD2-CD1 4.13Å; F143-I147 HydrophobicContact CD2-CG2 4.16Å; F143-I147 HydrophobicContact CE2-CB 4.29Å; F143-I147 HydrophobicContact CE2-CG2 3.83Å; F143-I147 WeakPolarHBondContact O-CB 3.32Å; F143-I147 PolarHBondContact O-N 3.04Å; F143-I147 VanDerWaalsContact O-N 3.15Å; I147-S149 VanDerWaalsContact C-N 3.32Å; I147-S149 PolarHBondContact O-N 2.96Å; I147-K150 PolarHBondContact O-N 3.36Å; I147-K150 VanDerWaalsContact O-N 3.16Å; I147-P222 HydrophobicContact CG2-CG 4.03Å; I147-P222 WeakPolarHBondContact O-CG 3.48Å; I147-F224 HydrophobicContact CG2-CE2 4.49Å; I147-I229 HydrophobicContact CD1-CG2 3.83Å
148	C	84.7	Confident	82.9	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.007	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-65.7	-35.4	-174.3	-159.5	0	0	0	0	112.3	F143 D144 K150 S151 C154	F143-C148 HydrophobicContact CD1-CB 4.26Å; F143-C148 HydrophobicContact CE1-CB 4Å; F143-C148 HydrophobicContact CZ-CB 4.4Å; F143-C148 PolarHBondContact O-N 2.78Å; D144-C148 PolarHBondContact O-N 2.81Å; C148-K150 PolarHBondContact O-N 3.17Å; C148-K150 VanDerWaalsContact O-N 3.13Å; C148-S151 PolarHBondContact O-N 3.26Å; C148-S151 VanDerWaalsContact O-N 3.13Å; C148-C154 WeakPolarHBondContact CA-SG 3.36Å; C148-C154 HydrophobicContact CB-CB 4.03Å; C148-C154 WeakPolarHBondContact CB-SG 3.36Å; C148-C154 WeakPolarHBondContact SG-CB 3.26Å; C148-C154 CovalentContact SG-SG 2.04Å; C148-C154 PolarHBondContact SG-SG 3.08Å
149	S	82.6	Confident	83	Confident	45 Å²	45	56.1 Å²	56.1	32%	0.315	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-59	-24.7	176.5	70.9	0	0	0	0	114.3	D144 R145 I147	D144-S149 WeakPolarHBondContact O-CB 3.22Å; D144-S149 PolarHBondContact O-N 2.97Å; R145-S149 WeakPolarHBondContact O-CB 3.32Å; R145-S149 PolarHBondContact O-OG 2.91Å; I147-S149 VanDerWaalsContact C-N 3.32Å; I147-S149 PolarHBondContact O-N 2.96Å
150	K	79.4	Confident	82.9	Confident	109 Å²	109	53.2 Å²	53.2	47%	0.474	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-88.6	-9.7	-177.7	-67.2	174.8	-179.7	157.6	0	113.1	E146 I147 C148 F224	E146-K150 VanDerWaalsContact O-CD 3.31Å; E146-K150 WeakPolarHBondContact O-CD 3.48Å; E146-K150 VanDerWaalsContact O-CE 3.22Å; E146-K150 WeakPolarHBondContact O-CE 3.12Å; E146-K150 PolarHBondContact O-NZ 3.21Å; I147-K150 PolarHBondContact O-N 3.36Å; I147-K150 VanDerWaalsContact O-N 3.16Å; C148-K150 PolarHBondContact O-N 3.17Å; C148-K150 VanDerWaalsContact O-N 3.13Å; K150-F224 HydrophobicContact CB-CE1 4.32Å; K150-F224 HydrophobicContact CB-CZ 3.82Å; K150-F224 HydrophobicContact CD-CE1 3.76Å; K150-F224 HydrophobicContact CD-CE2 4.11Å; K150-F224 HydrophobicContact CD-CZ 3.27Å; K150-F224 HydrophobicContact CG-CZ 4.2Å
151	S	78.3	Confident	83	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.021	23%	0.228	C	C	.	.			trans	-126.5	124.3	174.7	178.9	0	0	0	0	110.5	S89 C148 L153 C154	S89-S151 PolarHBondContact O-OG 3.07Å; C148-S151 PolarHBondContact O-N 3.26Å; C148-S151 VanDerWaalsContact O-N 3.13Å; S151-L153 VanDerWaalsContact C-N 3.3Å; S151-L153 PolarHBondContact O-N 2.82Å; S151-C154 WeakPolarHBondContact O-CB 3.49Å; S151-C154 PolarHBondContact O-N 2.74Å
152	V	72.5	Confident	83	Confident	74 Å²	74	47.7 Å²	47.7	45%	0.448	23%	0.232	S	C	.	.	H	α-helix	trans	-68.4	-35.6	179.9	-164	0	0	0	0	111.1	C154 R155 E156	V152-C154 PolarHBondContact O-N 3.17Å; V152-R155 PolarHBondContact O-N 3.26Å; V152-R155 VanDerWaalsContact O-N 3.14Å; V152-E156 PolarHBondContact O-N 3.26Å
153	L	77.7	Confident	82.9	Confident	17 Å²	17	48.7 Å²	48.7	9%	0.089	23%	0.234	C	C	.	.	H	α-helix	trans	-63.5	-25.3	177.3	-149.7	72.8	0	0	0	112.6	S151 S157 N220 Y645	S151-L153 VanDerWaalsContact C-N 3.3Å; S151-L153 PolarHBondContact O-N 2.82Å; L153-S157 PolarHBondContact O-N 2.9Å; L153-S157 PolarHBondContact O-OG 3.4Å; L153-N220 HydrophobicContact CB-CB 4.21Å; L153-N220 HydrophobicContact CD2-CB 3.9Å; L153-N220 HydrophobicContact CG-CB 4.06Å; L153-Y645 WeakPolarHBondContact CD1-OH 3.38Å
154	C	83.2	Confident	82.9	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.007	23%	0.234	C	C	.	.	H	α-helix	trans	-68.6	-44	173.9	-175.2	0	0	0	0	112.3	C148 S151 V152 E156 S157 N220	C148-C154 WeakPolarHBondContact CA-SG 3.36Å; C148-C154 HydrophobicContact CB-CB 4.03Å; C148-C154 WeakPolarHBondContact CB-SG 3.36Å; C148-C154 WeakPolarHBondContact SG-CB 3.26Å; C148-C154 CovalentContact SG-SG 2.04Å; C148-C154 PolarHBondContact SG-SG 3.08Å; S151-C154 WeakPolarHBondContact O-CB 3.49Å; S151-C154 PolarHBondContact O-N 2.74Å; V152-C154 PolarHBondContact O-N 3.17Å; C154-E156 VanDerWaalsContact C-N 3.33Å; C154-E156 PolarHBondContact O-N 2.82Å; C154-S157 WeakPolarHBondContact O-CB 3.15Å; C154-S157 PolarHBondContact O-N 2.9Å; C154-S157 PolarHBondContact O-OG 2.68Å; C154-N220 WeakPolarHBondContact CA-O 3.37Å; C154-N220 WeakPolarHBondContact CB-O 3.36Å; C154-N220 PolarHBondContact SG-O 3.34Å
155	R	79.5	Confident	83	Confident	143 Å²	143	46.7 Å²	46.7	54%	0.54	22%	0.224	S	C	.	.	H	α-helix	trans	-68.6	-33	-179.4	-71.4	-176.2	171	177.5	-0.9	113	V152 S157	V152-R155 PolarHBondContact O-N 3.26Å; V152-R155 VanDerWaalsContact O-N 3.14Å; R155-S157 PolarHBondContact O-N 3.12Å
156	E	77.1	Confident	83.1	Confident	71 Å²	71	41.8 Å²	41.8	33%	0.332	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-2.6	176.9	-61.7	-58.8	141.3	0	0	113	V152 C154 N158 H159	V152-E156 PolarHBondContact O-N 3.26Å; C154-E156 VanDerWaalsContact C-N 3.33Å; C154-E156 PolarHBondContact O-N 2.82Å; E156-N158 PolarHBondContact O-N 3.01Å; E156-H159 PolarHBondContact O-N 2.86Å
157	S	81.9	Confident	83.3	Confident	3 Å²	3	37.4 Å²	37.4	2%	0.021	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	121.1	179.6	-70.6	0	0	0	0	110.8	L153 C154 R155 H159 M218 N220	L153-S157 PolarHBondContact O-N 2.9Å; L153-S157 PolarHBondContact O-OG 3.4Å; C154-S157 WeakPolarHBondContact O-CB 3.15Å; C154-S157 PolarHBondContact O-N 2.9Å; C154-S157 PolarHBondContact O-OG 2.68Å; R155-S157 PolarHBondContact O-N 3.12Å; S157-H159 PolarHBondContact O-N 2.83Å; S157-M218 VanDerWaalsContact CB-O 3.26Å; S157-M218 WeakPolarHBondContact CB-O 3.4Å; S157-M218 PolarHBondContact OG-O 3.04Å; S157-N220 PolarHBondContact OG-N 3.19Å; S157-N220 VanDerWaalsContact OG-N 3.13Å
158	N	86.4	Confident	83.4	Confident	15 Å²	15	39.1 Å²	39.1	8%	0.08	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	15.7	-179.6	-47	-52.4	0	0	0	115.8	N125 E156 A160 L161 L217 M218 Y219	N125-N158 PolarHBondContact OD1-ND2 2.89Å; E156-N158 PolarHBondContact O-N 3.01Å; N158-A160 PolarHBondContact O-N 3.02Å; N158-L161 HydrophobicContact CB-CB 4.46Å; N158-L161 VanDerWaalsContact O-CB 3.22Å; N158-L161 WeakPolarHBondContact O-CB 3.13Å; N158-L161 PolarHBondContact O-N 2.97Å; N158-L217 HydrophobicContact CB-CD2 4.36Å; N158-L217 WeakPolarHBondContact OD1-CA 3.38Å; N158-M218 PolarHBondContact ND2-O 2.82Å; N158-M218 PolarHBondContact OD1-N 3Å; N158-M218 PolarHBondContact OD1-O 3.1Å; N158-Y219 WeakPolarHBondContact ND2-CE1 3.49Å
159	H	82	Confident	83.6	Confident	103 Å²	103	41.8 Å²	41.8	48%	0.477	21%	0.21	S	C	.	.	H	α-helix	trans	-58.2	-35.3	178.9	-179.3	-98.7	0	0	0	112.8	E156 S157 L161 G162 L163	E156-H159 PolarHBondContact O-N 2.86Å; S157-H159 PolarHBondContact O-N 2.83Å; H159-L161 PolarHBondContact O-N 2.9Å; H159-G162 PolarHBondContact O-N 3.43Å; H159-L163 PolarHBondContact O-N 2.64Å
160	A	84.6	Confident	83.8	Confident	28 Å²	28	42.6 Å²	42.6	23%	0.231	21%	0.211	C	C	.	.	H	α-helix	trans	-55.1	-33.5	173.7	0	0	0	0	0	113.3	N158 I164 I193 L198	N158-A160 PolarHBondContact O-N 3.02Å; A160-I164 WeakPolarHBondContact O-CD1 3.42Å; A160-I164 WeakPolarHBondContact O-CG1 3.16Å; A160-I164 PolarHBondContact O-N 2.9Å; A160-I193 HydrophobicContact CB-CG2 3.6Å; A160-L198 HydrophobicContact CB-CD2 4.13Å
161	L	88.5	Confident	84	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.1	-51.2	-177.4	-178.6	63.7	0	0	0	111.7	I121 N158 H159 L163 I164 I165 L198 F199 I215 L217	I121-L161 HydrophobicContact CG2-CD2 3.99Å; N158-L161 HydrophobicContact CB-CB 4.46Å; N158-L161 VanDerWaalsContact O-CB 3.22Å; N158-L161 WeakPolarHBondContact O-CB 3.13Å; N158-L161 PolarHBondContact O-N 2.97Å; H159-L161 PolarHBondContact O-N 2.9Å; L161-L163 VanDerWaalsContact C-N 3.35Å; L161-L163 PolarHBondContact O-N 3Å; L161-I164 PolarHBondContact O-N 3.37Å; L161-I165 HydrophobicContact CD1-CD1 3.81Å; L161-I165 HydrophobicContact CD1-CG1 4.22Å; L161-I165 HydrophobicContact CD2-CD1 4.4Å; L161-I165 HydrophobicContact CG-CD1 3.7Å; L161-I165 HydrophobicContact CG-CG1 4.44Å; L161-I165 VanDerWaalsContact O-CG1 3.3Å; L161-I165 WeakPolarHBondContact O-CG1 3.44Å; L161-I165 PolarHBondContact O-N 2.82Å; L161-L198 HydrophobicContact CB-CD1 4.42Å; L161-L198 HydrophobicContact CB-CD2 4.2Å; L161-L198 HydrophobicContact CD1-CD2 4.45Å; L161-F199 HydrophobicContact CD1-CE1 3.54Å; L161-F199 HydrophobicContact CD1-CZ 3.87Å; L161-I215 HydrophobicContact CD1-CG2 4Å; L161-I215 HydrophobicContact CD2-CG2 4.17Å; L161-L217 HydrophobicContact CD2-CD2 3.47Å; L161-L217 VanDerWaalsContact CD2-CD2 3.47Å
162	G	86.3	Confident	84.4	Confident	14 Å²	14	49.5 Å²	49.5	14%	0.144	25%	0.249	C	C	.	.	H	α-helix	trans	-59.4	-45.8	-179.3	0	0	0	0	0	111.7	H159 I164 I165 D166	H159-G162 PolarHBondContact O-N 3.43Å; G162-I164 VanDerWaalsContact C-N 3.31Å; G162-I164 PolarHBondContact O-N 2.75Å; G162-I165 PolarHBondContact O-N 2.63Å; G162-D166 PolarHBondContact O-N 3.01Å
163	L	86.2	Confident	84.9	Confident	55 Å²	55	47.9 Å²	47.9	29%	0.288	24%	0.238	S	C	.	.	H	α-helix	trans	-57.2	-41.2	176.8	-71	177.7	0	0	0	113	H159 L161 A167 I193	H159-L163 PolarHBondContact O-N 2.64Å; L161-L163 VanDerWaalsContact C-N 3.35Å; L161-L163 PolarHBondContact O-N 3Å; L163-A167 WeakPolarHBondContact O-CB 3.16Å; L163-A167 PolarHBondContact O-N 3.21Å; L163-I193 HydrophobicContact CD1-CD1 4Å
164	I	88.7	Confident	85.1	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-74.6	-39.6	-179.2	-62.2	155.2	0	0	0	111.1	A160 L161 G162 A167 Y168 L181 L195 L198 F199	A160-I164 WeakPolarHBondContact O-CD1 3.42Å; A160-I164 WeakPolarHBondContact O-CG1 3.16Å; A160-I164 PolarHBondContact O-N 2.9Å; L161-I164 PolarHBondContact O-N 3.37Å; G162-I164 VanDerWaalsContact C-N 3.31Å; G162-I164 PolarHBondContact O-N 2.75Å; I164-A167 PolarHBondContact O-N 3.1Å; I164-Y168 WeakPolarHBondContact O-CB 3.4Å; I164-Y168 PolarHBondContact O-N 3.19Å; I164-L181 HydrophobicContact CG2-CD2 4.45Å; I164-L195 HydrophobicContact CD1-CD1 4.27Å; I164-L195 HydrophobicContact CD1-CD2 3.14Å; I164-L195 HydrophobicContact CD1-CG 4.32Å; I164-L195 HydrophobicContact CG1-CD2 4.18Å; I164-L198 HydrophobicContact CD1-CD2 4.24Å; I164-F199 HydrophobicContact CB-CZ 4.5Å; I164-F199 HydrophobicContact CD1-CE2 3.88Å; I164-F199 HydrophobicContact CD1-CZ 4.12Å; I164-F199 HydrophobicContact CG2-CE2 3.94Å; I164-F199 HydrophobicContact CG2-CZ 4.13Å
165	I	88.6	Confident	85.1	Confident	6 Å²	6	59.6 Å²	59.6	3%	0.031	29%	0.29	C	S	.	.	H	α-helix	trans	-60.7	-50.5	177.4	-70.4	172.1	0	0	0	109.4	T118 D122 L161 G162 A167 Y168 F169	T118-I165 HydrophobicContact CG2-CG1 4.47Å; D122-I165 HydrophobicContact CB-CD1 3.96Å; L161-I165 HydrophobicContact CD1-CD1 3.81Å; L161-I165 HydrophobicContact CD1-CG1 4.22Å; L161-I165 HydrophobicContact CD2-CD1 4.4Å; L161-I165 HydrophobicContact CG-CD1 3.7Å; L161-I165 HydrophobicContact CG-CG1 4.44Å; L161-I165 VanDerWaalsContact O-CG1 3.3Å; L161-I165 WeakPolarHBondContact O-CG1 3.44Å; L161-I165 PolarHBondContact O-N 2.82Å; G162-I165 PolarHBondContact O-N 2.63Å; I165-A167 PolarHBondContact O-N 2.8Å; I165-Y168 PolarHBondContact O-N 3.05Å; I165-F169 HydrophobicContact CG2-CD2 3.88Å; I165-F169 HydrophobicContact CG2-CE2 4.18Å; I165-F169 VanDerWaalsContact O-CD2 3.25Å; I165-F169 WeakPolarHBondContact O-CD2 3.3Å; I165-F169 PolarHBondContact O-N 2.96Å
166	D	87.6	Confident	85.4	Confident	93 Å²	93	55.3 Å²	55.3	50%	0.497	28%	0.278	S	S	.	.	H	α-helix	trans	-59.7	-46.9	177.9	-73.1	-18.5	0	0	0	111.3	G162 Y168 D170 L173	G162-D166 PolarHBondContact O-N 3.01Å; D166-Y168 VanDerWaalsContact C-N 3.28Å; D166-Y168 PolarHBondContact O-N 2.88Å; D166-D170 VanDerWaalsContact O-CB 3.22Å; D166-D170 WeakPolarHBondContact O-CB 2.94Å; D166-D170 PolarHBondContact O-N 3.24Å; D166-L173 HydrophobicContact CB-CD1 4.22Å
167	A	87.9	Confident	85.6	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.008	31%	0.305	C	S	.	.	H	α-helix	trans	-63.9	-30.4	178.3	0	0	0	0	0	113.7	L163 I164 I165 L173 R174 V179 L181	L163-A167 WeakPolarHBondContact O-CB 3.16Å; L163-A167 PolarHBondContact O-N 3.21Å; I164-A167 PolarHBondContact O-N 3.1Å; I165-A167 PolarHBondContact O-N 2.8Å; A167-L173 HydrophobicContact CB-CB 4.47Å; A167-R174 WeakPolarHBondContact O-CA 3.42Å; A167-R174 WeakPolarHBondContact O-CB 3.5Å; A167-R174 PolarHBondContact O-N 3.09Å; A167-V179 HydrophobicContact CB-CG1 3.96Å; A167-L181 HydrophobicContact CB-CD1 4.2Å; A167-L181 HydrophobicContact CB-CD2 3.92Å
168	Y	87.4	Confident	85.7	Confident	39 Å²	39	67 Å²	67	15%	0.153	33%	0.329	C	S	.	.	H	α-helix	trans	-79.1	-41.9	-178	-171.4	-92.3	0	0	0	112.5	M113 I164 I165 D166 L181 I209	M113-Y168 HydrophobicContact CE-CD1 3.81Å; M113-Y168 HydrophobicContact CE-CD2 3.67Å; M113-Y168 HydrophobicContact CE-CE1 3.99Å; M113-Y168 HydrophobicContact CE-CE2 3.85Å; M113-Y168 HydrophobicContact CE-CG 3.65Å; I164-Y168 WeakPolarHBondContact O-CB 3.4Å; I164-Y168 PolarHBondContact O-N 3.19Å; I165-Y168 PolarHBondContact O-N 3.05Å; D166-Y168 VanDerWaalsContact C-N 3.28Å; D166-Y168 PolarHBondContact O-N 2.88Å; Y168-L181 HydrophobicContact CD2-CD1 4Å; Y168-L181 HydrophobicContact CG-CD1 4.48Å; Y168-I209 WeakPolarHBondContact CE2-O 3.3Å
169	F	88.8	Confident	85.7	Confident	58 Å²	58	66.9 Å²	66.9	25%	0.254	33%	0.329	S	S	.	.	H	α-helix	trans	-93.4	-27.2	-175.2	-67.2	-72.2	0	0	0	113.9	Y115 T118 I165 P171	Y115-F169 HydrophobicContact CD2-CB 4.01Å; Y115-F169 AromaticContact CD2-CD1 3.81Å; Y115-F169 HydrophobicContact CD2-CD1 3.81Å; Y115-F169 HydrophobicContact CD2-CD2 4.23Å; Y115-F169 HydrophobicContact CD2-CE1 4.37Å; Y115-F169 AromaticContact CD2-CG 3.74Å; Y115-F169 HydrophobicContact CD2-CG 3.74Å; Y115-F169 HydrophobicContact CE2-CB 4.39Å; Y115-F169 HydrophobicContact CG-CD1 4.38Å; T118-F169 HydrophobicContact CG2-CE2 3.82Å; T118-F169 HydrophobicContact CG2-CZ 4.06Å; T118-F169 WeakPolarHBondContact OG1-CE2 3.39Å; T118-F169 WeakPolarHBondContact OG1-CZ 3.4Å; I165-F169 HydrophobicContact CG2-CD2 3.88Å; I165-F169 HydrophobicContact CG2-CE2 4.18Å; I165-F169 VanDerWaalsContact O-CD2 3.25Å; I165-F169 WeakPolarHBondContact O-CD2 3.3Å; I165-F169 PolarHBondContact O-N 2.96Å; F169-P171 VanDerWaalsContact O-CD 3.23Å; F169-P171 WeakPolarHBondContact O-CD 3.39Å
170	D	87.7	Confident	85.9	Confident	62 Å²	62	65.4 Å²	65.4	33%	0.332	32%	0.324	S	S	.	.			trans	-78.2	112.5	173.6	-170.7	-17.8	0	0	0	110.2	D166 K172 L173 R174	D166-D170 VanDerWaalsContact O-CB 3.22Å; D166-D170 WeakPolarHBondContact O-CB 2.94Å; D166-D170 PolarHBondContact O-N 3.24Å; D170-K172 PolarHBondContact O-N 3.4Å; D170-K172 VanDerWaalsContact O-N 3.16Å; D170-K172 VanDerWaalsContact OD1-CB 3.3Å; D170-K172 WeakPolarHBondContact OD1-CB 3.49Å; D170-K172 PolarHBondContact OD1-N 3.15Å; D170-L173 HydrophobicContact CB-CB 4.19Å; D170-L173 HydrophobicContact CB-CD1 4.02Å; D170-L173 HydrophobicContact CB-CG 4.07Å; D170-L173 PolarHBondContact O-N 3.4Å; D170-R174 WeakPolarHBondContact O-CB 3.31Å; D170-R174 PolarHBondContact O-N 2.66Å
171	P	84.1	Confident	86	Confident	84 Å²	84	64.6 Å²	64.6	55%	0.545	32%	0.316	S	S	.	.	H	α-helix	trans	-61.5	-24.2	179.1	25.9	-34.8	0	0	0	113.3	F169 N175	F169-P171 VanDerWaalsContact O-CD 3.23Å; F169-P171 WeakPolarHBondContact O-CD 3.39Å; P171-N175 WeakPolarHBondContact O-CB 3.41Å; P171-N175 PolarHBondContact O-N 2.74Å; P171-N175 PolarHBondContact O-ND2 3.2Å
172	K	85.7	Confident	85.9	Confident	172 Å²	172	66.4 Å²	66.4	75%	0.748	33%	0.327	S	S	*	.	H	α-helix	trans	-69.5	-44.7	176.6	-64	179.5	179.3	176.8	0	111.2	D170 N176	D170-K172 PolarHBondContact O-N 3.4Å; D170-K172 VanDerWaalsContact O-N 3.16Å; D170-K172 VanDerWaalsContact OD1-CB 3.3Å; D170-K172 WeakPolarHBondContact OD1-CB 3.49Å; D170-K172 PolarHBondContact OD1-N 3.15Å; K172-N176 PolarHBondContact O-N 2.99Å
173	L	83.7	Confident	86	Confident	41 Å²	41	67.6 Å²	67.6	22%	0.215	33%	0.328	C	S	.	.	H	α-helix	trans	-70.9	-45.8	177.8	-65.8	178.5	0	0	0	110.8	D166 A167 D170 N175 N176 V179 F189	D166-L173 HydrophobicContact CB-CD1 4.22Å; A167-L173 HydrophobicContact CB-CB 4.47Å; D170-L173 HydrophobicContact CB-CB 4.19Å; D170-L173 HydrophobicContact CB-CD1 4.02Å; D170-L173 HydrophobicContact CB-CG 4.07Å; D170-L173 PolarHBondContact O-N 3.4Å; L173-N175 VanDerWaalsContact C-N 3.26Å; L173-N175 PolarHBondContact O-N 2.76Å; L173-N176 VanDerWaalsContact O-CB 3.26Å; L173-N176 WeakPolarHBondContact O-CB 3.41Å; L173-N176 PolarHBondContact O-N 3.29Å; L173-V179 VanDerWaalsContact O-CB 3.28Å; L173-V179 WeakPolarHBondContact O-CB 3.47Å; L173-V179 WeakPolarHBondContact O-CG2 2.94Å; L173-F189 HydrophobicContact CD2-CE2 3.72Å; L173-F189 HydrophobicContact CD2-CZ 3.46Å; L173-F189 VanDerWaalsContact CD2-CZ 3.46Å
174	R	80.5	Confident	86	Confident	133 Å²	133	67 Å²	67	50%	0.502	33%	0.327	S	S	.	.	H	α-helix	trans	-57.6	-35.5	-179.1	-176.1	175.8	172.2	177.6	-0.8	114.1	A167 D170	A167-R174 WeakPolarHBondContact O-CA 3.42Å; A167-R174 WeakPolarHBondContact O-CB 3.5Å; A167-R174 PolarHBondContact O-N 3.09Å; D170-R174 WeakPolarHBondContact O-CB 3.31Å; D170-R174 PolarHBondContact O-N 2.66Å
175	N	83.6	Confident	85.9	Confident	130 Å²	130	67.9 Å²	67.9	70%	0.695	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-2.4	-179.6	-67.3	-26.2	0	0	0	113.1	P171 L173	P171-N175 WeakPolarHBondContact O-CB 3.41Å; P171-N175 PolarHBondContact O-N 2.74Å; P171-N175 PolarHBondContact O-ND2 3.2Å; L173-N175 VanDerWaalsContact C-N 3.26Å; L173-N175 PolarHBondContact O-N 2.76Å
176	N	86	Confident	86	Confident	54 Å²	54	67.6 Å²	67.6	29%	0.289	33%	0.331	S	S	.	.			trans	-68.7	137	175.9	-169.8	-3.7	0	0	0	109.8	K172 L173 E178 V179 F189	K172-N176 PolarHBondContact O-N 2.99Å; L173-N176 VanDerWaalsContact O-CB 3.26Å; L173-N176 WeakPolarHBondContact O-CB 3.41Å; L173-N176 PolarHBondContact O-N 3.29Å; N176-E178 PolarHBondContact O-N 2.93Å; N176-E178 PolarHBondContact OD1-N 3.47Å; N176-V179 HydrophobicContact CB-CB 4.42Å; N176-V179 HydrophobicContact CB-CG2 4.09Å; N176-V179 PolarHBondContact O-N 3.44Å; N176-V179 VanDerWaalsContact O-N 3.15Å; N176-F189 WeakPolarHBondContact ND2-CE1 3.38Å
177	K	82.5	Confident	86	Confident	208 Å²	208	66 Å²	66	90%	0.904	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-24.7	178.5	-66.2	-177.3	180	179.1	0	112.7	V179	K177-V179 VanDerWaalsContact C-N 3.29Å
178	E	82.3	Confident	85.8	Confident	112 Å²	112	66.2 Å²	66.2	52%	0.523	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-0.3	179.2	-62.5	-178.4	168.6	0	0	113.8	N176 F189	N176-E178 PolarHBondContact O-N 2.93Å; N176-E178 PolarHBondContact OD1-N 3.47Å; E178-F189 HydrophobicContact CB-CD1 4.44Å; E178-F189 PolarHBondContact O-N 3.35Å; E178-F189 VanDerWaalsContact O-N 3.1Å; E178-F189 WeakPolarHBondContact OE2-CD1 3.34Å
179	V	86.3	Confident	85.6	Confident	12 Å²	12	69.3 Å²	69.3	7%	0.073	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	112.3	-178.9	178.6	0	0	0	0	109.2	A167 L173 N176 K177 L181 N187 V188 F189	A167-V179 HydrophobicContact CB-CG1 3.96Å; L173-V179 VanDerWaalsContact O-CB 3.28Å; L173-V179 WeakPolarHBondContact O-CB 3.47Å; L173-V179 WeakPolarHBondContact O-CG2 2.94Å; N176-V179 HydrophobicContact CB-CB 4.42Å; N176-V179 HydrophobicContact CB-CG2 4.09Å; N176-V179 PolarHBondContact O-N 3.44Å; N176-V179 VanDerWaalsContact O-N 3.15Å; K177-V179 VanDerWaalsContact C-N 3.29Å; V179-L181 HydrophobicContact CG1-CD2 4.16Å; V179-L181 HydrophobicContact CG1-CG 4.11Å; V179-N187 CarbonylContact C-O 3.59Å; V179-N187 WeakPolarHBondContact CA-O 3.38Å; V179-V188 HydrophobicContact CG2-CG1 4.5Å; V179-F189 HydrophobicContact CG2-CE2 4.44Å
180	N	86.5	Confident	85	Confident	71 Å²	71	68.1 Å²	68.1	38%	0.38	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	103.4	175.3	-166.9	21.1	0	0	0	110.6	T182 A186 N187	N180-T182 VanDerWaalsContact C-N 3.27Å; N180-T182 PolarHBondContact O-N 2.97Å; N180-T182 VanDerWaalsContact O-N 3.08Å; N180-T182 WeakPolarHBondContact OD1-CG2 3.32Å; N180-A186 WeakPolarHBondContact O-CA 3.38Å; N180-N187 HydrophobicContact CB-CB 4.42Å; N180-N187 PolarHBondContact N-O 2.92Å; N180-N187 PolarHBondContact O-N 2.98Å
181	L	86.4	Confident	84.7	Confident	12 Å²	12	66.7 Å²	66.7	6%	0.063	34%	0.335	C	S	.	.			trans	-87.2	63.7	-178.9	-59	178.6	0	0	0	111.4	I164 A167 Y168 V179 A186 V188 R208 I209	I164-L181 HydrophobicContact CG2-CD2 4.45Å; A167-L181 HydrophobicContact CB-CD1 4.2Å; A167-L181 HydrophobicContact CB-CD2 3.92Å; Y168-L181 HydrophobicContact CD2-CD1 4Å; Y168-L181 HydrophobicContact CG-CD1 4.48Å; V179-L181 HydrophobicContact CG1-CD2 4.16Å; V179-L181 HydrophobicContact CG1-CG 4.11Å; L181-A186 HydrophobicContact CD2-CB 4.35Å; L181-V188 HydrophobicContact CD2-CG2 4.25Å; L181-R208 WeakPolarHBondContact O-CA 3.43Å; L181-I209 PolarHBondContact O-N 2.87Å
182	T	88.1	Confident	84.7	Confident	38 Å²	38	66.6 Å²	66.6	23%	0.233	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-88.8	161.8	174.8	42.1	0	0	0	0	112.4	N180 V185 G207	N180-T182 VanDerWaalsContact C-N 3.27Å; N180-T182 PolarHBondContact O-N 2.97Å; N180-T182 VanDerWaalsContact O-N 3.08Å; N180-T182 WeakPolarHBondContact OD1-CG2 3.32Å; T182-V185 CarbonylContact C-O 3.6Å; T182-V185 VanDerWaalsContact C-O 3.3Å; T182-V185 WeakPolarHBondContact CB-O 3.3Å; T182-V185 CarbonylContact O-C 3.55Å; T182-V185 PolarHBondContact OG1-O 3.16Å; T182-G207 CarbonylContact C-O 3.6Å; T182-G207 WeakPolarHBondContact CA-O 3.36Å; T182-G207 WeakPolarHBondContact CB-O 3.47Å; T182-G207 WeakPolarHBondContact CG2-O 3.34Å
183	Y	87.1	Confident	84.7	Confident	38 Å²	38	59.4 Å²	59.4	15%	0.149	30%	0.295	C	S	.	.	S	Bend	trans	-118.9	137	171.3	-172	-91.4	0	0	0	109.4	L195 V202 V204 G207 Q548	Y183-L195 HydrophobicContact CD2-CB 4.23Å; Y183-L195 HydrophobicContact CD2-CD1 4.48Å; Y183-L195 HydrophobicContact CE2-CB 4.15Å; Y183-V202 HydrophobicContact CD1-CB 4.45Å; Y183-V202 HydrophobicContact CD1-CG1 4.39Å; Y183-V202 HydrophobicContact CD2-CB 4.04Å; Y183-V202 HydrophobicContact CD2-CG1 3.78Å; Y183-V202 HydrophobicContact CD2-CG2 3.91Å; Y183-V202 HydrophobicContact CE1-CB 4.38Å; Y183-V202 HydrophobicContact CE2-CB 3.96Å; Y183-V202 HydrophobicContact CE2-CG1 4.23Å; Y183-V202 HydrophobicContact CE2-CG2 3.52Å; Y183-V202 HydrophobicContact CG-CB 4.29Å; Y183-V202 HydrophobicContact CG-CG1 3.87Å; Y183-V204 HydrophobicContact CD1-CG2 4.04Å; Y183-V204 HydrophobicContact CG-CG2 4.15Å; Y183-G207 PolarHBondContact N-O 3.12Å; Y183-G207 VanDerWaalsContact N-O 3.14Å; Y183-Q548 HydrophobicContact CE1-CB 4.42Å; Y183-Q548 WeakPolarHBondContact OH-CB 3.45Å; Y183-Q548 PolarHBondContact OH-OE1 3.42Å
184	P	85.7	Confident	84.9	Confident	42 Å²	42	58.4 Å²	58.4	27%	0.273	29%	0.289	S	S	.	.	S	Bend	cis	-85.4	-4.4	11.1	33.2	-34.9	0	0	0	115.6	Y194 L195 V585	P184-Y194 HydrophobicContact CB-CD2 4.32Å; P184-Y194 HydrophobicContact CB-CE2 3.92Å; P184-Y194 HydrophobicContact CG-CE2 4.43Å; P184-L195 VanDerWaalsContact O-CB 3.31Å; P184-L195 WeakPolarHBondContact O-CB 3.29Å; P184-L195 PolarHBondContact O-N 2.99Å; P184-V585 HydrophobicContact CG-CG1 4.3Å
185	V	87.6	Confident	85.3	Confident	20 Å²	20	52 Å²	52	12%	0.121	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	128.6	-174.8	179.4	0	0	0	0	109.8	T182 K192 I193 Y194 D588	T182-V185 CarbonylContact C-O 3.6Å; T182-V185 VanDerWaalsContact C-O 3.3Å; T182-V185 WeakPolarHBondContact CB-O 3.3Å; T182-V185 CarbonylContact O-C 3.55Å; T182-V185 PolarHBondContact OG1-O 3.16Å; V185-K192 HydrophobicContact CG1-CB 4.49Å; V185-I193 WeakPolarHBondContact CA-O 3.32Å; V185-Y194 HydrophobicContact CG2-CD2 3.84Å; V185-D588 HydrophobicContact CG2-CB 4.1Å; V185-D588 WeakPolarHBondContact CG2-O 3.38Å
186	A	89.8	Confident	85.3	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	147.4	170.5	0	0	0	0	0	110.4	N180 L181 I193 L195	N180-A186 WeakPolarHBondContact O-CA 3.38Å; L181-A186 HydrophobicContact CD2-CB 4.35Å; A186-I193 PolarHBondContact N-O 3.01Å; A186-I193 PolarHBondContact O-N 2.79Å; A186-L195 HydrophobicContact CB-CD1 3.97Å; A186-L195 HydrophobicContact CB-CD2 4.36Å; A186-L195 HydrophobicContact CB-CG 4.32Å
187	N	87.6	Confident	85.3	Confident	59 Å²	59	44 Å²	44	32%	0.316	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	120.5	172	-173.2	3.7	0	0	0	108.6	V179 N180 G190 N191	V179-N187 CarbonylContact C-O 3.59Å; V179-N187 WeakPolarHBondContact CA-O 3.38Å; N180-N187 HydrophobicContact CB-CB 4.42Å; N180-N187 PolarHBondContact N-O 2.92Å; N180-N187 PolarHBondContact O-N 2.98Å; N187-G190 VanDerWaalsContact OD1-CA 3.31Å; N187-G190 WeakPolarHBondContact OD1-CA 3.43Å; N187-G190 PolarHBondContact OD1-N 2.83Å; N187-N191 WeakPolarHBondContact CA-O 3.21Å; N187-N191 PolarHBondContact OD1-O 2.85Å
188	V	85.2	Confident	85.6	Confident	6 Å²	6	35 Å²	35	4%	0.036	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	112	-178.1	179.8	0	0	0	0	108.1	V179 L181 G190 N191 I193	V179-V188 HydrophobicContact CG2-CG1 4.5Å; L181-V188 HydrophobicContact CD2-CG2 4.25Å; V188-G190 PolarHBondContact O-N 3.25Å; V188-N191 PolarHBondContact N-O 3.19Å; V188-N191 WeakPolarHBondContact O-CB 3.45Å; V188-N191 PolarHBondContact O-N 2.8Å; V188-I193 HydrophobicContact CG2-CD1 4.45Å
189	F	82	Confident	86.1	Confident	103 Å²	103	29.7 Å²	29.7	45%	0.452	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	40	-178.8	-62.3	-71.9	0	0	0	113.3	L173 N176 E178 V179 N191	L173-F189 HydrophobicContact CD2-CE2 3.72Å; L173-F189 HydrophobicContact CD2-CZ 3.46Å; L173-F189 VanDerWaalsContact CD2-CZ 3.46Å; N176-F189 WeakPolarHBondContact ND2-CE1 3.38Å; E178-F189 HydrophobicContact CB-CD1 4.44Å; E178-F189 PolarHBondContact O-N 3.35Å; E178-F189 VanDerWaalsContact O-N 3.1Å; E178-F189 WeakPolarHBondContact OE2-CD1 3.34Å; V179-F189 HydrophobicContact CG2-CE2 4.44Å; F189-N191 VanDerWaalsContact C-N 3.27Å; F189-N191 PolarHBondContact O-N 3.49Å
190	G	77.4	Confident	86.2	Confident	34 Å²	34	29.1 Å²	29.1	35%	0.351	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	-3.8	-179.3	0	0	0	0	0	115.3	N187 V188	N187-G190 VanDerWaalsContact OD1-CA 3.31Å; N187-G190 WeakPolarHBondContact OD1-CA 3.43Å; N187-G190 PolarHBondContact OD1-N 2.83Å; V188-G190 PolarHBondContact O-N 3.25Å
191	N	80	Confident	86.3	Confident	31 Å²	31	26.3 Å²	26.3	17%	0.166	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	118.2	171.7	-65	-21.7	0	0	0	109.6	N187 V188 F189 K624	N187-N191 WeakPolarHBondContact CA-O 3.21Å; N187-N191 PolarHBondContact OD1-O 2.85Å; V188-N191 PolarHBondContact N-O 3.19Å; V188-N191 WeakPolarHBondContact O-CB 3.45Å; V188-N191 PolarHBondContact O-N 2.8Å; F189-N191 VanDerWaalsContact C-N 3.27Å; F189-N191 PolarHBondContact O-N 3.49Å; N191-K624 PolarHBondContact OD1-NZ 3.16Å
192	K	84.5	Confident	86.6	Confident	83 Å²	83	26.4 Å²	26.4	36%	0.361	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	124.2	170.1	-68.6	-174.6	175.9	-172.2	0	109.5	V185	V185-K192 HydrophobicContact CG1-CB 4.49Å
193	I	86.7	Confident	86.7	Confident	20 Å²	20	26.4 Å²	26.4	10%	0.103	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	113	-178.4	-51.8	177.1	0	0	0	108.3	A160 L163 V185 A186 V188 L195	A160-I193 HydrophobicContact CB-CG2 3.6Å; L163-I193 HydrophobicContact CD1-CD1 4Å; V185-I193 WeakPolarHBondContact CA-O 3.32Å; A186-I193 PolarHBondContact N-O 3.01Å; A186-I193 PolarHBondContact O-N 2.79Å; V188-I193 HydrophobicContact CG2-CD1 4.45Å; I193-L195 HydrophobicContact CB-CD2 4.37Å; I193-L195 HydrophobicContact CG2-CD2 3.8Å
194	Y	88.2	Confident	86.8	Confident	20 Å²	20	28 Å²	28	8%	0.078	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	125	171.3	178.7	-113	0	0	0	109.9	P184 V185 G196 V551 V585	P184-Y194 HydrophobicContact CB-CD2 4.32Å; P184-Y194 HydrophobicContact CB-CE2 3.92Å; P184-Y194 HydrophobicContact CG-CE2 4.43Å; V185-Y194 HydrophobicContact CG2-CD2 3.84Å; Y194-G196 VanDerWaalsContact CE1-CA 3.48Å; Y194-G196 WeakPolarHBondContact CE1-O 3.31Å; Y194-V551 HydrophobicContact CD1-CG2 3.53Å; Y194-V551 HydrophobicContact CE1-CG2 3.56Å; Y194-V585 HydrophobicContact CE2-CG1 4.22Å
195	L	88.2	Confident	86.8	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.172	C	C	.	.			trans	-97.5	-8.1	-174.6	-52.2	-172.3	0	0	0	113	I164 Y183 P184 A186 I193 L198 F199 I209	I164-L195 HydrophobicContact CD1-CD1 4.27Å; I164-L195 HydrophobicContact CD1-CD2 3.14Å; I164-L195 HydrophobicContact CD1-CG 4.32Å; I164-L195 HydrophobicContact CG1-CD2 4.18Å; Y183-L195 HydrophobicContact CD2-CB 4.23Å; Y183-L195 HydrophobicContact CD2-CD1 4.48Å; Y183-L195 HydrophobicContact CE2-CB 4.15Å; P184-L195 VanDerWaalsContact O-CB 3.31Å; P184-L195 WeakPolarHBondContact O-CB 3.29Å; P184-L195 PolarHBondContact O-N 2.99Å; A186-L195 HydrophobicContact CB-CD1 3.97Å; A186-L195 HydrophobicContact CB-CD2 4.36Å; A186-L195 HydrophobicContact CB-CG 4.32Å; I193-L195 HydrophobicContact CB-CD2 4.37Å; I193-L195 HydrophobicContact CG2-CD2 3.8Å; L195-L198 PolarHBondContact O-N 2.93Å; L195-L198 VanDerWaalsContact O-N 3.17Å; L195-F199 HydrophobicContact CB-CD2 4.21Å; L195-F199 HydrophobicContact CD1-CD2 4.08Å; L195-F199 HydrophobicContact CD1-CE2 4.17Å; L195-F199 PolarHBondContact O-N 3.13Å; L195-F199 VanDerWaalsContact O-N 3.09Å; L195-I209 HydrophobicContact CD1-CD1 3.57Å
196	G	84.2	Confident	86.7	Confident	3 Å²	3	35.7 Å²	35.7	3%	0.031	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	136.7	172.7	0	0	0	0	0	109.9	Y194 L198 G549	Y194-G196 VanDerWaalsContact CE1-CA 3.48Å; Y194-G196 WeakPolarHBondContact CE1-O 3.31Å; G196-L198 VanDerWaalsContact C-N 3.28Å; G196-L198 PolarHBondContact O-N 3.19Å; G196-G549 CarbonylContact C-O 3.2Å
197	G	84.6	Confident	86.4	Confident	11 Å²	11	37.3 Å²	37.3	11%	0.113	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	87	-29.3	-172.3	0	0	0	0	0	114.8	H216 G549	G197-H216 WeakPolarHBondContact O-CB 3.35Å; G197-H216 PolarHBondContact O-ND1 3.45Å; G197-G549 PolarHBondContact N-O 3.33Å
198	L	89.7	Confident	86.3	Confident	19 Å²	19	41.5 Å²	41.5	10%	0.099	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-45.5	176.3	177.9	64.4	0	0	0	112.2	A160 L161 I164 L195 G196 I215 H216	A160-L198 HydrophobicContact CB-CD2 4.13Å; L161-L198 HydrophobicContact CB-CD1 4.42Å; L161-L198 HydrophobicContact CB-CD2 4.2Å; L161-L198 HydrophobicContact CD1-CD2 4.45Å; I164-L198 HydrophobicContact CD1-CD2 4.24Å; L195-L198 PolarHBondContact O-N 2.93Å; L195-L198 VanDerWaalsContact O-N 3.17Å; G196-L198 VanDerWaalsContact C-N 3.28Å; G196-L198 PolarHBondContact O-N 3.19Å; L198-I215 HydrophobicContact CD1-CG2 4.5Å; L198-H216 WeakPolarHBondContact CD1-O 3.26Å; L198-H216 PolarHBondContact O-N 3.37Å
199	F	91.5	Very high	86.4	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.009	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	129.7	177.6	-63.8	-33.3	0	0	0	111.3	L161 I164 L195 V202 I209 V212 I215	L161-F199 HydrophobicContact CD1-CE1 3.54Å; L161-F199 HydrophobicContact CD1-CZ 3.87Å; I164-F199 HydrophobicContact CB-CZ 4.5Å; I164-F199 HydrophobicContact CD1-CE2 3.88Å; I164-F199 HydrophobicContact CD1-CZ 4.12Å; I164-F199 HydrophobicContact CG2-CE2 3.94Å; I164-F199 HydrophobicContact CG2-CZ 4.13Å; L195-F199 HydrophobicContact CB-CD2 4.21Å; L195-F199 HydrophobicContact CD1-CD2 4.08Å; L195-F199 HydrophobicContact CD1-CE2 4.17Å; L195-F199 PolarHBondContact O-N 3.13Å; L195-F199 VanDerWaalsContact O-N 3.09Å; F199-V202 HydrophobicContact CB-CG2 3.53Å; F199-I209 HydrophobicContact CD2-CD1 4.39Å; F199-I209 HydrophobicContact CE2-CD1 4.33Å; F199-V212 HydrophobicContact CB-CG1 3.92Å; F199-V212 HydrophobicContact CB-CG2 4.35Å; F199-V212 HydrophobicContact CD1-CG1 3.97Å; F199-V212 HydrophobicContact CD2-CG2 4.41Å; F199-V212 HydrophobicContact CG-CG1 4.09Å; F199-V212 HydrophobicContact CG-CG2 4.23Å; F199-I215 HydrophobicContact CD1-CG1 3.92Å; F199-I215 HydrophobicContact CD1-CG2 4.47Å; F199-I215 HydrophobicContact CE1-CD1 4.18Å; F199-I215 HydrophobicContact CE1-CG1 3.97Å; F199-I215 HydrophobicContact CE1-CG2 4.35Å
200	G	89.7	Confident	86.8	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	150.7	176.6	0	0	0	0	0	112.7	V202 K213 L214 F544	G200-V202 VanDerWaalsContact C-N 3.26Å; G200-V202 PolarHBondContact O-N 3.46Å; G200-K213 PolarHBondContact O-N 3.45Å; G200-L214 PolarHBondContact N-O 3.39Å; G200-L214 PolarHBondContact O-N 3.41Å; G200-F544 CarbonylContact C-O 3.49Å; G200-F544 WeakPolarHBondContact CA-O 3.22Å
201	G	89.1	Confident	87.4	Confident	11 Å²	11	44 Å²	44	11%	0.113	24%	0.236	C	C	.	.	S	Bend	trans	61.9	32.5	-177.5	0	0	0	0	0	113.5	A203 F544	G201-A203 PolarHBondContact O-N 3.07Å; G201-F544 PolarHBondContact N-O 3.35Å; G201-F544 VanDerWaalsContact N-O 3.11Å
202	V	90.8	Very high	88	Confident	14 Å²	14	42.5 Å²	42.5	9%	0.085	23%	0.229	C	C	.	.			trans	-66.8	125.8	-179.4	-172.3	0	0	0	0	111.8	Y183 F199 G200 V204 I209 E211 V212 Q548	Y183-V202 HydrophobicContact CD1-CB 4.45Å; Y183-V202 HydrophobicContact CD1-CG1 4.39Å; Y183-V202 HydrophobicContact CD2-CB 4.04Å; Y183-V202 HydrophobicContact CD2-CG1 3.78Å; Y183-V202 HydrophobicContact CD2-CG2 3.91Å; Y183-V202 HydrophobicContact CE1-CB 4.38Å; Y183-V202 HydrophobicContact CE2-CB 3.96Å; Y183-V202 HydrophobicContact CE2-CG1 4.23Å; Y183-V202 HydrophobicContact CE2-CG2 3.52Å; Y183-V202 HydrophobicContact CG-CB 4.29Å; Y183-V202 HydrophobicContact CG-CG1 3.87Å; F199-V202 HydrophobicContact CB-CG2 3.53Å; G200-V202 VanDerWaalsContact C-N 3.26Å; G200-V202 PolarHBondContact O-N 3.46Å; V202-V204 HydrophobicContact CG1-CG2 4.15Å; V202-I209 HydrophobicContact CG1-CG1 4.41Å; V202-I209 HydrophobicContact CG1-CG2 4.13Å; V202-E211 CarbonylContact C-O 3.6Å; V202-E211 VanDerWaalsContact CA-O 3.24Å; V202-E211 WeakPolarHBondContact CA-O 3.34Å; V202-V212 HydrophobicContact CG1-CG2 4.45Å; V202-V212 HydrophobicContact CG2-CG2 4.11Å; V202-Q548 VanDerWaalsContact N-CD 3.35Å; V202-Q548 PolarHBondContact O-NE2 3.28Å
203	A	90.3	Very high	88.4	Confident	39 Å²	39	41.8 Å²	41.8	32%	0.322	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	128.9	167.2	0	0	0	0	0	110.1	G201 K210 E211	G201-A203 PolarHBondContact O-N 3.07Å; A203-K210 WeakPolarHBondContact O-CB 3.39Å; A203-K210 PolarHBondContact O-N 2.88Å; A203-E211 HydrophobicContact CB-CB 4Å; A203-E211 PolarHBondContact N-O 3.23Å; A203-E211 PolarHBondContact O-N 2.92Å
204	V	88.9	Confident	88.6	Confident	71 Å²	71	41 Å²	41	43%	0.43	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	134.6	-173.3	-174.1	0	0	0	0	110	Y183 V202 G207 R208	Y183-V204 HydrophobicContact CD1-CG2 4.04Å; Y183-V204 HydrophobicContact CG-CG2 4.15Å; V202-V204 HydrophobicContact CG1-CG2 4.15Å; V204-G207 WeakPolarHBondContact CG1-O 3.14Å; V204-R208 CarbonylContact C-O 3.48Å; V204-R208 WeakPolarHBondContact CA-O 3.4Å
205	C	86.9	Confident	88.9	Confident	64 Å²	64	40 Å²	40	43%	0.432	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	117.6	173.1	-172.9	0	0	0	0	109	G207 R208 K210	C205-G207 VanDerWaalsContact C-N 3.26Å; C205-G207 PolarHBondContact O-N 3.08Å; C205-R208 PolarHBondContact N-O 3.23Å; C205-R208 PolarHBondContact O-N 2.83Å; C205-K210 HydrophobicContact CB-CB 4.23Å; C205-K210 HydrophobicContact CB-CD 4.16Å
206	N	86.2	Confident	89.1	Confident	160 Å²	160	40.4 Å²	40.4	86%	0.856	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	43.7	-174.9	-60.8	-11.7	0	0	0	113.1	R208	N206-R208 PolarHBondContact O-N 3.41Å
207	G	82.3	Confident	89.5	Confident	33 Å²	33	40.4 Å²	40.4	34%	0.34	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	-18.1	-177.2	0	0	0	0	0	115.2	T182 Y183 V204 C205	T182-G207 CarbonylContact C-O 3.6Å; T182-G207 WeakPolarHBondContact CA-O 3.36Å; T182-G207 WeakPolarHBondContact CB-O 3.47Å; T182-G207 WeakPolarHBondContact CG2-O 3.34Å; Y183-G207 PolarHBondContact N-O 3.12Å; Y183-G207 VanDerWaalsContact N-O 3.14Å; V204-G207 WeakPolarHBondContact CG1-O 3.14Å; C205-G207 VanDerWaalsContact C-N 3.26Å; C205-G207 PolarHBondContact O-N 3.08Å
208	R	85.9	Confident	89.8	Confident	148 Å²	148	42 Å²	42	56%	0.558	22%	0.224	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	149.5	-178.1	-66.8	-174.9	173.3	125.5	-3.9	113.5	L181 V204 C205 N206 K210	L181-R208 WeakPolarHBondContact O-CA 3.43Å; V204-R208 CarbonylContact C-O 3.48Å; V204-R208 WeakPolarHBondContact CA-O 3.4Å; C205-R208 PolarHBondContact N-O 3.23Å; C205-R208 PolarHBondContact O-N 2.83Å; N206-R208 PolarHBondContact O-N 3.41Å; R208-K210 PolarHBondContact O-N 3.36Å
209	I	87.9	Confident	89.8	Confident	7 Å²	7	41.2 Å²	41.2	4%	0.036	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	119.1	176.5	-57.5	168.6	0	0	0	109.8	M113 Y168 L181 L195 F199 V202 V212	M113-I209 HydrophobicContact CE-CG2 4.36Å; M113-I209 HydrophobicContact CG-CG2 4.25Å; Y168-I209 WeakPolarHBondContact CE2-O 3.3Å; L181-I209 PolarHBondContact O-N 2.87Å; L195-I209 HydrophobicContact CD1-CD1 3.57Å; F199-I209 HydrophobicContact CD2-CD1 4.39Å; F199-I209 HydrophobicContact CE2-CD1 4.33Å; V202-I209 HydrophobicContact CG1-CG1 4.41Å; V202-I209 HydrophobicContact CG1-CG2 4.13Å; I209-V212 HydrophobicContact CG2-CG2 3.72Å
210	K	88.9	Confident	89.6	Confident	131 Å²	131	41.5 Å²	41.5	57%	0.57	22%	0.221	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	-43.2	175.6	-176.3	-178.3	176.7	-174.9	0	111.8	N111 A203 C205 R208	N111-K210 PolarHBondContact ND2-O 2.97Å; A203-K210 WeakPolarHBondContact O-CB 3.39Å; A203-K210 PolarHBondContact O-N 2.88Å; C205-K210 HydrophobicContact CB-CB 4.23Å; C205-K210 HydrophobicContact CB-CD 4.16Å; R208-K210 PolarHBondContact O-N 3.36Å
211	E	90.6	Very high	89.4	Confident	56 Å²	56	41.5 Å²	41.5	26%	0.262	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	143.7	-175.3	166.7	174.9	-170.9	0	0	110	N111 V202 A203 K213	N111-E211 HydrophobicContact CB-CB 4.31Å; N111-E211 HydrophobicContact CB-CG 3.71Å; N111-E211 VanDerWaalsContact OD1-CA 3.26Å; N111-E211 WeakPolarHBondContact OD1-CA 3.43Å; V202-E211 CarbonylContact C-O 3.6Å; V202-E211 VanDerWaalsContact CA-O 3.24Å; V202-E211 WeakPolarHBondContact CA-O 3.34Å; A203-E211 HydrophobicContact CB-CB 4Å; A203-E211 PolarHBondContact N-O 3.23Å; A203-E211 PolarHBondContact O-N 2.92Å; E211-K213 HydrophobicContact CG-CG 4.49Å; E211-K213 WeakPolarHBondContact OE1-CE 3.5Å
212	V	92.6	Very high	89.2	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.216	C	C	.	.			trans	-133.5	128.4	173.5	177.6	0	0	0	0	107.1	N111 L112 M113 F199 V202 I209 L214 I215	N111-V212 PolarHBondContact OD1-N 2.87Å; N111-V212 PolarHBondContact OD1-O 3.38Å; L112-V212 WeakPolarHBondContact CB-O 3.5Å; L112-V212 PolarHBondContact N-O 3.3Å; M113-V212 HydrophobicContact CG-CB 3.69Å; M113-V212 HydrophobicContact CG-CG2 3.39Å; M113-V212 HydrophobicContact SD-CB 4.16Å; M113-V212 HydrophobicContact SD-CG2 3.68Å; F199-V212 HydrophobicContact CB-CG1 3.92Å; F199-V212 HydrophobicContact CB-CG2 4.35Å; F199-V212 HydrophobicContact CD1-CG1 3.97Å; F199-V212 HydrophobicContact CD2-CG2 4.41Å; F199-V212 HydrophobicContact CG-CG1 4.09Å; F199-V212 HydrophobicContact CG-CG2 4.23Å; V202-V212 HydrophobicContact CG1-CG2 4.45Å; V202-V212 HydrophobicContact CG2-CG2 4.11Å; I209-V212 HydrophobicContact CG2-CG2 3.72Å; V212-L214 VanDerWaalsContact CG1-O 3.24Å; V212-L214 WeakPolarHBondContact CG1-O 3.44Å; V212-I215 HydrophobicContact CG1-CG1 4.07Å
213	K	92	Very high	88.6	Confident	69 Å²	69	40.5 Å²	40.5	30%	0.3	21%	0.213	S	C	.	.	S	Bend	trans	-96.2	-25.4	-177.2	-66.3	-174.1	175.5	-171.6	0	113.4	N109 L112 G200 E211 F544	N109-K213 WeakPolarHBondContact O-CD 3.43Å; L112-K213 WeakPolarHBondContact CD1-O 3.46Å; G200-K213 PolarHBondContact O-N 3.45Å; E211-K213 HydrophobicContact CG-CG 4.49Å; E211-K213 WeakPolarHBondContact OE1-CE 3.5Å; K213-F544 HydrophobicContact CD-CE1 3.85Å; K213-F544 HydrophobicContact CD-CZ 4.3Å
214	L	92.9	Very high	88	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.01	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	130.7	-178.1	-178.6	78.1	0	0	0	109.5	V104 A105 G200 V212 L540 F544 V545	V104-L214 WeakPolarHBondContact O-CA 3.41Å; V104-L214 WeakPolarHBondContact O-CD1 3.2Å; A105-L214 HydrophobicContact CB-CD1 4Å; G200-L214 PolarHBondContact N-O 3.39Å; G200-L214 PolarHBondContact O-N 3.41Å; V212-L214 VanDerWaalsContact CG1-O 3.24Å; V212-L214 WeakPolarHBondContact CG1-O 3.44Å; L214-L540 HydrophobicContact CD1-CB 4.21Å; L214-L540 HydrophobicContact CD1-CD1 4.05Å; L214-L540 HydrophobicContact CD1-CD2 4.38Å; L214-L540 HydrophobicContact CD1-CG 4.45Å; L214-L540 HydrophobicContact CD2-CB 4.21Å; L214-F544 HydrophobicContact CB-CB 4.31Å; L214-F544 HydrophobicContact CD2-CB 4.1Å; L214-V545 HydrophobicContact CD2-CG2 3.35Å
215	I	93.6	Very high	87.2	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	123.1	166.8	-63	176.6	0	0	0	107.2	V104 L112 I121 L161 L198 F199 V212 L217	V104-I215 PolarHBondContact N-O 3.14Å; V104-I215 PolarHBondContact O-N 2.64Å; L112-I215 HydrophobicContact CB-CD1 4.19Å; L112-I215 HydrophobicContact CB-CG1 4.47Å; L112-I215 HydrophobicContact CD1-CB 4.37Å; L112-I215 HydrophobicContact CD1-CD1 4.29Å; L112-I215 HydrophobicContact CD1-CG1 3.89Å; I121-I215 HydrophobicContact CD1-CD1 3.78Å; I121-I215 HydrophobicContact CG2-CG2 4.33Å; L161-I215 HydrophobicContact CD1-CG2 4Å; L161-I215 HydrophobicContact CD2-CG2 4.17Å; L198-I215 HydrophobicContact CD1-CG2 4.5Å; F199-I215 HydrophobicContact CD1-CG1 3.92Å; F199-I215 HydrophobicContact CD1-CG2 4.47Å; F199-I215 HydrophobicContact CE1-CD1 4.18Å; F199-I215 HydrophobicContact CE1-CG1 3.97Å; F199-I215 HydrophobicContact CE1-CG2 4.35Å; V212-I215 HydrophobicContact CG1-CG1 4.07Å; I215-L217 HydrophobicContact CG2-CD2 3.96Å; I215-L217 HydrophobicContact CG2-CG 4.48Å
216	H	92.2	Very high	86.8	Confident	9 Å²	9	43.8 Å²	43.8	4%	0.042	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	100.1	-172.5	-177.6	-130.2	0	0	0	109.7	F101 G197 L198 Y537 V545	F101-H216 AromaticContact CD1-CE1 3.39Å; F101-H216 WeakPolarHBondContact CD1-CE1 3.32Å; F101-H216 AromaticContact CD1-NE2 3.4Å; F101-H216 WeakPolarHBondContact CD1-NE2 3.16Å; F101-H216 AromaticContact CE1-CE1 4Å; F101-H216 AromaticContact CG-NE2 3.82Å; G197-H216 WeakPolarHBondContact O-CB 3.35Å; G197-H216 PolarHBondContact O-ND1 3.45Å; L198-H216 WeakPolarHBondContact CD1-O 3.26Å; L198-H216 PolarHBondContact O-N 3.37Å; H216-Y537 AromaticContact NE2-CE2 3.8Å; H216-Y537 AromaticContact NE2-CZ 3.74Å; H216-Y537 PolarHBondContact NE2-OH 2.85Å; H216-V545 HydrophobicContact CB-CG2 4.48Å
217	L	92.6	Very high	86.4	Confident	2 Å²	2	39 Å²	39	1%	0.01	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	134.7	-178.5	-54	173.6	0	0	0	109.7	F101 V102 V104 I121 N158 L161 I215 Y219	F101-L217 CarbonylContact C-O 3.3Å; F101-L217 VanDerWaalsContact CA-O 3.29Å; F101-L217 WeakPolarHBondContact CA-O 3.32Å; V102-L217 HydrophobicContact CB-CB 4.21Å; V102-L217 PolarHBondContact N-O 2.86Å; V102-L217 PolarHBondContact O-N 3.3Å; V104-L217 HydrophobicContact CG2-CD1 4.03Å; V104-L217 HydrophobicContact CG2-CG 4.44Å; I121-L217 HydrophobicContact CG2-CD1 4.22Å; I121-L217 HydrophobicContact CG2-CD2 4.28Å; N158-L217 HydrophobicContact CB-CD2 4.36Å; N158-L217 WeakPolarHBondContact OD1-CA 3.38Å; L161-L217 HydrophobicContact CD2-CD2 3.47Å; L161-L217 VanDerWaalsContact CD2-CD2 3.47Å; I215-L217 HydrophobicContact CG2-CD2 3.96Å; I215-L217 HydrophobicContact CG2-CG 4.48Å; L217-Y219 HydrophobicContact CB-CE2 4.01Å; L217-Y219 HydrophobicContact CD1-CE2 4.5Å
218	M	90.3	Very high	86.5	Confident	46 Å²	46	39.6 Å²	39.6	23%	0.227	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	120.3	176.6	179.8	-176.8	63.1	0	0	109.2	A99 F101 S157 N158 N220	A99-M218 HydrophobicContact CB-CG 4.46Å; F101-M218 HydrophobicContact CD1-CB 4.02Å; F101-M218 HydrophobicContact CD1-CG 3.97Å; F101-M218 HydrophobicContact CE1-CB 4.02Å; F101-M218 HydrophobicContact CE1-CG 3.57Å; F101-M218 HydrophobicContact CE1-SD 3.74Å; F101-M218 HydrophobicContact CZ-CG 4.21Å; F101-M218 HydrophobicContact CZ-SD 4.22Å; S157-M218 VanDerWaalsContact CB-O 3.26Å; S157-M218 WeakPolarHBondContact CB-O 3.4Å; S157-M218 PolarHBondContact OG-O 3.04Å; N158-M218 PolarHBondContact ND2-O 2.82Å; N158-M218 PolarHBondContact OD1-N 3Å; N158-M218 PolarHBondContact OD1-O 3.1Å; M218-N220 VanDerWaalsContact CE-ND2 3.34Å; M218-N220 WeakPolarHBondContact CE-ND2 3.19Å
219	Y	90.6	Very high	86.4	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.008	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	105.8	175.3	-61.1	-75	0	0	0	109.4	A99 F100 V102 N125 V128 L129 N158 L217	A99-Y219 WeakPolarHBondContact CA-O 3.33Å; F100-Y219 PolarHBondContact N-O 3.03Å; F100-Y219 PolarHBondContact O-N 3.14Å; V102-Y219 HydrophobicContact CG2-CD2 4.34Å; V102-Y219 HydrophobicContact CG2-CE2 4.04Å; N125-Y219 WeakPolarHBondContact OD1-CE1 3.35Å; N125-Y219 PolarHBondContact OD1-OH 3.3Å; V128-Y219 HydrophobicContact CB-CE1 4.02Å; V128-Y219 HydrophobicContact CG1-CD1 3.9Å; V128-Y219 HydrophobicContact CG1-CE1 3.59Å; V128-Y219 HydrophobicContact CG1-CE2 4.33Å; V128-Y219 HydrophobicContact CG1-CG 4.4Å; L129-Y219 HydrophobicContact CD2-CD1 4.01Å; L129-Y219 HydrophobicContact CD2-CE1 4.23Å; L129-Y219 HydrophobicContact CG-CE1 4.29Å; N158-Y219 WeakPolarHBondContact ND2-CE1 3.49Å; L217-Y219 HydrophobicContact CB-CE2 4.01Å; L217-Y219 HydrophobicContact CD1-CE2 4.5Å
220	N	86.8	Confident	86.2	Confident	7 Å²	7	33.5 Å²	33.5	4%	0.037	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	129.6	173.2	-65.8	-55.7	0	0	0	109.4	E98 A99 L153 C154 S157 M218	E98-N220 WeakPolarHBondContact O-CA 3.27Å; A99-N220 WeakPolarHBondContact CB-OD1 3.5Å; L153-N220 HydrophobicContact CB-CB 4.21Å; L153-N220 HydrophobicContact CD2-CB 3.9Å; L153-N220 HydrophobicContact CG-CB 4.06Å; C154-N220 WeakPolarHBondContact CA-O 3.37Å; C154-N220 WeakPolarHBondContact CB-O 3.36Å; C154-N220 PolarHBondContact SG-O 3.34Å; S157-N220 PolarHBondContact OG-N 3.19Å; S157-N220 VanDerWaalsContact OG-N 3.13Å; M218-N220 VanDerWaalsContact CE-ND2 3.34Å; M218-N220 WeakPolarHBondContact CE-ND2 3.19Å
221	Y	86.5	Confident	86	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	146.5	178.4	62.3	-81	0	0	0	112.4	E98 F100 F143 T223 I230 F233	E98-Y221 HydrophobicContact CB-CE1 4.28Å; E98-Y221 HydrophobicContact CB-CE2 4.36Å; E98-Y221 PolarHBondContact N-O 3.17Å; E98-Y221 PolarHBondContact O-N 3.04Å; E98-Y221 PolarHBondContact OE2-OH 3.32Å; E98-Y221 VanDerWaalsContact OE2-OH 3.12Å; F100-Y221 HydrophobicContact CB-CE1 3.91Å; F143-Y221 HydrophobicContact CE2-CG 4.49Å; Y221-T223 HydrophobicContact CD2-CG2 4.26Å; Y221-T223 HydrophobicContact CE2-CG2 3.85Å; Y221-I230 HydrophobicContact CE2-CG1 4.31Å; Y221-F233 HydrophobicContact CD1-CD1 4.21Å; Y221-F233 AromaticContact CD1-CE1 3.97Å; Y221-F233 HydrophobicContact CD1-CE1 3.97Å; Y221-F233 HydrophobicContact CD1-CZ 4.48Å; Y221-F233 AromaticContact CE1-CD1 3.84Å; Y221-F233 HydrophobicContact CE1-CD1 3.84Å; Y221-F233 AromaticContact CE1-CE1 3.81Å; Y221-F233 HydrophobicContact CE1-CE1 3.81Å; Y221-F233 HydrophobicContact CE2-CD1 4.37Å; Y221-F233 AromaticContact CZ-CD1 3.93Å
222	P	84.2	Confident	86	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.006	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	134.5	175.5	31	-32.3	0	0	0	110.3	T90 I147 F224	T90-P222 HydrophobicContact CG2-CB 4.19Å; I147-P222 HydrophobicContact CG2-CG 4.03Å; I147-P222 WeakPolarHBondContact O-CG 3.48Å; P222-F224 HydrophobicContact CB-CE1 4.01Å; P222-F224 HydrophobicContact CB-CE2 4.05Å; P222-F224 HydrophobicContact CB-CZ 3.68Å; P222-F224 HydrophobicContact CG-CE1 4.26Å; P222-F224 HydrophobicContact CG-CE2 3.81Å; P222-F224 HydrophobicContact CG-CZ 3.48Å; P222-F224 VanDerWaalsContact CG-CZ 3.48Å
223	T	78.5	Confident	85.8	Confident	4 Å²	4	31.6 Å²	31.6	3%	0.025	17%	0.166	C	C	.	.			trans	-96.5	-13.6	-179.3	67.1	0	0	0	0	112.9	A96 E98 Y221 N225 N226 I230	A96-T223 WeakPolarHBondContact CB-OG1 3.43Å; A96-T223 PolarHBondContact O-N 3.27Å; A96-T223 PolarHBondContact O-OG1 2.75Å; E98-T223 HydrophobicContact CB-CG2 3.88Å; E98-T223 HydrophobicContact CG-CG2 3.64Å; Y221-T223 HydrophobicContact CD2-CG2 4.26Å; Y221-T223 HydrophobicContact CE2-CG2 3.85Å; T223-N225 PolarHBondContact O-N 2.95Å; T223-N225 VanDerWaalsContact O-N 3.1Å; T223-N226 PolarHBondContact O-N 3.35Å; T223-I230 HydrophobicContact CG2-CD1 3.8Å; T223-I230 HydrophobicContact CG2-CG1 3.53Å
224	F	77.8	Confident	85.7	Confident	62 Å²	62	29.1 Å²	29.1	27%	0.272	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	31.2	-177	-51.6	-71.4	0	0	0	113.9	I147 K150 P222 N226 I229	I147-F224 HydrophobicContact CG2-CE2 4.49Å; K150-F224 HydrophobicContact CB-CE1 4.32Å; K150-F224 HydrophobicContact CB-CZ 3.82Å; K150-F224 HydrophobicContact CD-CE1 3.76Å; K150-F224 HydrophobicContact CD-CE2 4.11Å; K150-F224 HydrophobicContact CD-CZ 3.27Å; K150-F224 HydrophobicContact CG-CZ 4.2Å; P222-F224 HydrophobicContact CB-CE1 4.01Å; P222-F224 HydrophobicContact CB-CE2 4.05Å; P222-F224 HydrophobicContact CB-CZ 3.68Å; P222-F224 HydrophobicContact CG-CE1 4.26Å; P222-F224 HydrophobicContact CG-CE2 3.81Å; P222-F224 HydrophobicContact CG-CZ 3.48Å; P222-F224 VanDerWaalsContact CG-CZ 3.48Å; F224-N226 PolarHBondContact O-N 2.8Å; F224-N226 VanDerWaalsContact O-N 3.12Å; F224-I229 HydrophobicContact CD2-CD1 3.88Å
225	N	72.2	Confident	85.5	Confident	123 Å²	123	35.3 Å²	35.3	66%	0.658	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.8	21.1	-174.7	-55.4	-18.5	0	0	0	113.7	A96 T223	A96-N225 PolarHBondContact N-OD1 3.23Å; T223-N225 PolarHBondContact O-N 2.95Å; T223-N225 VanDerWaalsContact O-N 3.1Å
226	N	77.9	Confident	85.4	Confident	57 Å²	57	35.8 Å²	35.8	31%	0.305	19%	0.186	S	C	.	.			trans	-110.5	102.4	178.8	-170.3	-4.5	0	0	0	110.5	T223 F224 T228 I229	T223-N226 PolarHBondContact O-N 3.35Å; F224-N226 PolarHBondContact O-N 2.8Å; F224-N226 VanDerWaalsContact O-N 3.12Å; N226-T228 PolarHBondContact ND2-OG1 3.16Å; N226-T228 PolarHBondContact O-N 2.81Å; N226-T228 WeakPolarHBondContact OD1-CB 3.17Å; N226-T228 PolarHBondContact OD1-N 2.81Å; N226-T228 VanDerWaalsContact OD1-N 3.15Å; N226-T228 PolarHBondContact OD1-OG1 3.3Å; N226-I229 HydrophobicContact CB-CD1 4Å; N226-I229 HydrophobicContact CB-CG1 4.1Å; N226-I229 WeakPolarHBondContact O-CB 3.37Å; N226-I229 PolarHBondContact O-N 3.48Å
227	A	78.1	Confident	85.3	Confident	59 Å²	59	35.3 Å²	35.3	49%	0.488	18%	0.184	S	C	.	.	H	α-helix	trans	-58.9	-20.4	179	0	0	0	0	0	113.7	I229 K231	A227-I229 VanDerWaalsContact C-N 3.31Å; A227-I229 PolarHBondContact O-N 3.23Å; A227-K231 PolarHBondContact O-N 2.98Å
228	T	83.3	Confident	85.2	Confident	47 Å²	47	39 Å²	39	29%	0.288	20%	0.198	S	C	.	.	H	α-helix	trans	-68.3	-30.8	176.3	65.3	0	0	0	0	112.5	N226 T232	N226-T228 PolarHBondContact ND2-OG1 3.16Å; N226-T228 PolarHBondContact O-N 2.81Å; N226-T228 WeakPolarHBondContact OD1-CB 3.17Å; N226-T228 PolarHBondContact OD1-N 2.81Å; N226-T228 VanDerWaalsContact OD1-N 3.15Å; N226-T228 PolarHBondContact OD1-OG1 3.3Å; T228-T232 VanDerWaalsContact O-CB 3.22Å; T228-T232 WeakPolarHBondContact O-CB 3.43Å; T228-T232 PolarHBondContact O-N 3.41Å; T228-T232 PolarHBondContact O-OG1 3.37Å
229	I	84.3	Confident	85.2	Confident	13 Å²	13	43.3 Å²	43.3	7%	0.067	21%	0.212	C	C	.	.	H	α-helix	trans	-67.1	-47	179.8	-64	179.6	0	0	0	109.7	I136 I147 F224 N226 A227 K231 T232 F233	I136-I229 HydrophobicContact CD1-CG1 4.26Å; I147-I229 HydrophobicContact CD1-CG2 3.83Å; F224-I229 HydrophobicContact CD2-CD1 3.88Å; N226-I229 HydrophobicContact CB-CD1 4Å; N226-I229 HydrophobicContact CB-CG1 4.1Å; N226-I229 WeakPolarHBondContact O-CB 3.37Å; N226-I229 PolarHBondContact O-N 3.48Å; A227-I229 VanDerWaalsContact C-N 3.31Å; A227-I229 PolarHBondContact O-N 3.23Å; I229-K231 PolarHBondContact O-N 2.74Å; I229-T232 PolarHBondContact O-N 2.94Å; I229-F233 VanDerWaalsContact O-CB 3.27Å; I229-F233 WeakPolarHBondContact O-CB 3.31Å; I229-F233 PolarHBondContact O-N 3.41Å
230	I	84.3	Confident	85.2	Confident	13 Å²	13	45.2 Å²	45.2	7%	0.067	22%	0.219	C	C	.	.	H	α-helix	trans	-54.8	-56.1	178	-58.6	165.6	0	0	0	110.1	E98 Y221 T223 T232 F233 E234 D257	E98-I230 VanDerWaalsContact CD-CD1 3.46Å; E98-I230 WeakPolarHBondContact OE1-CD1 3.33Å; E98-I230 VanDerWaalsContact OE2-CD1 3.28Å; E98-I230 WeakPolarHBondContact OE2-CD1 3.34Å; E98-I230 VanDerWaalsContact OE2-CG1 3.29Å; E98-I230 WeakPolarHBondContact OE2-CG1 3.46Å; E98-I230 WeakPolarHBondContact OE2-CG2 3.47Å; Y221-I230 HydrophobicContact CE2-CG1 4.31Å; T223-I230 HydrophobicContact CG2-CD1 3.8Å; T223-I230 HydrophobicContact CG2-CG1 3.53Å; I230-T232 VanDerWaalsContact C-N 3.32Å; I230-T232 PolarHBondContact O-N 2.92Å; I230-F233 PolarHBondContact O-N 2.97Å; I230-E234 WeakPolarHBondContact O-CB 3.43Å; I230-E234 PolarHBondContact O-N 3.43Å; I230-D257 HydrophobicContact CG2-CB 3.7Å
231	K	85.6	Confident	85.4	Confident	125 Å²	125	45.4 Å²	45.4	54%	0.543	22%	0.22	S	C	.	.	H	α-helix	trans	-62.1	-38.6	-178.9	-68.9	-179.5	179.3	-177.3	0	112.8	A227 I229 K235	A227-K231 PolarHBondContact O-N 2.98Å; I229-K231 PolarHBondContact O-N 2.74Å; K231-K235 WeakPolarHBondContact O-CB 3.25Å; K231-K235 PolarHBondContact O-N 3.41Å
232	T	88.5	Confident	85.4	Confident	23 Å²	23	48.8 Å²	48.8	14%	0.141	24%	0.244	C	C	.	.	H	α-helix	trans	-71.3	-42.6	-179.6	-56.6	0	0	0	0	111	L134 N135 I136 T228 I229 I230 K235 A236	L134-T232 HydrophobicContact CB-CG2 3.83Å; L134-T232 HydrophobicContact CD2-CG2 4.5Å; N135-T232 WeakPolarHBondContact O-CG2 3.2Å; I136-T232 HydrophobicContact CG1-CG2 4.48Å; T228-T232 VanDerWaalsContact O-CB 3.22Å; T228-T232 WeakPolarHBondContact O-CB 3.43Å; T228-T232 PolarHBondContact O-N 3.41Å; T228-T232 PolarHBondContact O-OG1 3.37Å; I229-T232 PolarHBondContact O-N 2.94Å; I230-T232 VanDerWaalsContact C-N 3.32Å; I230-T232 PolarHBondContact O-N 2.92Å; T232-K235 PolarHBondContact O-N 2.88Å; T232-A236 VanDerWaalsContact O-CB 3.27Å; T232-A236 WeakPolarHBondContact O-CB 3.35Å; T232-A236 PolarHBondContact O-N 3.38Å
233	F	90.5	Very high	85.7	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-60.2	-52.6	175.3	177	-103.6	0	0	0	111	F100 V128 L132 L134 F143 Y221 I229 I230 K235 A236 L237	F100-F233 HydrophobicContact CB-CE1 3.89Å; F100-F233 HydrophobicContact CD2-CD1 4.42Å; F100-F233 HydrophobicContact CD2-CE1 4.24Å; F100-F233 HydrophobicContact CG-CE1 4.03Å; V128-F233 HydrophobicContact CG1-CE2 4.47Å; V128-F233 HydrophobicContact CG1-CZ 4.42Å; L132-F233 HydrophobicContact CD2-CD2 3.84Å; L132-F233 HydrophobicContact CD2-CE2 3.64Å; L134-F233 HydrophobicContact CD1-CB 4.05Å; L134-F233 HydrophobicContact CD1-CD2 4.38Å; L134-F233 HydrophobicContact CD2-CB 4.3Å; L134-F233 HydrophobicContact CD2-CD2 4.19Å; F143-F233 HydrophobicContact CD1-CE2 4.32Å; F143-F233 AromaticContact CD2-CD2 3.6Å; F143-F233 HydrophobicContact CD2-CD2 3.6Å; F143-F233 AromaticContact CD2-CE2 3.72Å; F143-F233 HydrophobicContact CD2-CE2 3.72Å; F143-F233 AromaticContact CE1-CE2 3.98Å; F143-F233 HydrophobicContact CE1-CE2 3.98Å; F143-F233 AromaticContact CE2-CD2 3.42Å; F143-F233 HydrophobicContact CE2-CD2 3.42Å; F143-F233 VanDerWaalsContact CE2-CD2 3.42Å; F143-F233 AromaticContact CE2-CE2 3.32Å; F143-F233 HydrophobicContact CE2-CE2 3.32Å; F143-F233 HydrophobicContact CE2-CG 4.34Å; F143-F233 HydrophobicContact CE2-CZ 4.19Å; F143-F233 HydrophobicContact CG-CD2 4.36Å; F143-F233 HydrophobicContact CG-CE2 4.2Å; F143-F233 HydrophobicContact CZ-CD2 4.07Å; F143-F233 AromaticContact CZ-CE2 3.46Å; F143-F233 HydrophobicContact CZ-CE2 3.46Å; F143-F233 VanDerWaalsContact CZ-CE2 3.46Å; F143-F233 HydrophobicContact CZ-CZ 4.03Å; Y221-F233 HydrophobicContact CD1-CD1 4.21Å; Y221-F233 AromaticContact CD1-CE1 3.97Å; Y221-F233 HydrophobicContact CD1-CE1 3.97Å; Y221-F233 HydrophobicContact CD1-CZ 4.48Å; Y221-F233 AromaticContact CE1-CD1 3.84Å; Y221-F233 HydrophobicContact CE1-CD1 3.84Å; Y221-F233 AromaticContact CE1-CE1 3.81Å; Y221-F233 HydrophobicContact CE1-CE1 3.81Å; Y221-F233 HydrophobicContact CE2-CD1 4.37Å; Y221-F233 AromaticContact CZ-CD1 3.93Å; I229-F233 VanDerWaalsContact O-CB 3.27Å; I229-F233 WeakPolarHBondContact O-CB 3.31Å; I229-F233 PolarHBondContact O-N 3.41Å; I230-F233 PolarHBondContact O-N 2.97Å; F233-K235 VanDerWaalsContact C-N 3.34Å; F233-K235 PolarHBondContact O-N 3.37Å; F233-A236 PolarHBondContact O-N 2.94Å; F233-L237 HydrophobicContact CE1-CD2 4.05Å; F233-L237 HydrophobicContact CZ-CD2 4.1Å; F233-L237 WeakPolarHBondContact O-CB 3.43Å; F233-L237 PolarHBondContact O-N 2.75Å
234	E	88.2	Confident	86.1	Confident	16 Å²	16	53.8 Å²	53.8	8%	0.075	28%	0.276	C	S	.	.	H	α-helix	trans	-55.3	-49.4	175.9	175.7	-173	146.5	0	0	111.4	F100 I230 A236 L237 R238 I258	F100-E234 HydrophobicContact CE2-CB 3.95Å; F100-E234 HydrophobicContact CE2-CG 3.82Å; F100-E234 HydrophobicContact CZ-CG 4.26Å; I230-E234 WeakPolarHBondContact O-CB 3.43Å; I230-E234 PolarHBondContact O-N 3.43Å; E234-A236 VanDerWaalsContact C-N 3.31Å; E234-A236 PolarHBondContact O-N 3.17Å; E234-L237 PolarHBondContact O-N 2.87Å; E234-R238 HydrophobicContact CG-CG 4.27Å; E234-R238 VanDerWaalsContact O-CB 3.31Å; E234-R238 WeakPolarHBondContact O-CB 3.46Å; E234-R238 WeakPolarHBondContact O-CG 3.42Å; E234-R238 PolarHBondContact O-N 3.44Å; E234-R238 IonicContact OE1-CZ 3.14Å; E234-R238 IonicContact OE1-NE 3.34Å; E234-R238 PolarHBondContact OE1-NE 2.72Å; E234-R238 IonicContact OE1-NH1 3.37Å; E234-R238 PolarHBondContact OE1-NH1 2.86Å; E234-R238 IonicContact OE1-NH2 2.64Å; E234-I258 HydrophobicContact CG-CD1 4.21Å; E234-I258 HydrophobicContact CG-CG1 4.2Å; E234-I258 WeakPolarHBondContact OE1-CG1 3.37Å; E234-I258 WeakPolarHBondContact OE2-CG1 3.34Å
235	K	89.6	Confident	86.2	Confident	132 Å²	132	57.4 Å²	57.4	57%	0.574	29%	0.294	S	S	*	.	H	α-helix	trans	-65.7	-34.4	-178.3	-170.2	-177.6	178.5	174.8	0	112.3	K231 T232 F233 R239	K231-K235 WeakPolarHBondContact O-CB 3.25Å; K231-K235 PolarHBondContact O-N 3.41Å; T232-K235 PolarHBondContact O-N 2.88Å; F233-K235 VanDerWaalsContact C-N 3.34Å; F233-K235 PolarHBondContact O-N 3.37Å; K235-R239 WeakPolarHBondContact O-CB 3.48Å; K235-R239 WeakPolarHBondContact O-CG 3.35Å; K235-R239 PolarHBondContact O-N 2.64Å; K235-R239 PolarHBondContact O-NE 3.32Å
236	A	90.7	Very high	86.6	Confident	10 Å²	10	57 Å²	57	8%	0.083	30%	0.3	C	S	.	.	H	α-helix	trans	-70.5	-46	176.1	0	0	0	0	0	110.8	L132 L134 T232 F233 E234 R239 Y240	L132-A236 HydrophobicContact CD1-CB 4.14Å; L132-A236 HydrophobicContact CG-CB 4.46Å; L134-A236 HydrophobicContact CD2-CB 3.62Å; T232-A236 VanDerWaalsContact O-CB 3.27Å; T232-A236 WeakPolarHBondContact O-CB 3.35Å; T232-A236 PolarHBondContact O-N 3.38Å; F233-A236 PolarHBondContact O-N 2.94Å; E234-A236 VanDerWaalsContact C-N 3.31Å; E234-A236 PolarHBondContact O-N 3.17Å; A236-R239 PolarHBondContact O-N 3.05Å; A236-Y240 PolarHBondContact O-N 3.44Å
237	L	91.5	Very high	86.7	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64	-48	178.4	-177.8	58.1	0	0	0	111.6	F100 V102 V128 F233 E234 R239 Y240 L241	F100-L237 HydrophobicContact CD1-CD2 3.43Å; F100-L237 VanDerWaalsContact CD1-CD2 3.43Å; F100-L237 HydrophobicContact CE1-CD2 3.31Å; F100-L237 HydrophobicContact CE1-CG 4.28Å; F100-L237 HydrophobicContact CG-CD2 4.16Å; F100-L237 HydrophobicContact CZ-CD2 3.96Å; V102-L237 HydrophobicContact CG2-CD2 4.27Å; V128-L237 HydrophobicContact CG1-CD1 4.22Å; V128-L237 HydrophobicContact CG2-CD1 3.48Å; V128-L237 VanDerWaalsContact CG2-CD1 3.48Å; F233-L237 HydrophobicContact CE1-CD2 4.05Å; F233-L237 HydrophobicContact CZ-CD2 4.1Å; F233-L237 WeakPolarHBondContact O-CB 3.43Å; F233-L237 PolarHBondContact O-N 2.75Å; E234-L237 PolarHBondContact O-N 2.87Å; L237-R239 VanDerWaalsContact C-N 3.33Å; L237-R239 PolarHBondContact O-N 2.95Å; L237-Y240 WeakPolarHBondContact O-CB 3.42Å; L237-Y240 PolarHBondContact O-N 2.89Å; L237-Y240 VanDerWaalsContact O-N 3.09Å; L237-L241 HydrophobicContact CD1-CD1 4.09Å; L237-L241 HydrophobicContact CD1-CD2 4.45Å; L237-L241 HydrophobicContact CD1-CG 4.07Å; L237-L241 HydrophobicContact CG-CD1 3.92Å; L237-L241 HydrophobicContact CG-CG 4.32Å; L237-L241 VanDerWaalsContact O-CG 3.31Å; L237-L241 WeakPolarHBondContact O-CG 3.47Å; L237-L241 PolarHBondContact O-N 3.3Å
238	R	88.8	Confident	87	Confident	78 Å²	78	55.8 Å²	55.8	29%	0.294	29%	0.294	S	S	.	.	H	α-helix	trans	-57.6	-43.2	176.1	-77	179.8	167.6	-173.1	-14.9	112.4	E234 Y240 L241 S242 I258	E234-R238 HydrophobicContact CG-CG 4.27Å; E234-R238 VanDerWaalsContact O-CB 3.31Å; E234-R238 WeakPolarHBondContact O-CB 3.46Å; E234-R238 WeakPolarHBondContact O-CG 3.42Å; E234-R238 PolarHBondContact O-N 3.44Å; E234-R238 IonicContact OE1-CZ 3.14Å; E234-R238 IonicContact OE1-NE 3.34Å; E234-R238 PolarHBondContact OE1-NE 2.72Å; E234-R238 IonicContact OE1-NH1 3.37Å; E234-R238 PolarHBondContact OE1-NH1 2.86Å; E234-R238 IonicContact OE1-NH2 2.64Å; R238-Y240 VanDerWaalsContact C-N 3.31Å; R238-Y240 PolarHBondContact O-N 3.07Å; R238-L241 PolarHBondContact O-N 3.08Å; R238-S242 WeakPolarHBondContact O-CB 3.44Å; R238-S242 PolarHBondContact O-N 3.36Å; R238-S242 PolarHBondContact O-OG 3.47Å; R238-S242 VanDerWaalsContact O-OG 3.14Å; R238-I258 VanDerWaalsContact NH2-CD1 3.31Å; R238-I258 VanDerWaalsContact NH2-CG1 3.26Å; R238-I258 VanDerWaalsContact NH2-CG2 3.29Å
239	R	90.4	Very high	87.2	Confident	138 Å²	138	53.6 Å²	53.6	52%	0.521	28%	0.281	S	S	.	.	H	α-helix	trans	-62.1	-38.7	175.5	-85	-178.8	-80	166.6	-5.8	112.5	K235 A236 L237 S242 S243	K235-R239 WeakPolarHBondContact O-CB 3.48Å; K235-R239 WeakPolarHBondContact O-CG 3.35Å; K235-R239 PolarHBondContact O-N 2.64Å; K235-R239 PolarHBondContact O-NE 3.32Å; A236-R239 PolarHBondContact O-N 3.05Å; L237-R239 VanDerWaalsContact C-N 3.33Å; L237-R239 PolarHBondContact O-N 2.95Å; R239-S242 WeakPolarHBondContact CA-OG 3Å; R239-S242 PolarHBondContact O-OG 2.92Å; R239-S243 PolarHBondContact O-N 3.38Å
240	Y	91.2	Very high	87.4	Confident	42 Å²	42	55.5 Å²	55.5	17%	0.165	29%	0.289	C	S	.	.	H	α-helix	trans	-68.6	-48.8	176.1	179.1	-118.6	0	0	0	111.3	I124 Y127 V128 A236 L237 R238 S242 S243 L244	I124-Y240 HydrophobicContact CB-CE1 4.47Å; I124-Y240 HydrophobicContact CG1-CE1 4.39Å; I124-Y240 HydrophobicContact CG2-CE1 4.07Å; Y127-Y240 WeakPolarHBondContact CB-OH 3.31Å; Y127-Y240 AromaticContact CD1-CD1 3.71Å; Y127-Y240 HydrophobicContact CD1-CD1 3.71Å; Y127-Y240 AromaticContact CD1-CD2 3.9Å; Y127-Y240 HydrophobicContact CD1-CD2 3.9Å; Y127-Y240 AromaticContact CD1-CE1 3.33Å; Y127-Y240 HydrophobicContact CD1-CE1 3.33Å; Y127-Y240 AromaticContact CD1-CE2 3.56Å; Y127-Y240 HydrophobicContact CD1-CE2 3.56Å; Y127-Y240 AromaticContact CD1-CG 3.96Å; Y127-Y240 HydrophobicContact CD1-CG 3.96Å; Y127-Y240 AromaticContact CD1-CZ 3.25Å; Y127-Y240 HydrophobicContact CD2-CE2 4.35Å; Y127-Y240 AromaticContact CE1-CD1 3.95Å; Y127-Y240 HydrophobicContact CE1-CD1 3.95Å; Y127-Y240 AromaticContact CE1-CD2 3.49Å; Y127-Y240 HydrophobicContact CE1-CD2 3.49Å; Y127-Y240 VanDerWaalsContact CE1-CD2 3.49Å; Y127-Y240 AromaticContact CE1-CE1 3.96Å; Y127-Y240 HydrophobicContact CE1-CE1 3.96Å; Y127-Y240 AromaticContact CE1-CE2 3.51Å; Y127-Y240 HydrophobicContact CE1-CE2 3.51Å; Y127-Y240 AromaticContact CE1-CG 3.72Å; Y127-Y240 HydrophobicContact CE1-CG 3.72Å; Y127-Y240 AromaticContact CE1-CZ 3.75Å; Y127-Y240 HydrophobicContact CE2-CE2 4.32Å; Y127-Y240 AromaticContact CG-CE1 3.95Å; Y127-Y240 HydrophobicContact CG-CE1 3.95Å; Y127-Y240 AromaticContact CG-CE2 3.99Å; Y127-Y240 HydrophobicContact CG-CE2 3.99Å; Y127-Y240 AromaticContact CG-CZ 3.54Å; Y127-Y240 AromaticContact CZ-CE2 3.91Å; V128-Y240 HydrophobicContact CG2-CD1 4.28Å; V128-Y240 HydrophobicContact CG2-CE1 4.36Å; A236-Y240 PolarHBondContact O-N 3.44Å; L237-Y240 WeakPolarHBondContact O-CB 3.42Å; L237-Y240 PolarHBondContact O-N 2.89Å; L237-Y240 VanDerWaalsContact O-N 3.09Å; R238-Y240 VanDerWaalsContact C-N 3.31Å; R238-Y240 PolarHBondContact O-N 3.07Å; Y240-S242 VanDerWaalsContact C-N 3.34Å; Y240-S242 PolarHBondContact O-N 3.22Å; Y240-S243 WeakPolarHBondContact O-CB 3.26Å; Y240-S243 PolarHBondContact O-N 3.07Å; Y240-S243 VanDerWaalsContact O-N 3.07Å; Y240-S243 PolarHBondContact O-OG 2.9Å; Y240-L244 HydrophobicContact CD1-CD1 4.25Å; Y240-L244 HydrophobicContact CE1-CD1 3.78Å; Y240-L244 HydrophobicContact CE2-CD1 4.13Å
241	L	90.7	Very high	87.7	Confident	11 Å²	11	56.6 Å²	56.6	6%	0.058	29%	0.293	C	S	.	.	H	α-helix	trans	-61.8	-39.7	179	-64.8	175.6	0	0	0	112.2	V102 I124 L237 R238 S243 L244 E245 F251	V102-L241 HydrophobicContact CG1-CD1 4.09Å; V102-L241 HydrophobicContact CG2-CD1 4.27Å; I124-L241 HydrophobicContact CG2-CD2 4.12Å; L237-L241 HydrophobicContact CD1-CD1 4.09Å; L237-L241 HydrophobicContact CD1-CD2 4.45Å; L237-L241 HydrophobicContact CD1-CG 4.07Å; L237-L241 HydrophobicContact CG-CD1 3.92Å; L237-L241 HydrophobicContact CG-CG 4.32Å; L237-L241 VanDerWaalsContact O-CG 3.31Å; L237-L241 WeakPolarHBondContact O-CG 3.47Å; L237-L241 PolarHBondContact O-N 3.3Å; R238-L241 PolarHBondContact O-N 3.08Å; L241-S243 VanDerWaalsContact C-N 3.25Å; L241-S243 PolarHBondContact O-N 3.21Å; L241-L244 PolarHBondContact O-N 2.67Å; L241-E245 PolarHBondContact O-N 2.84Å; L241-F251 HydrophobicContact CB-CB 4.11Å; L241-F251 HydrophobicContact CB-CD2 4.35Å; L241-F251 HydrophobicContact CB-CG 4.21Å; L241-F251 HydrophobicContact CD1-CB 4.16Å; L241-F251 HydrophobicContact CD2-CB 4.29Å; L241-F251 HydrophobicContact CD2-CD1 3.72Å; L241-F251 HydrophobicContact CD2-CD2 4.43Å; L241-F251 HydrophobicContact CD2-CE1 4.15Å; L241-F251 HydrophobicContact CD2-CG 3.89Å; L241-F251 HydrophobicContact CG-CB 4.41Å; L241-F251 HydrophobicContact CG-CG 4.45Å
242	S	87.5	Confident	87.9	Confident	70 Å²	70	51.6 Å²	51.6	49%	0.49	27%	0.273	S	S	.	.	H	α-helix	trans	-63.9	-30.4	175.6	63.5	0	0	0	0	112.8	R238 R239 Y240 L244 E245	R238-S242 WeakPolarHBondContact O-CB 3.44Å; R238-S242 PolarHBondContact O-N 3.36Å; R238-S242 PolarHBondContact O-OG 3.47Å; R238-S242 VanDerWaalsContact O-OG 3.14Å; R239-S242 WeakPolarHBondContact CA-OG 3Å; R239-S242 PolarHBondContact O-OG 2.92Å; Y240-S242 VanDerWaalsContact C-N 3.34Å; Y240-S242 PolarHBondContact O-N 3.22Å; S242-L244 PolarHBondContact O-N 3.12Å; S242-E245 PolarHBondContact O-N 3.47Å
243	S	89.3	Confident	88	Confident	74 Å²	74	51.5 Å²	51.5	52%	0.517	27%	0.273	S	S	.	.	H	α-helix	trans	-68.5	-19.2	175.8	77.4	0	0	0	0	113.2	R239 Y240 L241	R239-S243 PolarHBondContact O-N 3.38Å; Y240-S243 WeakPolarHBondContact O-CB 3.26Å; Y240-S243 PolarHBondContact O-N 3.07Å; Y240-S243 VanDerWaalsContact O-N 3.07Å; Y240-S243 PolarHBondContact O-OG 2.9Å; L241-S243 VanDerWaalsContact C-N 3.25Å; L241-S243 PolarHBondContact O-N 3.21Å
244	L	88	Confident	88	Confident	36 Å²	36	51.8 Å²	51.8	19%	0.188	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-1.9	-176.3	-63.4	170.2	0	0	0	113.5	I124 Y240 L241 S242 S246 T247 F251	I124-L244 HydrophobicContact CD1-CD1 3.65Å; I124-L244 HydrophobicContact CG1-CD1 3.58Å; Y240-L244 HydrophobicContact CD1-CD1 4.25Å; Y240-L244 HydrophobicContact CE1-CD1 3.78Å; Y240-L244 HydrophobicContact CE2-CD1 4.13Å; L241-L244 PolarHBondContact O-N 2.67Å; S242-L244 PolarHBondContact O-N 3.12Å; L244-S246 PolarHBondContact O-N 3.48Å; L244-S246 VanDerWaalsContact O-N 3.09Å; L244-T247 WeakPolarHBondContact O-CB 3.28Å; L244-T247 WeakPolarHBondContact O-CG2 3.38Å; L244-T247 PolarHBondContact O-N 3.3Å; L244-T247 PolarHBondContact O-OG1 2.62Å; L244-F251 HydrophobicContact CB-CE2 3.86Å; L244-F251 HydrophobicContact CB-CZ 4.31Å
245	E	80.5	Confident	87.9	Confident	139 Å²	139	51.1 Å²	51.1	65%	0.65	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-60.3	-24.2	-177.8	-163.9	165.7	-166.8	0	0	112.6	L241 S242 T247 G248	L241-E245 PolarHBondContact O-N 2.84Å; S242-E245 PolarHBondContact O-N 3.47Å; E245-T247 PolarHBondContact O-N 3.06Å; E245-T247 VanDerWaalsContact O-N 3.15Å; E245-G248 PolarHBondContact O-N 3.33Å
246	S	79.4	Confident	87.6	Confident	114 Å²	114	46.5 Å²	46.5	80%	0.797	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-62.8	-15.7	173.5	61.7	0	0	0	0	114.9	L244 G248	L244-S246 PolarHBondContact O-N 3.48Å; L244-S246 VanDerWaalsContact O-N 3.09Å; S246-G248 VanDerWaalsContact C-N 3.27Å; S246-G248 PolarHBondContact O-N 3.33Å
247	T	80.9	Confident	87.2	Confident	65 Å²	65	47.4 Å²	47.4	40%	0.399	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-78.5	-6.6	-178.6	61.2	0	0	0	0	114.1	L244 E245 L249	L244-T247 WeakPolarHBondContact O-CB 3.28Å; L244-T247 WeakPolarHBondContact O-CG2 3.38Å; L244-T247 PolarHBondContact O-N 3.3Å; L244-T247 PolarHBondContact O-OG1 2.62Å; E245-T247 PolarHBondContact O-N 3.06Å; E245-T247 VanDerWaalsContact O-N 3.15Å; T247-L249 VanDerWaalsContact C-N 3.28Å
248	G	83.1	Confident	86.8	Confident	25 Å²	25	47.4 Å²	47.4	26%	0.258	26%	0.259	S	S	.	.	S	Bend	trans	82.3	1.9	-173.6	0	0	0	0	0	114.4	E245 S246	E245-G248 PolarHBondContact O-N 3.33Å; S246-G248 VanDerWaalsContact C-N 3.27Å; S246-G248 PolarHBondContact O-N 3.33Å
249	L	88.4	Confident	86.7	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	130.4	171.5	-65.2	171.1	0	0	0	110.2	V104 L106 L112 Y117 A120 I121 T247 F251	V104-L249 HydrophobicContact CG1-CB 4.33Å; V104-L249 HydrophobicContact CG1-CD2 4.02Å; L106-L249 HydrophobicContact CD2-CD2 3.96Å; L112-L249 HydrophobicContact CD2-CD2 3.78Å; Y117-L249 HydrophobicContact CD1-CD2 3.85Å; Y117-L249 HydrophobicContact CD1-CG 4.27Å; Y117-L249 HydrophobicContact CG-CD2 4.39Å; A120-L249 HydrophobicContact CB-CD1 4.45Å; I121-L249 HydrophobicContact CD1-CD2 4.49Å; I121-L249 HydrophobicContact CG1-CD1 4.22Å; T247-L249 VanDerWaalsContact C-N 3.28Å; L249-F251 HydrophobicContact CB-CE1 4.3Å; L249-F251 HydrophobicContact CB-CE2 3.75Å; L249-F251 HydrophobicContact CB-CZ 3.58Å; L249-F251 HydrophobicContact CD1-CE1 4.48Å; L249-F251 HydrophobicContact CD1-CZ 3.84Å; L249-F251 HydrophobicContact CG-CZ 4.37Å
250	Q	88.3	Confident	86.4	Confident	52 Å²	52	41.2 Å²	41.2	24%	0.243	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	125.9	168.6	-62.3	-168	-17.8	0	0	109.8	V104 A105 N107	V104-Q250 WeakPolarHBondContact CA-O 3.46Å; A105-Q250 PolarHBondContact N-O 3.17Å; A105-Q250 WeakPolarHBondContact O-CA 3.14Å; A105-Q250 WeakPolarHBondContact O-CB 3.35Å; A105-Q250 PolarHBondContact O-N 3.07Å; N107-Q250 WeakPolarHBondContact OD1-CG 3.4Å; N107-Q250 PolarHBondContact OD1-NE2 2.63Å
251	F	91.1	Very high	86	Confident	36 Å²	36	41.5 Å²	41.5	16%	0.158	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	112	175.5	-57.7	-79.3	0	0	0	109.6	V102 V104 I124 L241 L244 L249	V102-F251 HydrophobicContact CG1-CB 4.4Å; V102-F251 HydrophobicContact CG1-CD1 4.27Å; V104-F251 HydrophobicContact CB-CD1 4.46Å; V104-F251 HydrophobicContact CB-CE1 4.5Å; V104-F251 HydrophobicContact CG1-CD1 4.09Å; V104-F251 HydrophobicContact CG1-CE1 3.79Å; V104-F251 HydrophobicContact CG2-CD1 3.81Å; V104-F251 HydrophobicContact CG2-CE1 3.94Å; I124-F251 HydrophobicContact CD1-CE1 3.68Å; I124-F251 HydrophobicContact CD1-CZ 3.52Å; L241-F251 HydrophobicContact CB-CB 4.11Å; L241-F251 HydrophobicContact CB-CD2 4.35Å; L241-F251 HydrophobicContact CB-CG 4.21Å; L241-F251 HydrophobicContact CD1-CB 4.16Å; L241-F251 HydrophobicContact CD2-CB 4.29Å; L241-F251 HydrophobicContact CD2-CD1 3.72Å; L241-F251 HydrophobicContact CD2-CD2 4.43Å; L241-F251 HydrophobicContact CD2-CE1 4.15Å; L241-F251 HydrophobicContact CD2-CG 3.89Å; L241-F251 HydrophobicContact CG-CB 4.41Å; L241-F251 HydrophobicContact CG-CG 4.45Å; L244-F251 HydrophobicContact CB-CE2 3.86Å; L244-F251 HydrophobicContact CB-CZ 4.31Å; L249-F251 HydrophobicContact CB-CE1 4.3Å; L249-F251 HydrophobicContact CB-CE2 3.75Å; L249-F251 HydrophobicContact CB-CZ 3.58Å; L249-F251 HydrophobicContact CD1-CE1 4.48Å; L249-F251 HydrophobicContact CD1-CZ 3.84Å; L249-F251 HydrophobicContact CG-CZ 4.37Å
252	N	90.4	Very high	85.7	Confident	21 Å²	21	41.9 Å²	41.9	11%	0.112	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	112.6	177.2	-61.9	-75.4	0	0	0	108.8	V102 G103 R536 Y537 L540	V102-N252 CarbonylContact C-O 3.51Å; V102-N252 WeakPolarHBondContact CA-O 3.38Å; G103-N252 PolarHBondContact N-O 3.19Å; G103-N252 PolarHBondContact O-N 3.3Å; N252-R536 WeakPolarHBondContact OD1-CG 3.26Å; N252-Y537 HydrophobicContact CB-CD2 4.36Å; N252-Y537 WeakPolarHBondContact O-CD2 3.29Å; N252-L540 HydrophobicContact CB-CD1 4.39Å; N252-L540 VanDerWaalsContact ND2-CD1 3.34Å; N252-L540 WeakPolarHBondContact ND2-CD1 3.41Å
253	S	90.2	Very high	85.5	Confident	20 Å²	20	38.7 Å²	38.7	14%	0.14	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	145.1	-178.2	59.9	0	0	0	0	112.4	F101 L534	F101-S253 CarbonylContact O-C 3.57Å; F101-S253 VanDerWaalsContact O-CA 3.29Å; F101-S253 WeakPolarHBondContact O-CA 3.29Å; S253-L534 WeakPolarHBondContact O-CD1 3.49Å
254	F	89.2	Confident	85.2	Confident	7 Å²	7	36.7 Å²	36.7	3%	0.031	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	136.9	170.3	173.5	-79.4	0	0	0	110.4	F101 L259 L534 Y537 Y683	F101-F254 HydrophobicContact CB-CB 4.27Å; F101-F254 HydrophobicContact CB-CD1 4.45Å; F101-F254 AromaticContact CD2-CD1 3.75Å; F101-F254 HydrophobicContact CD2-CD1 3.75Å; F101-F254 HydrophobicContact CD2-CE1 4.3Å; F101-F254 HydrophobicContact CE2-CD1 4.47Å; F101-F254 HydrophobicContact CG-CD1 4.47Å; F101-F254 PolarHBondContact N-O 2.9Å; F101-F254 PolarHBondContact O-N 3.39Å; F254-L259 HydrophobicContact CE2-CD2 3.8Å; F254-L259 HydrophobicContact CZ-CD2 3.75Å; F254-L534 HydrophobicContact CB-CD1 3.81Å; F254-L534 HydrophobicContact CD2-CD1 3.45Å; F254-L534 VanDerWaalsContact CD2-CD1 3.45Å; F254-L534 HydrophobicContact CD2-CD2 4.18Å; F254-L534 HydrophobicContact CD2-CG 4.01Å; F254-L534 HydrophobicContact CE2-CD1 4.41Å; F254-L534 HydrophobicContact CE2-CD2 4.38Å; F254-L534 HydrophobicContact CG-CD1 4.02Å; F254-Y537 HydrophobicContact CB-CD1 3.37Å; F254-Y537 HydrophobicContact CB-CD2 3.9Å; F254-Y537 HydrophobicContact CB-CE1 3.17Å; F254-Y537 HydrophobicContact CB-CE2 3.71Å; F254-Y537 HydrophobicContact CB-CG 3.71Å; F254-Y537 HydrophobicContact CD1-CE1 4.06Å; F254-Y537 AromaticContact CD2-CD1 3.61Å; F254-Y537 HydrophobicContact CD2-CD1 3.61Å; F254-Y537 AromaticContact CD2-CE1 3.49Å; F254-Y537 HydrophobicContact CD2-CE1 3.49Å; F254-Y537 VanDerWaalsContact CD2-CE1 3.49Å; F254-Y537 HydrophobicContact CE2-CE1 4.4Å; F254-Y537 AromaticContact CG-CD1 3.73Å; F254-Y537 HydrophobicContact CG-CD1 3.73Å; F254-Y537 AromaticContact CG-CE1 3.31Å; F254-Y537 HydrophobicContact CG-CE1 3.31Å; F254-Y537 AromaticContact CG-CZ 3.81Å; F254-Y683 HydrophobicContact CE1-CE1 4.2Å; F254-Y683 VanDerWaalsContact CE1-OH 3.3Å; F254-Y683 WeakPolarHBondContact CE1-OH 3.46Å; F254-Y683 AromaticContact CZ-CE1 3.85Å; F254-Y683 HydrophobicContact CZ-CE1 3.85Å
255	S	87.1	Confident	85.1	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.007	21%	0.212	C	C	.	.			trans	-152.2	163.8	167.5	71.2	0	0	0	0	108.3	D257 I258 L259	S255-D257 VanDerWaalsContact C-N 3.25Å; S255-D257 PolarHBondContact O-N 2.87Å; S255-I258 PolarHBondContact O-N 3.4Å; S255-I258 WeakPolarHBondContact OG-CG1 3.08Å; S255-I258 PolarHBondContact OG-N 3.25Å; S255-L259 WeakPolarHBondContact O-CB 2.99Å; S255-L259 PolarHBondContact O-N 2.84Å
256	S	82.4	Confident	85.2	Confident	36 Å²	36	31.1 Å²	31.1	25%	0.252	18%	0.182	S	C	.	.	H	α-helix	trans	-60.5	-35.2	176.1	-56.6	0	0	0	0	112	L259 K260 E682	S256-L259 PolarHBondContact O-N 3.47Å; S256-K260 WeakPolarHBondContact O-CB 3.36Å; S256-K260 PolarHBondContact O-N 3Å; S256-E682 PolarHBondContact OG-OE1 3.3Å
257	D	82.3	Confident	85.5	Confident	28 Å²	28	26.3 Å²	26.3	15%	0.15	15%	0.15	C	C	.	.	H	α-helix	trans	-74	-35.6	176	-161.2	59.4	0	0	0	113.1	I230 S255 L259 K260 S261	I230-D257 HydrophobicContact CG2-CB 3.7Å; S255-D257 VanDerWaalsContact C-N 3.25Å; S255-D257 PolarHBondContact O-N 2.87Å; D257-L259 VanDerWaalsContact C-N 3.33Å; D257-K260 WeakPolarHBondContact O-CB 3.04Å; D257-K260 PolarHBondContact O-N 3.35Å; D257-S261 WeakPolarHBondContact O-CB 3.23Å; D257-S261 PolarHBondContact O-N 2.99Å; D257-S261 PolarHBondContact O-OG 3.27Å; D257-S261 VanDerWaalsContact O-OG 3.07Å
258	I	84.7	Confident	85.7	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-47.3	171.8	-69.4	169.5	0	0	0	109.5	F100 E234 R238 S255 K260 S261 E262 L534	F100-I258 HydrophobicContact CE2-CD1 3.61Å; F100-I258 HydrophobicContact CZ-CD1 3.65Å; E234-I258 HydrophobicContact CG-CD1 4.21Å; E234-I258 HydrophobicContact CG-CG1 4.2Å; E234-I258 WeakPolarHBondContact OE1-CG1 3.37Å; E234-I258 WeakPolarHBondContact OE2-CG1 3.34Å; R238-I258 VanDerWaalsContact NH2-CD1 3.31Å; R238-I258 VanDerWaalsContact NH2-CG1 3.26Å; R238-I258 VanDerWaalsContact NH2-CG2 3.29Å; S255-I258 PolarHBondContact O-N 3.4Å; S255-I258 WeakPolarHBondContact OG-CG1 3.08Å; S255-I258 PolarHBondContact OG-N 3.25Å; I258-K260 VanDerWaalsContact C-N 3.34Å; I258-K260 PolarHBondContact O-N 2.89Å; I258-S261 WeakPolarHBondContact CA-OG 3.1Å; I258-S261 PolarHBondContact O-N 2.9Å; I258-S261 PolarHBondContact O-OG 2.81Å; I258-E262 HydrophobicContact CG2-CG 4.07Å; I258-E262 VanDerWaalsContact O-CB 3.31Å; I258-E262 WeakPolarHBondContact O-CB 3.33Å; I258-E262 WeakPolarHBondContact O-CG 3.25Å; I258-E262 PolarHBondContact O-N 2.81Å; I258-L534 HydrophobicContact CG2-CD1 3.86Å; I258-L534 HydrophobicContact CG2-CD2 4.35Å
259	L	84.9	Confident	85.9	Confident	11 Å²	11	30.1 Å²	30.1	6%	0.058	16%	0.159	C	C	.	.	H	α-helix	trans	-60.8	-44.2	178.8	-179.4	52.1	0	0	0	111.6	M67 F254 S255 S256 D257 E262 I263 L528 L534	M67-L259 HydrophobicContact CE-CD1 3.71Å; M67-L259 HydrophobicContact CE-CD2 3.08Å; M67-L259 HydrophobicContact CE-CG 3.4Å; M67-L259 VanDerWaalsContact CE-CG 3.4Å; M67-L259 HydrophobicContact SD-CG 4.5Å; F254-L259 HydrophobicContact CE2-CD2 3.8Å; F254-L259 HydrophobicContact CZ-CD2 3.75Å; S255-L259 WeakPolarHBondContact O-CB 2.99Å; S255-L259 PolarHBondContact O-N 2.84Å; S256-L259 PolarHBondContact O-N 3.47Å; D257-L259 VanDerWaalsContact C-N 3.33Å; L259-E262 PolarHBondContact O-N 2.82Å; L259-I263 HydrophobicContact CD1-CD1 3.78Å; L259-I263 HydrophobicContact CD1-CG1 4.3Å; L259-I263 HydrophobicContact CG-CD1 4.11Å; L259-I263 WeakPolarHBondContact O-CB 3.19Å; L259-I263 WeakPolarHBondContact O-CD1 3.44Å; L259-I263 VanDerWaalsContact O-CG1 3.24Å; L259-I263 WeakPolarHBondContact O-CG1 3.39Å; L259-I263 PolarHBondContact O-N 3.29Å; L259-L528 HydrophobicContact CD1-CD2 3.81Å; L259-L534 HydrophobicContact CB-CD2 3.94Å; L259-L534 HydrophobicContact CD1-CD2 3.59Å; L259-L534 HydrophobicContact CG-CD2 4.32Å
260	K	84.3	Confident	85.8	Confident	75 Å²	75	30.1 Å²	30.1	33%	0.326	16%	0.16	S	C	.	.	H	α-helix	trans	-55.9	-50.9	172.5	-178.8	176.6	-175.8	172.8	0	112.6	D65 S256 D257 I258 I263 S264	D65-K260 HydrophobicContact CB-CD 4.26Å; D65-K260 HydrophobicContact CB-CG 3.53Å; S256-K260 WeakPolarHBondContact O-CB 3.36Å; S256-K260 PolarHBondContact O-N 3Å; D257-K260 WeakPolarHBondContact O-CB 3.04Å; D257-K260 PolarHBondContact O-N 3.35Å; I258-K260 VanDerWaalsContact C-N 3.34Å; I258-K260 PolarHBondContact O-N 2.89Å; K260-I263 PolarHBondContact O-N 3.14Å; K260-S264 PolarHBondContact O-N 3.46Å; K260-S264 PolarHBondContact O-OG 3.24Å
261	S	83.8	Confident	85.8	Confident	47 Å²	47	31.9 Å²	31.9	33%	0.329	17%	0.171	S	C	.	.	H	α-helix	trans	-68.9	-32.9	-179.1	60.1	0	0	0	0	113.5	D257 I258 S264 R265	D257-S261 WeakPolarHBondContact O-CB 3.23Å; D257-S261 PolarHBondContact O-N 2.99Å; D257-S261 PolarHBondContact O-OG 3.27Å; D257-S261 VanDerWaalsContact O-OG 3.07Å; I258-S261 WeakPolarHBondContact CA-OG 3.1Å; I258-S261 PolarHBondContact O-N 2.9Å; I258-S261 PolarHBondContact O-OG 2.81Å; S261-S264 PolarHBondContact O-OG 3.19Å; S261-S264 VanDerWaalsContact O-OG 3.09Å; S261-R265 PolarHBondContact O-N 3.2Å
262	E	83.7	Confident	85.8	Confident	20 Å²	20	34.3 Å²	34.3	9%	0.093	19%	0.19	C	C	.	.	H	α-helix	trans	-72.1	-33.9	176.1	-73.6	-67.2	152.2	0	0	112.5	I258 L259 R265 L528 S532	I258-E262 HydrophobicContact CG2-CG 4.07Å; I258-E262 VanDerWaalsContact O-CB 3.31Å; I258-E262 WeakPolarHBondContact O-CB 3.33Å; I258-E262 WeakPolarHBondContact O-CG 3.25Å; I258-E262 PolarHBondContact O-N 2.81Å; L259-E262 PolarHBondContact O-N 2.82Å; E262-R265 WeakPolarHBondContact O-CB 3.49Å; E262-R265 IonicContact OE2-CZ 3.14Å; E262-R265 IonicContact OE2-NE 2.79Å; E262-R265 PolarHBondContact OE2-NE 2.83Å; E262-R265 IonicContact OE2-NH2 2.9Å; E262-R265 PolarHBondContact OE2-NH2 3Å; E262-L528 HydrophobicContact CB-CD2 3.89Å; E262-S532 VanDerWaalsContact OE2-CB 3.27Å; E262-S532 WeakPolarHBondContact OE2-CB 3.42Å; E262-S532 PolarHBondContact OE2-OG 2.92Å
263	I	83.3	Confident	85.9	Confident	3 Å²	3	37 Å²	37	2%	0.015	20%	0.199	C	C	.	.	H	α-helix	trans	-71.8	-46.3	175.3	-71	167.6	0	0	0	110.8	M67 L259 K260 R265 T266 N329 L527 L528	M67-I263 HydrophobicContact CE-CD1 4.06Å; M67-I263 HydrophobicContact CG-CD1 3.42Å; M67-I263 VanDerWaalsContact CG-CD1 3.42Å; M67-I263 HydrophobicContact SD-CD1 3.24Å; M67-I263 WeakPolarHBondContact SD-CD1 3.39Å; L259-I263 HydrophobicContact CD1-CD1 3.78Å; L259-I263 HydrophobicContact CD1-CG1 4.3Å; L259-I263 HydrophobicContact CG-CD1 4.11Å; L259-I263 WeakPolarHBondContact O-CB 3.19Å; L259-I263 WeakPolarHBondContact O-CD1 3.44Å; L259-I263 VanDerWaalsContact O-CG1 3.24Å; L259-I263 WeakPolarHBondContact O-CG1 3.39Å; L259-I263 PolarHBondContact O-N 3.29Å; K260-I263 PolarHBondContact O-N 3.14Å; I263-R265 PolarHBondContact O-N 2.04Å; I263-R265 VanDerWaalsContact O-N 3.17Å; I263-T266 VanDerWaalsContact O-CB 3.27Å; I263-T266 WeakPolarHBondContact O-CB 3.42Å; I263-T266 PolarHBondContact O-N 2.91Å; I263-T266 PolarHBondContact O-OG1 2.79Å; I263-N329 HydrophobicContact CG2-CB 3.87Å; I263-L527 HydrophobicContact CD1-CB 4.32Å; I263-L527 HydrophobicContact CG1-CB 4.36Å; I263-L528 HydrophobicContact CG1-CD2 4.13Å
264	S	83.3	Confident	86	Confident	32 Å²	32	38.1 Å²	38.1	22%	0.224	20%	0.201	C	C	.	.	H	α-helix	trans	-63.1	-23.2	179	69.2	0	0	0	0	112.6	K260 S261 T266 A267 T268	K260-S264 PolarHBondContact O-N 3.46Å; K260-S264 PolarHBondContact O-OG 3.24Å; S261-S264 PolarHBondContact O-OG 3.19Å; S261-S264 VanDerWaalsContact O-OG 3.09Å; S264-T266 PolarHBondContact O-N 2.97Å; S264-A267 WeakPolarHBondContact O-CB 3.14Å; S264-A267 PolarHBondContact O-N 3.22Å; S264-T268 PolarHBondContact O-N 3.29Å
265	R	85.9	Confident	86.3	Confident	53 Å²	53	41.7 Å²	41.7	20%	0.2	23%	0.226	C	C	.	.	H	α-helix	trans	-59.7	-28.2	171.7	-161.2	173.7	53.2	149.6	-9.7	113	S261 E262 I263 A267 T268 Y269 V529 S532	S261-R265 PolarHBondContact O-N 3.2Å; E262-R265 WeakPolarHBondContact O-CB 3.49Å; E262-R265 IonicContact OE2-CZ 3.14Å; E262-R265 IonicContact OE2-NE 2.79Å; E262-R265 PolarHBondContact OE2-NE 2.83Å; E262-R265 IonicContact OE2-NH2 2.9Å; E262-R265 PolarHBondContact OE2-NH2 3Å; I263-R265 PolarHBondContact O-N 2.04Å; I263-R265 VanDerWaalsContact O-N 3.17Å; R265-A267 PolarHBondContact O-N 3.36Å; R265-T268 WeakPolarHBondContact CA-OG1 3.37Å; R265-T268 WeakPolarHBondContact CG-OG1 3.43Å; R265-T268 PolarHBondContact O-N 3.13Å; R265-T268 VanDerWaalsContact O-N 3.12Å; R265-T268 PolarHBondContact O-OG1 3.38Å; R265-Y269 HydrophobicContact CG-CD2 3.86Å; R265-Y269 HydrophobicContact CG-CE2 3.42Å; R265-Y269 VanDerWaalsContact CG-CE2 3.42Å; R265-Y269 PolarHBondContact NH1-OH 3.13Å; R265-Y269 WeakPolarHBondContact O-CD2 3.32Å; R265-Y269 PolarHBondContact O-N 2.98Å; R265-V529 HydrophobicContact CB-CG2 4.32Å; R265-S532 VanDerWaalsContact NH2-CA 3.31Å
266	T	83.2	Confident	86.6	Confident	4 Å²	4	44.5 Å²	44.5	3%	0.025	24%	0.243	C	C	.	.	H	α-helix	trans	-57.4	-41.1	172.3	-63	0	0	0	0	111	I263 S264 T268 Y269 A270 N329 S815	I263-T266 VanDerWaalsContact O-CB 3.27Å; I263-T266 WeakPolarHBondContact O-CB 3.42Å; I263-T266 PolarHBondContact O-N 2.91Å; I263-T266 PolarHBondContact O-OG1 2.79Å; S264-T266 PolarHBondContact O-N 2.97Å; T266-T268 VanDerWaalsContact C-N 3.34Å; T266-T268 PolarHBondContact O-N 3.16Å; T266-Y269 PolarHBondContact O-N 3.08Å; T266-A270 WeakPolarHBondContact O-CB 3.35Å; T266-A270 PolarHBondContact O-N 3.3Å; T266-N329 WeakPolarHBondContact CB-OD1 3.5Å; T266-N329 WeakPolarHBondContact CG2-OD1 3.33Å; T266-S815 WeakPolarHBondContact CG2-OG 3.4Å; T266-S815 PolarHBondContact OG1-OG 3.21Å
267	A	84.4	Confident	87.1	Confident	13 Å²	13	42.8 Å²	42.8	11%	0.107	23%	0.231	C	C	.	.	H	α-helix	trans	-65.5	-40	177.2	0	0	0	0	0	111.9	S264 R265 Y269 A270 L271 T332	S264-A267 WeakPolarHBondContact O-CB 3.14Å; S264-A267 PolarHBondContact O-N 3.22Å; R265-A267 PolarHBondContact O-N 3.36Å; A267-Y269 VanDerWaalsContact C-N 3.27Å; A267-Y269 PolarHBondContact O-N 3.08Å; A267-A270 PolarHBondContact O-N 3Å; A267-L271 WeakPolarHBondContact O-CG 3.38Å; A267-L271 PolarHBondContact O-N 3.01Å; A267-T332 HydrophobicContact CB-CG2 4.07Å; A267-T332 WeakPolarHBondContact CB-OG1 3.48Å
268	T	86	Confident	87.7	Confident	89 Å²	89	42.9 Å²	42.9	55%	0.546	23%	0.232	S	C	.	.	H	α-helix	trans	-64.2	-31.5	176.7	68.8	0	0	0	0	113.1	S264 R265 T266 P272	S264-T268 PolarHBondContact O-N 3.29Å; R265-T268 WeakPolarHBondContact CA-OG1 3.37Å; R265-T268 WeakPolarHBondContact CG-OG1 3.43Å; R265-T268 PolarHBondContact O-N 3.13Å; R265-T268 VanDerWaalsContact O-N 3.12Å; R265-T268 PolarHBondContact O-OG1 3.38Å; T266-T268 VanDerWaalsContact C-N 3.34Å; T266-T268 PolarHBondContact O-N 3.16Å; T268-P272 WeakPolarHBondContact O-CD 3.46Å; T268-P272 WeakPolarHBondContact O-CG 3.31Å
269	Y	86.2	Confident	88.1	Confident	81 Å²	81	45.5 Å²	45.5	32%	0.318	25%	0.254	S	S	.	.	H	α-helix	trans	-80	-38.4	174.3	-73.8	-59.8	0	0	0	112.4	R265 T266 A267 P272 Y273 V529	R265-Y269 HydrophobicContact CG-CD2 3.86Å; R265-Y269 HydrophobicContact CG-CE2 3.42Å; R265-Y269 VanDerWaalsContact CG-CE2 3.42Å; R265-Y269 PolarHBondContact NH1-OH 3.13Å; R265-Y269 WeakPolarHBondContact O-CD2 3.32Å; R265-Y269 PolarHBondContact O-N 2.98Å; T266-Y269 PolarHBondContact O-N 3.08Å; A267-Y269 VanDerWaalsContact C-N 3.27Å; A267-Y269 PolarHBondContact O-N 3.08Å; Y269-P272 WeakPolarHBondContact O-CD 3.43Å; Y269-Y273 WeakPolarHBondContact O-CD2 3.31Å; Y269-Y273 WeakPolarHBondContact O-CE2 3.39Å; Y269-V529 HydrophobicContact CD2-CG1 4.01Å; Y269-V529 HydrophobicContact CD2-CG2 4.12Å; Y269-V529 HydrophobicContact CE2-CG1 3.76Å; Y269-V529 HydrophobicContact CE2-CG2 4.26Å
270	A	88.2	Confident	88.6	Confident	2 Å²	2	47.7 Å²	47.7	2%	0.017	27%	0.265	C	S	.	.	H	α-helix	trans	-74.6	-44.6	-174.9	0	0	0	0	0	113.4	T266 A267 Y273 T332 F336 V813	T266-A270 WeakPolarHBondContact O-CB 3.35Å; T266-A270 PolarHBondContact O-N 3.3Å; A267-A270 PolarHBondContact O-N 3Å; A270-Y273 PolarHBondContact O-N 3.38Å; A270-T332 HydrophobicContact CB-CG2 3.84Å; A270-F336 WeakPolarHBondContact O-CZ 3.45Å; A270-V813 HydrophobicContact CB-CG1 4.36Å; A270-V813 HydrophobicContact CB-CG2 4.2Å
271	L	87.9	Confident	89	Confident	90 Å²	90	44.1 Å²	44.1	47%	0.471	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-55.9	-42.3	-174.3	-71.9	171.2	0	0	0	114.1	A267 Y273 F274 T332	A267-L271 WeakPolarHBondContact O-CG 3.38Å; A267-L271 PolarHBondContact O-N 3.01Å; L271-Y273 PolarHBondContact O-N 2.76Å; L271-F274 WeakPolarHBondContact O-CB 3.37Å; L271-F274 PolarHBondContact O-N 2.8Å; L271-F274 VanDerWaalsContact O-N 3.11Å; L271-T332 HydrophobicContact CD2-CG2 4.03Å; L271-T332 HydrophobicContact CG-CG2 3.99Å
272	P	91.1	Very high	89.4	Confident	87 Å²	87	43.8 Å²	43.8	57%	0.565	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-63.3	-18.9	176	-24.6	35.4	0	0	0	115.3	T268 Y269 P275	T268-P272 WeakPolarHBondContact O-CD 3.46Å; T268-P272 WeakPolarHBondContact O-CG 3.31Å; Y269-P272 WeakPolarHBondContact O-CD 3.43Å; P272-P275 WeakPolarHBondContact O-CD 3.36Å
273	Y	92.2	Very high	89.7	Confident	77 Å²	77	45.6 Å²	45.6	30%	0.302	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-86	-10.1	176	-70.7	-74.2	0	0	0	113.2	Y269 A270 L271 V276 S277 F812 V813	Y269-Y273 WeakPolarHBondContact O-CD2 3.31Å; Y269-Y273 WeakPolarHBondContact O-CE2 3.39Å; A270-Y273 PolarHBondContact O-N 3.38Å; L271-Y273 PolarHBondContact O-N 2.76Å; Y273-V276 HydrophobicContact CD1-CG2 4.34Å; Y273-V276 WeakPolarHBondContact O-CA 3.46Å; Y273-V276 VanDerWaalsContact O-CB 3.28Å; Y273-V276 WeakPolarHBondContact O-CB 3.37Å; Y273-V276 PolarHBondContact O-N 3.05Å; Y273-S277 PolarHBondContact O-N 3.35Å; Y273-S277 VanDerWaalsContact O-N 3.12Å; Y273-F812 HydrophobicContact CD1-CB 4.22Å; Y273-F812 HydrophobicContact CE1-CB 3.61Å; Y273-F812 HydrophobicContact CE1-CG 4.31Å; Y273-F812 HydrophobicContact CE2-CB 4.36Å; Y273-V813 HydrophobicContact CD2-CG2 3.66Å; Y273-V813 HydrophobicContact CE2-CG2 4.14Å; Y273-V813 HydrophobicContact CG-CG2 4.44Å
274	F	92.8	Very high	90	Very high	43 Å²	43	46.2 Å²	46.2	19%	0.189	27%	0.268	C	S	.	.	H	α-helix	trans	-61.8	-42.6	177.1	-174.7	-104.9	0	0	0	113.3	L271 V276 S277 V278 L310 I313 P335 F336 L339	L271-F274 WeakPolarHBondContact O-CB 3.37Å; L271-F274 PolarHBondContact O-N 2.8Å; L271-F274 VanDerWaalsContact O-N 3.11Å; F274-V276 PolarHBondContact O-N 3.06Å; F274-S277 PolarHBondContact O-N 3.45Å; F274-S277 PolarHBondContact O-OG 3.4Å; F274-V278 HydrophobicContact CD1-CG2 4.41Å; F274-V278 HydrophobicContact CE1-CG2 4.06Å; F274-V278 HydrophobicContact CZ-CG2 4.24Å; F274-V278 WeakPolarHBondContact O-CG2 3.37Å; F274-V278 PolarHBondContact O-N 2.92Å; F274-V278 VanDerWaalsContact O-N 3.11Å; F274-L310 HydrophobicContact CE1-CD2 3.89Å; F274-L310 HydrophobicContact CZ-CD2 3.79Å; F274-I313 HydrophobicContact CZ-CD1 4.37Å; F274-P335 HydrophobicContact CD2-CB 3.96Å; F274-P335 HydrophobicContact CE2-CB 3.5Å; F274-P335 HydrophobicContact CZ-CB 4.02Å; F274-F336 HydrophobicContact CB-CE1 3.99Å; F274-F336 HydrophobicContact CB-CE2 4.21Å; F274-F336 HydrophobicContact CB-CZ 3.59Å; F274-F336 HydrophobicContact CD2-CD1 4.08Å; F274-F336 HydrophobicContact CD2-CD2 4.19Å; F274-F336 AromaticContact CD2-CE1 3.95Å; F274-F336 HydrophobicContact CD2-CE1 3.95Å; F274-F336 HydrophobicContact CD2-CE2 4.07Å; F274-F336 HydrophobicContact CD2-CG 4.2Å; F274-F336 AromaticContact CD2-CZ 3.95Å; F274-F336 HydrophobicContact CD2-CZ 3.95Å; F274-F336 HydrophobicContact CG-CE1 4.49Å; F274-F336 HydrophobicContact CG-CZ 4.29Å; F274-L339 HydrophobicContact CE2-CD2 3.98Å; F274-L339 HydrophobicContact CZ-CD2 4.17Å
275	P	94.2	Very high	90.3	Very high	83 Å²	83	44.8 Å²	44.8	54%	0.539	26%	0.257	S	S	.	.	H	α-helix	trans	-60.1	-28.5	170.7	-25.4	35.5	0	0	0	113.9	P272 V278 A279	P272-P275 WeakPolarHBondContact O-CD 3.36Å; P275-V278 PolarHBondContact O-N 3.15Å; P275-A279 WeakPolarHBondContact O-CB 3.4Å; P275-A279 PolarHBondContact O-N 3.06Å
276	V	93.9	Very high	90.4	Very high	60 Å²	60	45.8 Å²	45.8	36%	0.364	27%	0.266	S	S	.	.	H	α-helix	trans	-69.5	-41.9	176.4	-177.6	0	0	0	0	110.5	Y273 F274 V278 A279 L280	Y273-V276 HydrophobicContact CD1-CG2 4.34Å; Y273-V276 WeakPolarHBondContact O-CA 3.46Å; Y273-V276 VanDerWaalsContact O-CB 3.28Å; Y273-V276 WeakPolarHBondContact O-CB 3.37Å; Y273-V276 PolarHBondContact O-N 3.05Å; F274-V276 PolarHBondContact O-N 3.06Å; V276-V278 VanDerWaalsContact C-N 3.35Å; V276-A279 PolarHBondContact O-N 3.34Å; V276-L280 HydrophobicContact CG1-CD1 4.3Å; V276-L280 HydrophobicContact CG1-CG 4.49Å; V276-L280 WeakPolarHBondContact O-CG 3.37Å; V276-L280 PolarHBondContact O-N 3.04Å
277	S	92.6	Very high	90.5	Very high	0 Å²	0	50 Å²	50	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.8	-44	173.9	66.2	0	0	0	0	111.3	Y273 F274 A279 L280 L281 A806	Y273-S277 PolarHBondContact O-N 3.35Å; Y273-S277 VanDerWaalsContact O-N 3.12Å; F274-S277 PolarHBondContact O-N 3.45Å; F274-S277 PolarHBondContact O-OG 3.4Å; S277-A279 VanDerWaalsContact C-N 3.32Å; S277-A279 PolarHBondContact O-N 3.4Å; S277-L280 PolarHBondContact O-N 2.94Å; S277-L281 WeakPolarHBondContact O-CG 3.34Å; S277-L281 PolarHBondContact O-N 3.16Å; S277-A806 WeakPolarHBondContact CB-O 3.5Å
278	V	94.7	Very high	90.3	Very high	29 Å²	29	50.4 Å²	50.4	18%	0.176	30%	0.297	C	S	.	.	H	α-helix	trans	-59.1	-41.8	174.8	175.8	0	0	0	0	111.5	F274 P275 V276 T282 L306 L310 L339	F274-V278 HydrophobicContact CD1-CG2 4.41Å; F274-V278 HydrophobicContact CE1-CG2 4.06Å; F274-V278 HydrophobicContact CZ-CG2 4.24Å; F274-V278 WeakPolarHBondContact O-CG2 3.37Å; F274-V278 PolarHBondContact O-N 2.92Å; F274-V278 VanDerWaalsContact O-N 3.11Å; P275-V278 PolarHBondContact O-N 3.15Å; V276-V278 VanDerWaalsContact C-N 3.35Å; V278-T282 VanDerWaalsContact O-CB 3.28Å; V278-T282 WeakPolarHBondContact O-CB 3.45Å; V278-T282 PolarHBondContact O-N 3.26Å; V278-T282 PolarHBondContact O-OG1 2.95Å; V278-L306 HydrophobicContact CG1-CD2 4.12Å; V278-L310 HydrophobicContact CG1-CD1 4.45Å; V278-L310 HydrophobicContact CG2-CD2 4.12Å; V278-L339 HydrophobicContact CG2-CD2 3.93Å
279	A	94.6	Very high	90.1	Very high	57 Å²	57	46.4 Å²	46.4	47%	0.471	27%	0.272	S	S	.	.	H	α-helix	trans	-66.6	-41.2	177.5	0	0	0	0	0	112.6	P275 V276 S277 T282 A283	P275-A279 WeakPolarHBondContact O-CB 3.4Å; P275-A279 PolarHBondContact O-N 3.06Å; V276-A279 PolarHBondContact O-N 3.34Å; S277-A279 VanDerWaalsContact C-N 3.32Å; S277-A279 PolarHBondContact O-N 3.4Å; A279-T282 WeakPolarHBondContact O-CB 3.29Å; A279-T282 PolarHBondContact O-N 3.39Å; A279-A283 WeakPolarHBondContact O-CB 3.36Å; A279-A283 PolarHBondContact O-N 3.46Å
280	L	93.6	Very high	89.8	Confident	57 Å²	57	48.4 Å²	48.4	30%	0.298	28%	0.28	S	S	.	.	H	α-helix	trans	-64.1	-43.7	175.9	-71.1	172.8	0	0	0	111.7	V276 S277 A283 L284 L808	V276-L280 HydrophobicContact CG1-CD1 4.3Å; V276-L280 HydrophobicContact CG1-CG 4.49Å; V276-L280 WeakPolarHBondContact O-CG 3.37Å; V276-L280 PolarHBondContact O-N 3.04Å; S277-L280 PolarHBondContact O-N 2.94Å; L280-A283 PolarHBondContact O-N 3.25Å; L280-L284 PolarHBondContact O-N 3.08Å; L280-L808 HydrophobicContact CD1-CB 4.48Å; L280-L808 HydrophobicContact CD1-CD2 4.32Å
281	L	92.8	Very high	89	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.8	-40.5	175.6	-69.1	-178	0	0	0	112.1	S277 A283 L284 L285 L306 L339 V343 C802 L805 A806	S277-L281 WeakPolarHBondContact O-CG 3.34Å; S277-L281 PolarHBondContact O-N 3.16Å; L281-A283 VanDerWaalsContact C-N 3.3Å; L281-A283 PolarHBondContact O-N 2.61Å; L281-L284 PolarHBondContact O-N 2.98Å; L281-L285 WeakPolarHBondContact O-CB 3.21Å; L281-L285 VanDerWaalsContact O-CG 3.26Å; L281-L285 WeakPolarHBondContact O-CG 3.36Å; L281-L285 PolarHBondContact O-N 2.94Å; L281-L306 HydrophobicContact CB-CD1 4.3Å; L281-L306 HydrophobicContact CD1-CD1 4.12Å; L281-L339 HydrophobicContact CD1-CD2 3.59Å; L281-L339 HydrophobicContact CD1-CG 3.62Å; L281-V343 HydrophobicContact CD1-CG2 4.48Å; L281-C802 HydrophobicContact CD2-CB 4.38Å; L281-C802 WeakPolarHBondContact CD2-O 3.31Å; L281-C802 WeakPolarHBondContact CD2-SG 3.34Å; L281-L805 HydrophobicContact CD2-CB 4.23Å; L281-A806 HydrophobicContact CD1-CB 4.02Å; L281-A806 HydrophobicContact CD2-CB 4.21Å; L281-A806 HydrophobicContact CG-CB 4.38Å
282	T	92.3	Very high	88.1	Confident	40 Å²	40	49 Å²	49	25%	0.245	30%	0.297	C	S	.	.	H	α-helix	trans	-57.1	-46.3	172.9	-63.8	0	0	0	0	110.6	V278 A279 L285 L286 L303 L306	V278-T282 VanDerWaalsContact O-CB 3.28Å; V278-T282 WeakPolarHBondContact O-CB 3.45Å; V278-T282 PolarHBondContact O-N 3.26Å; V278-T282 PolarHBondContact O-OG1 2.95Å; A279-T282 WeakPolarHBondContact O-CB 3.29Å; A279-T282 PolarHBondContact O-N 3.39Å; T282-L285 PolarHBondContact O-N 3.33Å; T282-L286 HydrophobicContact CG2-CD1 4.08Å; T282-L286 WeakPolarHBondContact O-CB 3.39Å; T282-L286 VanDerWaalsContact O-CG 3.25Å; T282-L286 WeakPolarHBondContact O-CG 3.37Å; T282-L286 PolarHBondContact O-N 3.49Å; T282-L303 HydrophobicContact CG2-CD2 3.77Å; T282-L306 WeakPolarHBondContact OG1-CD2 3.46Å
283	A	91.3	Very high	87.2	Confident	58 Å²	58	47.9 Å²	47.9	48%	0.479	29%	0.286	S	S	.	.	H	α-helix	trans	-63.4	-41.7	177.4	0	0	0	0	0	112.2	A279 L280 L281 S287	A279-A283 WeakPolarHBondContact O-CB 3.36Å; A279-A283 PolarHBondContact O-N 3.46Å; L280-A283 PolarHBondContact O-N 3.25Å; L281-A283 VanDerWaalsContact C-N 3.3Å; L281-A283 PolarHBondContact O-N 2.61Å; A283-S287 VanDerWaalsContact O-CB 3.28Å; A283-S287 WeakPolarHBondContact O-CB 3.43Å; A283-S287 PolarHBondContact O-N 2.85Å
284	L	89.8	Confident	86.3	Confident	16 Å²	16	44.6 Å²	44.6	8%	0.084	27%	0.274	C	S	.	.	H	α-helix	trans	-61.3	-51.7	174.9	-177.9	72.2	0	0	0	111.3	L280 L281 L286 S287 V288 F347 M801 C802 L805	L280-L284 PolarHBondContact O-N 3.08Å; L281-L284 PolarHBondContact O-N 2.98Å; L284-L286 VanDerWaalsContact C-N 3.31Å; L284-L286 PolarHBondContact O-N 3.04Å; L284-S287 PolarHBondContact O-N 3.42Å; L284-S287 VanDerWaalsContact O-N 3.08Å; L284-V288 HydrophobicContact CD1-CG2 3.72Å; L284-V288 HydrophobicContact CG-CG2 4.1Å; L284-V288 WeakPolarHBondContact O-CB 3.4Å; L284-V288 VanDerWaalsContact O-CG2 3.3Å; L284-V288 WeakPolarHBondContact O-CG2 3.27Å; L284-V288 PolarHBondContact O-N 3.23Å; L284-F347 HydrophobicContact CD2-CZ 4.3Å; L284-M801 HydrophobicContact CD1-CE 4.19Å; L284-C802 HydrophobicContact CD2-CB 3.93Å; L284-L805 HydrophobicContact CB-CD1 3.95Å; L284-L805 HydrophobicContact CD1-CD1 3.82Å; L284-L805 HydrophobicContact CD2-CD1 3.92Å; L284-L805 HydrophobicContact CG-CD1 4.1Å
285	L	89.2	Confident	85.4	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-58.2	-44.2	-179.5	-73	165.2	0	0	0	111.4	L281 T282 L289 L306 V343 F347	L281-L285 WeakPolarHBondContact O-CB 3.21Å; L281-L285 VanDerWaalsContact O-CG 3.26Å; L281-L285 WeakPolarHBondContact O-CG 3.36Å; L281-L285 PolarHBondContact O-N 2.94Å; T282-L285 PolarHBondContact O-N 3.33Å; L285-L289 HydrophobicContact CB-CD1 4.41Å; L285-L289 HydrophobicContact CD2-CD1 3.86Å; L285-L289 VanDerWaalsContact O-CB 3.23Å; L285-L289 WeakPolarHBondContact O-CB 3.27Å; L285-L289 WeakPolarHBondContact O-CG 3.14Å; L285-L289 PolarHBondContact O-N 3.41Å; L285-L306 HydrophobicContact CD1-CB 3.82Å; L285-L306 HydrophobicContact CD1-CD2 4.14Å; L285-L306 HydrophobicContact CD1-CG 4.46Å; L285-V343 HydrophobicContact CD1-CG1 4.4Å; L285-V343 HydrophobicContact CD2-CG1 4.2Å; L285-F347 HydrophobicContact CD2-CE1 3.83Å; L285-F347 HydrophobicContact CD2-CE2 4.03Å; L285-F347 HydrophobicContact CD2-CZ 3.4Å; L285-F347 HydrophobicContact CG-CZ 4.28Å
286	L	87.9	Confident	84.5	Confident	74 Å²	74	41.7 Å²	41.7	39%	0.387	26%	0.259	S	S	.	.	H	α-helix	trans	-65	-39.3	175.6	-71.4	176.7	0	0	0	112.3	T282 L284 Y290 P299 L303	T282-L286 HydrophobicContact CG2-CD1 4.08Å; T282-L286 WeakPolarHBondContact O-CB 3.39Å; T282-L286 VanDerWaalsContact O-CG 3.25Å; T282-L286 WeakPolarHBondContact O-CG 3.37Å; T282-L286 PolarHBondContact O-N 3.49Å; L284-L286 VanDerWaalsContact C-N 3.31Å; L284-L286 PolarHBondContact O-N 3.04Å; L286-Y290 WeakPolarHBondContact O-CB 3.2Å; L286-P299 HydrophobicContact CD2-CB 3.8Å; L286-L303 HydrophobicContact CD2-CD1 4.14Å; L286-L303 HydrophobicContact CD2-CG 4.47Å
287	S	84.2	Confident	84	Confident	93 Å²	93	38.9 Å²	38.9	65%	0.65	24%	0.241	S	C	*	.	H	α-helix	trans	-71.5	-38.6	-179.8	-176.1	0	0	0	0	112.8	A283 L284	A283-S287 VanDerWaalsContact O-CB 3.28Å; A283-S287 WeakPolarHBondContact O-CB 3.43Å; A283-S287 PolarHBondContact O-N 2.85Å; L284-S287 PolarHBondContact O-N 3.42Å; L284-S287 VanDerWaalsContact O-N 3.08Å
288	V	81.9	Confident	83.7	Confident	21 Å²	21	39 Å²	39	13%	0.127	24%	0.242	C	C	.	.	H	α-helix	trans	-87.3	-40.4	-171.2	171.9	0	0	0	0	111.3	L284 Y290 F347 N477 E798	L284-V288 HydrophobicContact CD1-CG2 3.72Å; L284-V288 HydrophobicContact CG-CG2 4.1Å; L284-V288 WeakPolarHBondContact O-CB 3.4Å; L284-V288 VanDerWaalsContact O-CG2 3.3Å; L284-V288 WeakPolarHBondContact O-CG2 3.27Å; L284-V288 PolarHBondContact O-N 3.23Å; V288-Y290 VanDerWaalsContact C-N 3.29Å; V288-Y290 PolarHBondContact O-N 3.45Å; V288-F347 HydrophobicContact CG1-CE1 4.09Å; V288-N477 PolarHBondContact O-ND2 2.91Å; V288-E798 VanDerWaalsContact CG1-CD 3.43Å; V288-E798 HydrophobicContact CG1-CG 3.9Å; V288-E798 WeakPolarHBondContact CG1-OE1 3.37Å
289	L	81.5	Confident	83.2	Confident	6 Å²	6	37.8 Å²	37.8	3%	0.031	24%	0.235	C	C	.	.	S	Bend	trans	-86	-2.3	-176	-58.1	172.4	0	0	0	113.5	L285 T291 K298 G302 F347 L350	L285-L289 HydrophobicContact CB-CD1 4.41Å; L285-L289 HydrophobicContact CD2-CD1 3.86Å; L285-L289 VanDerWaalsContact O-CB 3.23Å; L285-L289 WeakPolarHBondContact O-CB 3.27Å; L285-L289 WeakPolarHBondContact O-CG 3.14Å; L285-L289 PolarHBondContact O-N 3.41Å; L289-T291 PolarHBondContact O-N 3.27Å; L289-K298 PolarHBondContact O-N 3.48Å; L289-K298 VanDerWaalsContact O-N 3.08Å; L289-G302 VanDerWaalsContact CD1-CA 3.46Å; L289-F347 HydrophobicContact CD2-CD1 4.3Å; L289-F347 HydrophobicContact CD2-CE1 4.23Å; L289-F347 HydrophobicContact CG-CE1 4.37Å; L289-L350 HydrophobicContact CD1-CD1 3.95Å; L289-L350 HydrophobicContact CD2-CD1 4.05Å
290	Y	79	Confident	83	Confident	123 Å²	123	36.8 Å²	36.8	48%	0.482	22%	0.222	S	C	.	.			trans	-85.6	99.7	173.1	-166.1	-91.7	0	0	0	110.8	L286 V288	L286-Y290 WeakPolarHBondContact O-CB 3.2Å; V288-Y290 VanDerWaalsContact C-N 3.29Å; V288-Y290 PolarHBondContact O-N 3.45Å
291	T	71.8	Confident	82.9	Confident	9 Å²	9	34.2 Å²	34.2	6%	0.055	21%	0.209	C	C	.	.			trans	-89.5	168.3	176.8	58.4	0	0	0	0	111.7	L289 D293 T296 S297	L289-T291 PolarHBondContact O-N 3.27Å; T291-D293 PolarHBondContact O-N 3.14Å; T291-D293 PolarHBondContact OG1-O 3Å; T291-T296 PolarHBondContact OG1-OG1 3.29Å; T291-S297 PolarHBondContact N-OG 3.34Å; T291-S297 PolarHBondContact O-OG 3.35Å; T291-S297 VanDerWaalsContact OG1-CA 3.3Å; T291-S297 WeakPolarHBondContact OG1-CA 3.39Å; T291-S297 PolarHBondContact OG1-N 2.91Å; T291-S297 PolarHBondContact OG1-OG 2.86Å
292	A	68.3	Low	82.8	Confident	94 Å²	94	34.2 Å²	34.2	78%	0.777	21%	0.209	S	C	*	.	S	Bend	trans	-61.1	-25.2	178.9	0	0	0	0	0	114.1	P294	A292-P294 WeakPolarHBondContact O-CD 3.3Å
293	D	73	Confident	82.8	Confident	65 Å²	65	35.1 Å²	35.1	35%	0.348	21%	0.212	S	C	.	.	S	Bend	trans	-101.5	110	177.1	-94.2	-28.4	0	0	0	111	T291 V295 T296 S297	T291-D293 PolarHBondContact O-N 3.14Å; T291-D293 PolarHBondContact OG1-O 3Å; D293-V295 PolarHBondContact O-N 3.46Å; D293-T296 HydrophobicContact CB-CG2 4.24Å; D293-T296 VanDerWaalsContact CB-OG1 3.3Å; D293-T296 WeakPolarHBondContact CB-OG1 3.11Å; D293-T296 PolarHBondContact O-N 3.27Å; D293-T296 PolarHBondContact O-OG1 3.05Å; D293-T296 VanDerWaalsContact O-OG1 3.05Å; D293-S297 PolarHBondContact O-N 3.36Å; D293-S297 PolarHBondContact O-OG 2.86Å
294	P	72.7	Confident	82.9	Confident	7 Å²	7	35.1 Å²	35.1	5%	0.045	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-11	-177.1	-24.7	35.6	0	0	0	115.2	A292 H437 C438	A292-P294 WeakPolarHBondContact O-CD 3.3Å; P294-H437 WeakPolarHBondContact CB-NE2 3.47Å; P294-C438 WeakPolarHBondContact O-CB 3.31Å; P294-C438 PolarHBondContact O-N 3.4Å; P294-C438 PolarHBondContact O-SG 3.36Å
295	V	74.8	Confident	83.1	Confident	33 Å²	33	34.3 Å²	34.3	20%	0.2	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-40	174.2	-178.8	0	0	0	0	110.1	D293 R431	D293-V295 PolarHBondContact O-N 3.46Å; V295-R431 PolarHBondContact O-NH1 3.09Å
296	T	75.5	Confident	83.4	Confident	33 Å²	33	34.6 Å²	34.6	20%	0.202	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-18.6	-178.1	63.7	0	0	0	0	112.9	T291 D293 K298	T291-T296 PolarHBondContact OG1-OG1 3.29Å; D293-T296 HydrophobicContact CB-CG2 4.24Å; D293-T296 VanDerWaalsContact CB-OG1 3.3Å; D293-T296 WeakPolarHBondContact CB-OG1 3.11Å; D293-T296 PolarHBondContact O-N 3.27Å; D293-T296 PolarHBondContact O-OG1 3.05Å; D293-T296 VanDerWaalsContact O-OG1 3.05Å; T296-K298 WeakPolarHBondContact O-CG 3.41Å
297	S	82.2	Confident	83.7	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.194	C	C	.	.			trans	-59.1	142.3	174.2	-46.2	0	0	0	0	111.2	T291 D293 R431	T291-S297 PolarHBondContact N-OG 3.34Å; T291-S297 PolarHBondContact O-OG 3.35Å; T291-S297 VanDerWaalsContact OG1-CA 3.3Å; T291-S297 WeakPolarHBondContact OG1-CA 3.39Å; T291-S297 PolarHBondContact OG1-N 2.91Å; T291-S297 PolarHBondContact OG1-OG 2.86Å; D293-S297 PolarHBondContact O-N 3.36Å; D293-S297 PolarHBondContact O-OG 2.86Å; S297-R431 PolarHBondContact O-NH2 3.03Å
298	K	85.7	Confident	84.3	Confident	4 Å²	4	28.1 Å²	28.1	2%	0.017	16%	0.163	C	C	.	.			trans	-124.5	40.7	-175.9	-65.8	-174	-176.2	-78.7	0	115.1	L289 T296 V300 E301 G302 L350 E432	L289-K298 PolarHBondContact O-N 3.48Å; L289-K298 VanDerWaalsContact O-N 3.08Å; T296-K298 WeakPolarHBondContact O-CG 3.41Å; K298-V300 VanDerWaalsContact C-N 3.33Å; K298-V300 PolarHBondContact O-N 2.8Å; K298-E301 VanDerWaalsContact C-OE2 3.3Å; K298-E301 WeakPolarHBondContact CA-OE2 3.33Å; K298-E301 HydrophobicContact CB-CB 4.19Å; K298-E301 HydrophobicContact CB-CG 4.43Å; K298-E301 PolarHBondContact O-N 3.21Å; K298-G302 PolarHBondContact O-N 3.43Å; K298-L350 HydrophobicContact CD-CD2 3.94Å; K298-E432 IonicContact NZ-OE2 3.49Å; K298-E432 PolarHBondContact NZ-OE2 2.88Å
299	P	86.2	Confident	84.9	Confident	3 Å²	3	27.1 Å²	27.1	2%	0.019	16%	0.157	C	C	.	.	H	α-helix	trans	-65	-38	-179.1	27.3	-34.3	0	0	0	111.9	L286 G302 L303 C438 L439	L286-P299 HydrophobicContact CD2-CB 3.8Å; P299-G302 PolarHBondContact O-N 3.32Å; P299-L303 VanDerWaalsContact O-CG 3.31Å; P299-L303 WeakPolarHBondContact O-CG 3.47Å; P299-L303 PolarHBondContact O-N 3.38Å; P299-C438 HydrophobicContact CG-CB 4.32Å; P299-L439 HydrophobicContact CG-CD2 4.39Å
300	V	89	Confident	85.6	Confident	35 Å²	35	29.9 Å²	29.9	21%	0.212	17%	0.171	C	C	.	.	H	α-helix	trans	-66.1	-44.8	-179.2	178.3	0	0	0	0	110.1	K298 G302 L303 M304 C438 L439	K298-V300 VanDerWaalsContact C-N 3.33Å; K298-V300 PolarHBondContact O-N 2.8Å; V300-G302 VanDerWaalsContact C-N 3.34Å; V300-G302 PolarHBondContact O-N 3.37Å; V300-L303 PolarHBondContact O-N 2.8Å; V300-M304 HydrophobicContact CG1-CG 4.43Å; V300-M304 VanDerWaalsContact O-CG 3.25Å; V300-M304 WeakPolarHBondContact O-CG 3.48Å; V300-M304 PolarHBondContact O-N 2.88Å; V300-C438 WeakPolarHBondContact CG2-O 3.48Å; V300-L439 HydrophobicContact CG2-CD2 4.35Å
301	E	91.5	Very high	86.4	Confident	3 Å²	3	25.8 Å²	25.8	1%	0.014	16%	0.157	C	C	.	.	H	α-helix	trans	-60.1	-45	177	-60.7	85.4	155.9	0	0	110.5	K298 L303 M304 G305 L350 F421 G428 R431	K298-E301 VanDerWaalsContact C-OE2 3.3Å; K298-E301 WeakPolarHBondContact CA-OE2 3.33Å; K298-E301 HydrophobicContact CB-CB 4.19Å; K298-E301 HydrophobicContact CB-CG 4.43Å; K298-E301 PolarHBondContact O-N 3.21Å; E301-L303 PolarHBondContact O-N 2.61Å; E301-M304 PolarHBondContact O-N 2.65Å; E301-G305 PolarHBondContact O-N 3.15Å; E301-L350 HydrophobicContact CB-CD2 4.09Å; E301-F421 WeakPolarHBondContact O-CE2 3.48Å; E301-G428 VanDerWaalsContact OE1-CA 3.3Å; E301-G428 WeakPolarHBondContact OE1-CA 3.38Å; E301-R431 IonicContact OE1-CZ 3.54Å; E301-R431 IonicContact OE1-NE 3.19Å; E301-R431 IonicContact OE1-NH2 3.82Å; E301-R431 PolarHBondContact OE1-NH2 3.46Å; E301-R431 IonicContact OE2-NH2 3.87Å
302	G	91	Very high	87.6	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-60	-43.6	174	0	0	0	0	0	114.4	L289 K298 P299 V300 M304 G305 L306	L289-G302 VanDerWaalsContact CD1-CA 3.46Å; K298-G302 PolarHBondContact O-N 3.43Å; P299-G302 PolarHBondContact O-N 3.32Å; V300-G302 VanDerWaalsContact C-N 3.34Å; V300-G302 PolarHBondContact O-N 3.37Å; G302-M304 VanDerWaalsContact C-N 3.27Å; G302-M304 PolarHBondContact O-N 3.37Å; G302-G305 WeakPolarHBondContact O-CA 3.39Å; G302-G305 PolarHBondContact O-N 3.45Å; G302-G305 VanDerWaalsContact O-N 3.08Å; G302-L306 PolarHBondContact O-N 3.12Å
303	L	92.7	Very high	88.9	Confident	60 Å²	60	21.6 Å²	21.6	31%	0.314	12%	0.121	S	C	.	.	H	α-helix	trans	-63.4	-34.4	175.3	-68.4	177.1	0	0	0	112.5	T282 L286 P299 V300 E301 G305 L306 A307	T282-L303 HydrophobicContact CG2-CD2 3.77Å; L286-L303 HydrophobicContact CD2-CD1 4.14Å; L286-L303 HydrophobicContact CD2-CG 4.47Å; P299-L303 VanDerWaalsContact O-CG 3.31Å; P299-L303 WeakPolarHBondContact O-CG 3.47Å; P299-L303 PolarHBondContact O-N 3.38Å; V300-L303 PolarHBondContact O-N 2.8Å; E301-L303 PolarHBondContact O-N 2.61Å; L303-G305 VanDerWaalsContact C-N 3.34Å; L303-L306 WeakPolarHBondContact O-CB 3.46Å; L303-L306 PolarHBondContact O-N 3.47Å; L303-A307 PolarHBondContact O-N 3.36Å
304	M	94.1	Very high	90	Very high	57 Å²	57	19.5 Å²	19.5	28%	0.281	12%	0.115	S	C	.	.	H	α-helix	trans	-72.5	-29	173.6	-65.9	-55.8	-61.2	0	0	112.1	V300 E301 G302 A307 N308 F420 I424	V300-M304 HydrophobicContact CG1-CG 4.43Å; V300-M304 VanDerWaalsContact O-CG 3.25Å; V300-M304 WeakPolarHBondContact O-CG 3.48Å; V300-M304 PolarHBondContact O-N 2.88Å; E301-M304 PolarHBondContact O-N 2.65Å; G302-M304 VanDerWaalsContact C-N 3.27Å; G302-M304 PolarHBondContact O-N 3.37Å; M304-A307 PolarHBondContact O-N 2.9Å; M304-N308 PolarHBondContact O-N 3.04Å; M304-F420 HydrophobicContact CE-CE1 3.89Å; M304-F420 HydrophobicContact CE-CE2 4.3Å; M304-F420 HydrophobicContact CE-CZ 3.36Å; M304-F420 WeakPolarHBondContact O-CE1 3.33Å; M304-I424 HydrophobicContact CB-CB 4.42Å; M304-I424 HydrophobicContact CB-CG1 4.27Å; M304-I424 HydrophobicContact CB-CG2 3.69Å; M304-I424 HydrophobicContact CE-CD1 3.97Å; M304-I424 HydrophobicContact CE-CG1 4.18Å; M304-I424 HydrophobicContact CG-CG2 3.87Å
305	G	93.6	Very high	91.1	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62.9	-45.6	167	0	0	0	0	0	111.7	E301 G302 L303 A307 N308 S309	E301-G305 PolarHBondContact O-N 3.15Å; G302-G305 WeakPolarHBondContact O-CA 3.39Å; G302-G305 PolarHBondContact O-N 3.45Å; G302-G305 VanDerWaalsContact O-N 3.08Å; L303-G305 VanDerWaalsContact C-N 3.34Å; G305-A307 VanDerWaalsContact C-N 3.31Å; G305-A307 PolarHBondContact O-N 2.98Å; G305-N308 WeakPolarHBondContact O-CB 3.49Å; G305-N308 PolarHBondContact O-N 3.15Å; G305-N308 VanDerWaalsContact O-N 3.08Å; G305-S309 PolarHBondContact O-N 2.98Å; G305-S309 VanDerWaalsContact O-N 3.14Å; G305-S309 PolarHBondContact O-OG 3.05Å
306	L	94.7	Very high	92.2	Very high	7 Å²	7	17.6 Å²	17.6	4%	0.037	10%	0.103	C	C	.	.	H	α-helix	trans	-59.6	-41.2	171.9	-177.4	64.2	0	0	0	112.3	V278 L281 T282 L285 G302 L303 N308 S309 L310 L339 V343	V278-L306 HydrophobicContact CG1-CD2 4.12Å; L281-L306 HydrophobicContact CB-CD1 4.3Å; L281-L306 HydrophobicContact CD1-CD1 4.12Å; T282-L306 WeakPolarHBondContact OG1-CD2 3.46Å; L285-L306 HydrophobicContact CD1-CB 3.82Å; L285-L306 HydrophobicContact CD1-CD2 4.14Å; L285-L306 HydrophobicContact CD1-CG 4.46Å; G302-L306 PolarHBondContact O-N 3.12Å; L303-L306 WeakPolarHBondContact O-CB 3.46Å; L303-L306 PolarHBondContact O-N 3.47Å; L306-N308 VanDerWaalsContact C-N 3.32Å; L306-N308 PolarHBondContact O-N 3.16Å; L306-S309 PolarHBondContact O-N 2.96Å; L306-L310 WeakPolarHBondContact O-CG 3.35Å; L306-L310 PolarHBondContact O-N 3.26Å; L306-L310 VanDerWaalsContact O-N 3.07Å; L306-L339 HydrophobicContact CD1-CD1 3.62Å; L306-L339 HydrophobicContact CD1-CG 4.27Å; L306-V343 HydrophobicContact CD1-CG2 3.8Å
307	A	95.1	Very high	93.1	Very high	31 Å²	31	17.2 Å²	17.2	26%	0.256	10%	0.099	S	C	.	.	H	α-helix	trans	-64.1	-35.5	174.9	0	0	0	0	0	112.5	L303 M304 G305 L310 L311	L303-A307 PolarHBondContact O-N 3.36Å; M304-A307 PolarHBondContact O-N 2.9Å; G305-A307 VanDerWaalsContact C-N 3.31Å; G305-A307 PolarHBondContact O-N 2.98Å; A307-L310 PolarHBondContact O-N 2.95Å; A307-L311 VanDerWaalsContact O-CG 3.3Å; A307-L311 WeakPolarHBondContact O-CG 3.44Å; A307-L311 PolarHBondContact O-N 2.65Å
308	N	96.4	Very high	93.7	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-56	-52.2	172.7	-174.5	89.5	0	0	0	110.9	M304 G305 L306 L310 L311 A312 D413 F416 Q417 F420	M304-N308 PolarHBondContact O-N 3.04Å; G305-N308 WeakPolarHBondContact O-CB 3.49Å; G305-N308 PolarHBondContact O-N 3.15Å; G305-N308 VanDerWaalsContact O-N 3.08Å; L306-N308 VanDerWaalsContact C-N 3.32Å; L306-N308 PolarHBondContact O-N 3.16Å; N308-L310 VanDerWaalsContact C-N 3.31Å; N308-L310 PolarHBondContact O-N 3.04Å; N308-L311 WeakPolarHBondContact O-CB 3.5Å; N308-L311 PolarHBondContact O-N 3.5Å; N308-L311 VanDerWaalsContact O-N 3.15Å; N308-A312 PolarHBondContact O-N 2.73Å; N308-D413 PolarHBondContact ND2-OD1 3.02Å; N308-F416 WeakPolarHBondContact OD1-CB 3.18Å; N308-F416 PolarHBondContact OD1-O 3.02Å; N308-Q417 PolarHBondContact OD1-N 3.01Å; N308-F420 HydrophobicContact CB-CD1 3.83Å; N308-F420 HydrophobicContact CB-CE1 4.2Å; N308-F420 WeakPolarHBondContact OD1-CD1 3.46Å
309	S	94.9	Very high	94.2	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-60.7	-41.1	180	-46.5	0	0	0	0	111.5	G305 L306 A312 I313 A342	G305-S309 PolarHBondContact O-N 2.98Å; G305-S309 VanDerWaalsContact O-N 3.14Å; G305-S309 PolarHBondContact O-OG 3.05Å; L306-S309 PolarHBondContact O-N 2.96Å; S309-A312 PolarHBondContact O-N 3.38Å; S309-I313 VanDerWaalsContact O-CG1 3.25Å; S309-I313 WeakPolarHBondContact O-CG1 3.08Å; S309-I313 PolarHBondContact O-N 3.17Å; S309-A342 WeakPolarHBondContact OG-CB 3.31Å
310	L	95.6	Very high	94.6	Very high	63 Å²	63	21.2 Å²	21.2	33%	0.33	12%	0.117	S	C	.	.	H	α-helix	trans	-65.3	-38.8	176	-68.3	174.2	0	0	0	112.7	F274 V278 L306 A307 N308 G314 L339	F274-L310 HydrophobicContact CE1-CD2 3.89Å; F274-L310 HydrophobicContact CZ-CD2 3.79Å; V278-L310 HydrophobicContact CG1-CD1 4.45Å; V278-L310 HydrophobicContact CG2-CD2 4.12Å; L306-L310 WeakPolarHBondContact O-CG 3.35Å; L306-L310 PolarHBondContact O-N 3.26Å; L306-L310 VanDerWaalsContact O-N 3.07Å; A307-L310 PolarHBondContact O-N 2.95Å; N308-L310 VanDerWaalsContact C-N 3.31Å; N308-L310 PolarHBondContact O-N 3.04Å; L310-G314 PolarHBondContact O-N 3.08Å; L310-L339 HydrophobicContact CD2-CD1 4.06Å; L310-L339 HydrophobicContact CG-CD1 4.37Å
311	L	96.4	Very high	94.9	Very high	37 Å²	37	19.6 Å²	19.6	19%	0.194	11%	0.107	C	C	.	.	H	α-helix	trans	-63.6	-43.3	173.6	-70.5	171.2	0	0	0	110.9	I48 T51 A307 N308 G314 A315 F416 F420	I48-L311 HydrophobicContact CG1-CD1 4.15Å; T51-L311 HydrophobicContact CG2-CB 4.22Å; T51-L311 HydrophobicContact CG2-CD2 3.78Å; T51-L311 VanDerWaalsContact CG2-O 3.29Å; T51-L311 WeakPolarHBondContact CG2-O 3.36Å; A307-L311 VanDerWaalsContact O-CG 3.3Å; A307-L311 WeakPolarHBondContact O-CG 3.44Å; A307-L311 PolarHBondContact O-N 2.65Å; N308-L311 WeakPolarHBondContact O-CB 3.5Å; N308-L311 PolarHBondContact O-N 3.5Å; N308-L311 VanDerWaalsContact O-N 3.15Å; L311-G314 PolarHBondContact O-N 3.04Å; L311-A315 WeakPolarHBondContact O-CB 3.42Å; L311-A315 PolarHBondContact O-N 3.35Å; L311-F416 HydrophobicContact CB-CD2 4.01Å; L311-F416 HydrophobicContact CB-CE2 3.94Å; L311-F420 HydrophobicContact CD1-CE1 4.34Å; L311-F420 HydrophobicContact CD1-CE2 4.26Å; L311-F420 HydrophobicContact CD1-CZ 4.1Å
312	A	97	Very high	94.9	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.008	13%	0.13	C	C	.	.	H	α-helix	trans	-62.9	-44.3	178.8	0	0	0	0	0	112.4	N308 S309 A315 A316 F412 D413 F416	N308-A312 PolarHBondContact O-N 2.73Å; S309-A312 PolarHBondContact O-N 3.38Å; A312-A315 PolarHBondContact O-N 3.07Å; A312-A316 WeakPolarHBondContact O-CB 3.4Å; A312-A316 PolarHBondContact O-N 3.49Å; A312-F412 HydrophobicContact CB-CB 4.1Å; A312-D413 VanDerWaalsContact CB-CA 3.43Å; A312-D413 HydrophobicContact CB-CB 3.62Å; A312-F416 HydrophobicContact CB-CD2 3.93Å; A312-F416 HydrophobicContact CB-CE2 4.39Å
313	I	95.7	Very high	95	Very high	14 Å²	14	28.5 Å²	28.5	7%	0.072	15%	0.154	C	C	.	.	H	α-helix	trans	-60	-48.7	174	-67.2	166.3	0	0	0	110.1	F274 S309 A315 A316 F317 P335 T338 L339	F274-I313 HydrophobicContact CZ-CD1 4.37Å; S309-I313 VanDerWaalsContact O-CG1 3.25Å; S309-I313 WeakPolarHBondContact O-CG1 3.08Å; S309-I313 PolarHBondContact O-N 3.17Å; I313-A315 VanDerWaalsContact C-N 3.34Å; I313-A315 PolarHBondContact O-N 3.43Å; I313-A316 PolarHBondContact O-N 3.3Å; I313-F317 HydrophobicContact CG2-CD2 3.92Å; I313-F317 HydrophobicContact CG2-CE2 4.04Å; I313-F317 VanDerWaalsContact O-CD2 3.29Å; I313-F317 WeakPolarHBondContact O-CD2 3.47Å; I313-F317 PolarHBondContact O-N 3.42Å; I313-P335 HydrophobicContact CG2-CB 4.06Å; I313-P335 HydrophobicContact CG2-CG 4.37Å; I313-T338 WeakPolarHBondContact CG1-OG1 3.22Å; I313-L339 HydrophobicContact CD1-CB 3.98Å; I313-L339 HydrophobicContact CD1-CD1 4.19Å
314	G	95.2	Very high	95	Very high	21 Å²	21	31.1 Å²	31.1	22%	0.216	17%	0.168	C	C	.	.	H	α-helix	trans	-57.7	-45.4	177.4	0	0	0	0	0	112.7	V55 L310 L311 G318	V55-G314 VanDerWaalsContact CG2-C 3.46Å; V55-G314 WeakPolarHBondContact CG2-O 3.18Å; L310-G314 PolarHBondContact O-N 3.08Å; L311-G314 PolarHBondContact O-N 3.04Å; G314-G318 PolarHBondContact O-N 3.2Å
315	A	96.6	Very high	94.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.1	-41.9	177	0	0	0	0	0	112.1	F50 T51 I54 L311 A312 I313 G318 F319 F412 F416	F50-A315 HydrophobicContact CE1-CB 4.5Å; T51-A315 HydrophobicContact CG2-CB 4.33Å; I54-A315 VanDerWaalsContact CG2-O 3.23Å; I54-A315 WeakPolarHBondContact CG2-O 3.27Å; L311-A315 WeakPolarHBondContact O-CB 3.42Å; L311-A315 PolarHBondContact O-N 3.35Å; A312-A315 PolarHBondContact O-N 3.07Å; I313-A315 VanDerWaalsContact C-N 3.34Å; I313-A315 PolarHBondContact O-N 3.43Å; A315-G318 PolarHBondContact O-N 2.97Å; A315-F319 WeakPolarHBondContact O-CB 3.43Å; A315-F319 PolarHBondContact O-N 3.29Å; A315-F412 HydrophobicContact CB-CB 4.44Å; A315-F412 HydrophobicContact CB-CD1 4.25Å; A315-F412 HydrophobicContact CB-CD2 4.08Å; A315-F412 HydrophobicContact CB-CE2 4.42Å; A315-F412 HydrophobicContact CB-CG 4Å; A315-F416 HydrophobicContact CB-CE2 4.15Å; A315-F416 HydrophobicContact CB-CZ 4.13Å
316	A	96.3	Very high	94.7	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-62.6	-48.2	178.3	0	0	0	0	0	112.6	A312 I313 F319 M320 A408 A409 F412	A312-A316 WeakPolarHBondContact O-CB 3.4Å; A312-A316 PolarHBondContact O-N 3.49Å; I313-A316 PolarHBondContact O-N 3.3Å; A316-F319 PolarHBondContact O-N 3.18Å; A316-M320 WeakPolarHBondContact O-CB 3.36Å; A316-M320 WeakPolarHBondContact O-CG 3.5Å; A316-M320 PolarHBondContact O-N 3.11Å; A316-A408 HydrophobicContact CB-CB 3.91Å; A316-A409 VanDerWaalsContact CB-CA 3.5Å; A316-A409 HydrophobicContact CB-CB 3.86Å; A316-F412 HydrophobicContact CB-CD2 3.93Å; A316-F412 HydrophobicContact CB-CE2 4.49Å
317	F	95.4	Very high	94.5	Very high	26 Å²	26	31.8 Å²	31.8	11%	0.114	17%	0.174	C	C	.	.	H	α-helix	trans	-66.2	-40.9	179.1	-84.9	-103.9	0	0	0	111.9	T58 I313 S321 F327 V331 V334 P335 F405	T58-F317 HydrophobicContact CG2-CB 4.34Å; I313-F317 HydrophobicContact CG2-CD2 3.92Å; I313-F317 HydrophobicContact CG2-CE2 4.04Å; I313-F317 VanDerWaalsContact O-CD2 3.29Å; I313-F317 WeakPolarHBondContact O-CD2 3.47Å; I313-F317 PolarHBondContact O-N 3.42Å; F317-S321 WeakPolarHBondContact O-CB 3.45Å; F317-S321 PolarHBondContact O-N 2.95Å; F317-F327 HydrophobicContact CE1-CD2 4.12Å; F317-F327 AromaticContact CE1-CE2 3.91Å; F317-F327 HydrophobicContact CE1-CE2 3.91Å; F317-V331 HydrophobicContact CE1-CG1 3.86Å; F317-V331 HydrophobicContact CZ-CG1 3.98Å; F317-V334 HydrophobicContact CE2-CG1 4.24Å; F317-V334 HydrophobicContact CZ-CB 4.27Å; F317-V334 HydrophobicContact CZ-CG1 4.42Å; F317-P335 HydrophobicContact CE1-CG 4.42Å; F317-P335 HydrophobicContact CE2-CG 3.78Å; F317-P335 HydrophobicContact CZ-CG 3.56Å; F317-F405 AromaticContact CD1-CD1 3.95Å; F317-F405 HydrophobicContact CD1-CD1 3.95Å; F317-F405 AromaticContact CD1-CE1 3.7Å; F317-F405 HydrophobicContact CD1-CE1 3.7Å; F317-F405 HydrophobicContact CD2-CD1 4.18Å; F317-F405 AromaticContact CE1-CD1 3.89Å; F317-F405 HydrophobicContact CE1-CD1 3.89Å; F317-F405 AromaticContact CE1-CE1 3.93Å; F317-F405 HydrophobicContact CE1-CE1 3.93Å; F317-F405 HydrophobicContact CE2-CD1 4.15Å; F317-F405 HydrophobicContact CG-CD1 4.09Å; F317-F405 HydrophobicContact CG-CE1 4.07Å; F317-F405 AromaticContact CZ-CD1 3.99Å; F317-F405 HydrophobicContact CZ-CD1 3.99Å; F317-F405 HydrophobicContact CZ-CE1 4.49Å
318	G	95.3	Very high	94.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.2	-44.2	173.6	0	0	0	0	0	112.3	I54 G314 A315 S321 L322	I54-G318 WeakPolarHBondContact O-CA 3.19Å; G314-G318 PolarHBondContact O-N 3.2Å; A315-G318 PolarHBondContact O-N 2.97Å; G318-S321 PolarHBondContact O-N 3.41Å; G318-L322 VanDerWaalsContact O-CG 3.31Å; G318-L322 WeakPolarHBondContact O-CG 3.21Å; G318-L322 PolarHBondContact O-N 3.14Å
319	F	95.7	Very high	93.7	Very high	79 Å²	79	30.7 Å²	30.7	35%	0.346	16%	0.163	S	C	.	.	H	α-helix	trans	-65.9	-46.8	-179.8	-178.3	-107.3	0	0	0	112.2	I54 A315 A316 S321 L322 L323 F412	I54-F319 HydrophobicContact CG2-CB 3.95Å; A315-F319 WeakPolarHBondContact O-CB 3.43Å; A315-F319 PolarHBondContact O-N 3.29Å; A316-F319 PolarHBondContact O-N 3.18Å; F319-S321 VanDerWaalsContact C-N 3.31Å; F319-S321 PolarHBondContact O-N 2.95Å; F319-L322 WeakPolarHBondContact O-CB 3.4Å; F319-L322 PolarHBondContact O-N 3.39Å; F319-L322 VanDerWaalsContact O-N 3.16Å; F319-L323 HydrophobicContact CD1-CD1 4.13Å; F319-L323 HydrophobicContact CE1-CD1 3.55Å; F319-L323 HydrophobicContact CE1-CG 4.43Å; F319-L323 HydrophobicContact CZ-CD1 3.81Å; F319-L323 HydrophobicContact CZ-CG 4.41Å; F319-L323 PolarHBondContact O-N 3.42Å; F319-L323 VanDerWaalsContact O-N 3.16Å; F319-F412 HydrophobicContact CB-CE2 3.77Å; F319-F412 HydrophobicContact CB-CZ 3.98Å; F319-F412 HydrophobicContact CD1-CE2 4.16Å; F319-F412 HydrophobicContact CD1-CZ 4.31Å; F319-F412 HydrophobicContact CD2-CZ 4.38Å; F319-F412 HydrophobicContact CG-CE2 4.04Å; F319-F412 AromaticContact CG-CZ 3.97Å; F319-F412 HydrophobicContact CG-CZ 3.97Å
320	M	95	Very high	93.3	Very high	11 Å²	11	30.8 Å²	30.8	5%	0.054	16%	0.164	C	C	.	.	H	α-helix	trans	-66.7	-34.3	178.2	-67.5	-35.3	-160.7	0	0	112.6	A316 L323 N324 I325 L404 F405 A408	A316-M320 WeakPolarHBondContact O-CB 3.36Å; A316-M320 WeakPolarHBondContact O-CG 3.5Å; A316-M320 PolarHBondContact O-N 3.11Å; M320-L323 PolarHBondContact O-N 2.93Å; M320-L323 HydrophobicContact SD-CD1 4.1Å; M320-N324 PolarHBondContact O-N 2.92Å; M320-I325 HydrophobicContact CB-CB 4.4Å; M320-I325 HydrophobicContact CB-CD1 4.24Å; M320-I325 HydrophobicContact CE-CD1 4.25Å; M320-I325 HydrophobicContact CG-CD1 4.23Å; M320-I325 PolarHBondContact O-N 3.31Å; M320-I325 VanDerWaalsContact O-N 3.11Å; M320-I325 HydrophobicContact SD-CD1 3.5Å; M320-I325 WeakPolarHBondContact SD-CD1 3.37Å; M320-L404 VanDerWaalsContact CE-C 3.44Å; M320-L404 HydrophobicContact CE-CB 4.07Å; M320-L404 WeakPolarHBondContact CE-O 3.45Å; M320-F405 HydrophobicContact CB-CD1 3.88Å; M320-F405 HydrophobicContact CB-CD2 4.24Å; M320-F405 HydrophobicContact CB-CE1 3.53Å; M320-F405 HydrophobicContact CB-CE2 3.93Å; M320-F405 HydrophobicContact CB-CG 4.23Å; M320-F405 HydrophobicContact CB-CZ 3.55Å; M320-F405 HydrophobicContact CG-CD1 3.99Å; M320-F405 HydrophobicContact CG-CD2 4.29Å; M320-F405 HydrophobicContact CG-CE1 4.18Å; M320-F405 HydrophobicContact CG-CE2 4.47Å; M320-F405 HydrophobicContact CG-CG 4.06Å; M320-F405 HydrophobicContact CG-CZ 4.42Å; M320-A408 HydrophobicContact CE-CB 3.34Å; M320-A408 HydrophobicContact CG-CB 4.22Å; M320-A408 HydrophobicContact SD-CB 4.12Å
321	S	94	Very high	93.1	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.014	15%	0.148	C	C	.	.	H	α-helix	trans	-63.4	-39.6	171.4	-175.1	0	0	0	0	112.2	G57 M61 F317 G318 F319 L323 N324	G57-S321 WeakPolarHBondContact O-CB 3.24Å; G57-S321 PolarHBondContact O-OG 3.26Å; M61-S321 VanDerWaalsContact CA-OG 3.26Å; M61-S321 WeakPolarHBondContact CA-OG 3.49Å; M61-S321 PolarHBondContact N-OG 3.16Å; M61-S321 VanDerWaalsContact N-OG 3.16Å; F317-S321 WeakPolarHBondContact O-CB 3.45Å; F317-S321 PolarHBondContact O-N 2.95Å; G318-S321 PolarHBondContact O-N 3.41Å; F319-S321 VanDerWaalsContact C-N 3.31Å; F319-S321 PolarHBondContact O-N 2.95Å; S321-L323 VanDerWaalsContact C-N 3.26Å; S321-L323 PolarHBondContact O-N 3.39Å; S321-N324 PolarHBondContact O-N 3.22Å
322	L	92.8	Very high	92.8	Very high	93 Å²	93	26.1 Å²	26.1	49%	0.487	14%	0.14	S	C	.	.	H	α-helix	trans	-64.5	-29.2	174.4	-69.9	169.8	0	0	0	113.2	I54 G318 F319 N324	I54-L322 HydrophobicContact CG2-CD1 4.46Å; G318-L322 VanDerWaalsContact O-CG 3.31Å; G318-L322 WeakPolarHBondContact O-CG 3.21Å; G318-L322 PolarHBondContact O-N 3.14Å; F319-L322 WeakPolarHBondContact O-CB 3.4Å; F319-L322 PolarHBondContact O-N 3.39Å; F319-L322 VanDerWaalsContact O-N 3.16Å; L322-N324 PolarHBondContact O-N 2.97Å
323	L	93.1	Very high	92.5	Very high	96 Å²	96	26.2 Å²	26.2	50%	0.503	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	3.9	175	-64.4	179.7	0	0	0	113.3	F319 M320 S321 I325	F319-L323 HydrophobicContact CD1-CD1 4.13Å; F319-L323 HydrophobicContact CE1-CD1 3.55Å; F319-L323 HydrophobicContact CE1-CG 4.43Å; F319-L323 HydrophobicContact CZ-CD1 3.81Å; F319-L323 HydrophobicContact CZ-CG 4.41Å; F319-L323 PolarHBondContact O-N 3.42Å; F319-L323 VanDerWaalsContact O-N 3.16Å; M320-L323 PolarHBondContact O-N 2.93Å; M320-L323 HydrophobicContact SD-CD1 4.1Å; S321-L323 VanDerWaalsContact C-N 3.26Å; S321-L323 PolarHBondContact O-N 3.39Å; L323-I325 HydrophobicContact CB-CD1 4.08Å; L323-I325 HydrophobicContact CB-CG1 4.02Å; L323-I325 HydrophobicContact CD1-CD1 4.24Å; L323-I325 PolarHBondContact O-N 2.98Å
324	N	91.2	Very high	92.4	Very high	115 Å²	115	25.6 Å²	25.6	62%	0.615	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.8	31.3	-174.6	-60.9	-50.4	0	0	0	113.7	M320 S321 L322	M320-N324 PolarHBondContact O-N 2.92Å; S321-N324 PolarHBondContact O-N 3.22Å; L322-N324 PolarHBondContact O-N 2.97Å
325	I	92.7	Very high	92.4	Very high	24 Å²	24	25.2 Å²	25.2	12%	0.123	13%	0.131	C	C	.	.	P	Polyproline II helix	trans	-75.4	129.9	174.3	-61.4	171.1	0	0	0	108.1	M320 L323 F327 L404 F405	M320-I325 HydrophobicContact CB-CB 4.4Å; M320-I325 HydrophobicContact CB-CD1 4.24Å; M320-I325 HydrophobicContact CE-CD1 4.25Å; M320-I325 HydrophobicContact CG-CD1 4.23Å; M320-I325 PolarHBondContact O-N 3.31Å; M320-I325 VanDerWaalsContact O-N 3.11Å; M320-I325 HydrophobicContact SD-CD1 3.5Å; M320-I325 WeakPolarHBondContact SD-CD1 3.37Å; L323-I325 HydrophobicContact CB-CD1 4.08Å; L323-I325 HydrophobicContact CB-CG1 4.02Å; L323-I325 HydrophobicContact CD1-CD1 4.24Å; L323-I325 PolarHBondContact O-N 2.98Å; I325-F327 PolarHBondContact O-N 2.92Å; I325-L404 HydrophobicContact CD1-CB 4.38Å; I325-L404 HydrophobicContact CD1-CD1 4.14Å; I325-L404 HydrophobicContact CG2-CD1 4.25Å; I325-F405 HydrophobicContact CB-CE2 4.26Å; I325-F405 HydrophobicContact CG2-CD2 4.23Å; I325-F405 HydrophobicContact CG2-CE2 3.73Å
326	P	89.4	Confident	92.2	Very high	36 Å²	36	25.3 Å²	25.3	23%	0.234	13%	0.131	C	C	.	.	P	Polyproline II helix	trans	-68	132	-173.5	26.9	-34.7	0	0	0	112.1	H62 V64	H62-P326 WeakPolarHBondContact O-CA 3.47Å; V64-P326 HydrophobicContact CB-CB 3.9Å; V64-P326 HydrophobicContact CG2-CB 3.46Å; V64-P326 VanDerWaalsContact CG2-CB 3.46Å
327	F	91	Very high	91.9	Very high	19 Å²	19	25.4 Å²	25.4	8%	0.083	13%	0.132	C	C	.	.	B	Isolated β-bridge	trans	-81.4	134.1	166.2	179.3	-89.9	0	0	0	109.2	M61 H62 V63 V64 F317 I325 V331 T332	M61-F327 HydrophobicContact CE-CB 4.17Å; M61-F327 HydrophobicContact CE-CD1 3.96Å; M61-F327 HydrophobicContact CE-CD2 4.27Å; M61-F327 HydrophobicContact CE-CE1 4.43Å; M61-F327 HydrophobicContact CE-CG 3.86Å; M61-F327 HydrophobicContact CG-CB 3.73Å; M61-F327 HydrophobicContact CG-CG 4.37Å; M61-F327 HydrophobicContact SD-CB 3.72Å; M61-F327 HydrophobicContact SD-CD1 4.42Å; M61-F327 HydrophobicContact SD-CD2 3.79Å; M61-F327 HydrophobicContact SD-CG 3.71Å; H62-F327 PolarHBondContact O-N 3.03Å; V63-F327 WeakPolarHBondContact CA-O 3.21Å; V63-F327 HydrophobicContact CG1-CD1 4.31Å; V63-F327 HydrophobicContact CG2-CB 4.43Å; V63-F327 HydrophobicContact CG2-CD1 4.12Å; V64-F327 PolarHBondContact N-O 3.45Å; F317-F327 HydrophobicContact CE1-CD2 4.12Å; F317-F327 AromaticContact CE1-CE2 3.91Å; F317-F327 HydrophobicContact CE1-CE2 3.91Å; I325-F327 PolarHBondContact O-N 2.92Å; F327-V331 HydrophobicContact CD2-CB 4.11Å; F327-V331 HydrophobicContact CD2-CG1 3.59Å; F327-V331 HydrophobicContact CE2-CB 4.2Å; F327-V331 HydrophobicContact CE2-CG1 3.75Å; F327-T332 VanDerWaalsContact CZ-OG1 3.26Å; F327-T332 WeakPolarHBondContact CZ-OG1 3.35Å
328	N	88.1	Confident	91.8	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.011	13%	0.128	C	C	.	.			trans	-140.1	178.6	-177.8	64.9	32.4	0	0	0	110.4	V64 L70 T330 V331 T332	V64-N328 WeakPolarHBondContact O-CB 3.38Å; L70-N328 HydrophobicContact CD1-CB 4.06Å; L70-N328 HydrophobicContact CD2-CB 3.76Å; N328-T330 PolarHBondContact O-N 3.43Å; N328-T330 PolarHBondContact OD1-N 3.27Å; N328-T330 VanDerWaalsContact OD1-N 3.1Å; N328-T330 PolarHBondContact OD1-OG1 2.99Å; N328-V331 PolarHBondContact O-N 3.11Å; N328-V331 VanDerWaalsContact OD1-CG2 3.23Å; N328-V331 WeakPolarHBondContact OD1-CG2 3.31Å; N328-V331 PolarHBondContact OD1-N 3.39Å; N328-T332 PolarHBondContact O-N 3.11Å
329	N	85.6	Confident	91.6	Very high	5 Å²	5	24.4 Å²	24.4	3%	0.027	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-38.4	-178.7	-175.2	32.2	0	0	0	113.7	I263 T266 V331 T332	I263-N329 HydrophobicContact CG2-CB 3.87Å; T266-N329 WeakPolarHBondContact CB-OD1 3.5Å; T266-N329 WeakPolarHBondContact CG2-OD1 3.33Å; N329-V331 VanDerWaalsContact C-N 3.34Å; N329-V331 PolarHBondContact O-N 2.82Å; N329-T332 VanDerWaalsContact O-CB 3.31Å; N329-T332 WeakPolarHBondContact O-CB 3.38Å; N329-T332 PolarHBondContact O-N 3.17Å; N329-T332 PolarHBondContact O-OG1 2.92Å
330	T	87.4	Confident	91.2	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.012	11%	0.113	C	C	.	.	G	3₁₀ helix	trans	-67.3	-36.2	179.7	53.3	0	0	0	0	111.7	N328 T332 V333 A398 F402 I753	N328-T330 PolarHBondContact O-N 3.43Å; N328-T330 PolarHBondContact OD1-N 3.27Å; N328-T330 VanDerWaalsContact OD1-N 3.1Å; N328-T330 PolarHBondContact OD1-OG1 2.99Å; T330-T332 PolarHBondContact O-N 3.2Å; T330-V333 PolarHBondContact O-N 2.78Å; T330-A398 PolarHBondContact OG1-O 3.47Å; T330-F402 WeakPolarHBondContact O-CD2 3.33Å; T330-I753 HydrophobicContact CG2-CD1 4.19Å
331	V	92.1	Very high	90.9	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.113	C	C	.	.	G	3₁₀ helix	trans	-62.3	-22.6	175.4	175.2	0	0	0	0	112.2	F317 F327 N328 N329 V333 V334 F405	F317-V331 HydrophobicContact CE1-CG1 3.86Å; F317-V331 HydrophobicContact CZ-CG1 3.98Å; F327-V331 HydrophobicContact CD2-CB 4.11Å; F327-V331 HydrophobicContact CD2-CG1 3.59Å; F327-V331 HydrophobicContact CE2-CB 4.2Å; F327-V331 HydrophobicContact CE2-CG1 3.75Å; N328-V331 PolarHBondContact O-N 3.11Å; N328-V331 VanDerWaalsContact OD1-CG2 3.23Å; N328-V331 WeakPolarHBondContact OD1-CG2 3.31Å; N328-V331 PolarHBondContact OD1-N 3.39Å; N329-V331 VanDerWaalsContact C-N 3.34Å; N329-V331 PolarHBondContact O-N 2.82Å; V331-V333 PolarHBondContact O-N 2.92Å; V331-V333 VanDerWaalsContact O-N 3.16Å; V331-V334 HydrophobicContact CG1-CG2 4.38Å; V331-V334 VanDerWaalsContact O-CB 3.31Å; V331-V334 WeakPolarHBondContact O-CB 3.27Å; V331-V334 WeakPolarHBondContact O-CG2 3.03Å; V331-V334 PolarHBondContact O-N 3.28Å; V331-V334 VanDerWaalsContact O-N 3.08Å; V331-F405 HydrophobicContact CG1-CB 4.16Å; V331-F405 HydrophobicContact CG1-CD1 3.87Å; V331-F405 HydrophobicContact CG1-CD2 3.84Å; V331-F405 HydrophobicContact CG1-CE1 4.16Å; V331-F405 HydrophobicContact CG1-CE2 4.13Å; V331-F405 HydrophobicContact CG1-CG 3.7Å; V331-F405 HydrophobicContact CG1-CZ 4.29Å; V331-F405 HydrophobicContact CG2-CD2 3.89Å; V331-F405 HydrophobicContact CG2-CE2 4.3Å; V331-F405 HydrophobicContact CG2-CG 4.39Å
332	T	90.4	Very high	90.7	Very high	2 Å²	2	21 Å²	21	1%	0.012	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-62.5	-25.4	179.4	-54.5	0	0	0	0	113.3	A267 A270 L271 F327 N328 N329 T330 P335	A267-T332 HydrophobicContact CB-CG2 4.07Å; A267-T332 WeakPolarHBondContact CB-OG1 3.48Å; A270-T332 HydrophobicContact CB-CG2 3.84Å; L271-T332 HydrophobicContact CD2-CG2 4.03Å; L271-T332 HydrophobicContact CG-CG2 3.99Å; F327-T332 VanDerWaalsContact CZ-OG1 3.26Å; F327-T332 WeakPolarHBondContact CZ-OG1 3.35Å; N328-T332 PolarHBondContact O-N 3.11Å; N329-T332 VanDerWaalsContact O-CB 3.31Å; N329-T332 WeakPolarHBondContact O-CB 3.38Å; N329-T332 PolarHBondContact O-N 3.17Å; N329-T332 PolarHBondContact O-OG1 2.92Å; T330-T332 PolarHBondContact O-N 3.2Å; T332-P335 WeakPolarHBondContact O-CD 3.41Å
333	V	90.5	Very high	90.6	Very high	4 Å²	4	16.6 Å²	16.6	2%	0.024	9%	0.091	C	C	.	.	G	3₁₀ helix	trans	-84.3	-19.2	179.2	-171.6	0	0	0	0	112.1	T330 V331 P335 F336 I337 M807 L810 F821	T330-V333 PolarHBondContact O-N 2.78Å; V331-V333 PolarHBondContact O-N 2.92Å; V331-V333 VanDerWaalsContact O-N 3.16Å; V333-P335 VanDerWaalsContact C-CD 3.48Å; V333-F336 WeakPolarHBondContact O-CB 3.27Å; V333-F336 PolarHBondContact O-N 3.19Å; V333-I337 HydrophobicContact CB-CD1 4.46Å; V333-I337 HydrophobicContact CG1-CD1 3.75Å; V333-I337 HydrophobicContact CG1-CG1 4.17Å; V333-I337 PolarHBondContact O-N 3.37Å; V333-M807 HydrophobicContact CG1-CE 4.18Å; V333-L810 HydrophobicContact CG1-CD1 3.78Å; V333-F821 HydrophobicContact CB-CD2 4.26Å; V333-F821 HydrophobicContact CB-CE2 4.34Å; V333-F821 HydrophobicContact CG1-CB 4.24Å; V333-F821 HydrophobicContact CG1-CD1 4.49Å; V333-F821 HydrophobicContact CG1-CD2 3.96Å; V333-F821 HydrophobicContact CG1-CE2 4.46Å; V333-F821 HydrophobicContact CG1-CG 3.99Å; V333-F821 HydrophobicContact CG2-CD2 4.05Å; V333-F821 HydrophobicContact CG2-CE2 4.21Å
334	V	93.5	Very high	90.3	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-51.5	-47.7	-176.9	174.6	0	0	0	0	112.8	F317 V331 F336 I337 T338 F402 F405	F317-V334 HydrophobicContact CE2-CG1 4.24Å; F317-V334 HydrophobicContact CZ-CB 4.27Å; F317-V334 HydrophobicContact CZ-CG1 4.42Å; V331-V334 HydrophobicContact CG1-CG2 4.38Å; V331-V334 VanDerWaalsContact O-CB 3.31Å; V331-V334 WeakPolarHBondContact O-CB 3.27Å; V331-V334 WeakPolarHBondContact O-CG2 3.03Å; V331-V334 PolarHBondContact O-N 3.28Å; V331-V334 VanDerWaalsContact O-N 3.08Å; V334-F336 PolarHBondContact O-N 3.39Å; V334-I337 PolarHBondContact O-N 2.6Å; V334-T338 HydrophobicContact CG1-CG2 3.71Å; V334-T338 WeakPolarHBondContact O-CG2 3.27Å; V334-T338 PolarHBondContact O-N 3.47Å; V334-T338 PolarHBondContact O-OG1 3.5Å; V334-F402 HydrophobicContact CG2-CD2 3.39Å; V334-F402 HydrophobicContact CG2-CE2 3.4Å; V334-F402 HydrophobicContact CG2-CG 4.17Å; V334-F402 HydrophobicContact CG2-CZ 4.16Å; V334-F405 HydrophobicContact CG1-CB 4.29Å; V334-F405 HydrophobicContact CG2-CB 4.43Å
335	P	93.9	Very high	90.3	Very high	14 Å²	14	7.1 Å²	7.1	9%	0.091	4%	0.041	C	C	.	.	H	α-helix	trans	-58.2	-33.9	180	-25.4	36.7	0	0	0	113.6	F274 I313 F317 T332 V333 T338 L339	F274-P335 HydrophobicContact CD2-CB 3.96Å; F274-P335 HydrophobicContact CE2-CB 3.5Å; F274-P335 HydrophobicContact CZ-CB 4.02Å; I313-P335 HydrophobicContact CG2-CB 4.06Å; I313-P335 HydrophobicContact CG2-CG 4.37Å; F317-P335 HydrophobicContact CE1-CG 4.42Å; F317-P335 HydrophobicContact CE2-CG 3.78Å; F317-P335 HydrophobicContact CZ-CG 3.56Å; T332-P335 WeakPolarHBondContact O-CD 3.41Å; V333-P335 VanDerWaalsContact C-CD 3.48Å; P335-T338 WeakPolarHBondContact CA-OG1 3.16Å; P335-T338 PolarHBondContact O-OG1 3Å; P335-L339 WeakPolarHBondContact O-CB 3.16Å; P335-L339 PolarHBondContact O-N 3.02Å; P335-L339 VanDerWaalsContact O-N 3.07Å
336	F	92.9	Very high	90.2	Very high	1 Å²	1	6 Å²	6	0%	0.004	4%	0.035	C	C	.	.	H	α-helix	trans	-70.8	-41.3	-179.7	-63.8	-97.5	0	0	0	111.3	A270 F274 V333 V334 A340 M807 S809 L810	A270-F336 WeakPolarHBondContact O-CZ 3.45Å; F274-F336 HydrophobicContact CB-CE1 3.99Å; F274-F336 HydrophobicContact CB-CE2 4.21Å; F274-F336 HydrophobicContact CB-CZ 3.59Å; F274-F336 HydrophobicContact CD2-CD1 4.08Å; F274-F336 HydrophobicContact CD2-CD2 4.19Å; F274-F336 AromaticContact CD2-CE1 3.95Å; F274-F336 HydrophobicContact CD2-CE1 3.95Å; F274-F336 HydrophobicContact CD2-CE2 4.07Å; F274-F336 HydrophobicContact CD2-CG 4.2Å; F274-F336 AromaticContact CD2-CZ 3.95Å; F274-F336 HydrophobicContact CD2-CZ 3.95Å; F274-F336 HydrophobicContact CG-CE1 4.49Å; F274-F336 HydrophobicContact CG-CZ 4.29Å; V333-F336 WeakPolarHBondContact O-CB 3.27Å; V333-F336 PolarHBondContact O-N 3.19Å; V334-F336 PolarHBondContact O-N 3.39Å; F336-A340 WeakPolarHBondContact O-CB 3.48Å; F336-A340 PolarHBondContact O-N 3.13Å; F336-M807 HydrophobicContact CB-SD 3.7Å; F336-S809 WeakPolarHBondContact CD1-OG 3.46Å; F336-S809 VanDerWaalsContact CE1-OG 3.29Å; F336-S809 WeakPolarHBondContact CE1-OG 3.35Å; F336-L810 HydrophobicContact CB-CD1 4.34Å; F336-L810 HydrophobicContact CD1-CD2 4.06Å; F336-L810 HydrophobicContact CD1-CG 4.22Å; F336-L810 HydrophobicContact CD2-CD2 4.13Å; F336-L810 HydrophobicContact CE1-CD2 4.02Å; F336-L810 HydrophobicContact CE2-CD2 4.1Å; F336-L810 HydrophobicContact CG-CD1 4.42Å; F336-L810 HydrophobicContact CG-CD2 4.11Å; F336-L810 HydrophobicContact CG-CG 4.37Å; F336-L810 HydrophobicContact CZ-CD2 4.04Å
337	I	90.4	Very high	90.2	Very high	2 Å²	2	4.3 Å²	4.3	1%	0.01	2%	0.024	C	C	.	.	H	α-helix	trans	-72.6	-45.2	-179.6	-64.4	160.7	0	0	0	110.6	V333 V334 L339 A340 L341 F402 M757 M807 F821	V333-I337 HydrophobicContact CB-CD1 4.46Å; V333-I337 HydrophobicContact CG1-CD1 3.75Å; V333-I337 HydrophobicContact CG1-CG1 4.17Å; V333-I337 PolarHBondContact O-N 3.37Å; V334-I337 PolarHBondContact O-N 2.6Å; I337-L339 VanDerWaalsContact C-N 3.31Å; I337-L339 PolarHBondContact O-N 3.23Å; I337-A340 WeakPolarHBondContact O-CA 3.2Å; I337-A340 VanDerWaalsContact O-CB 3.24Å; I337-A340 WeakPolarHBondContact O-CB 3.4Å; I337-A340 PolarHBondContact O-N 3.35Å; I337-A340 VanDerWaalsContact O-N 3.09Å; I337-L341 HydrophobicContact CG2-CD1 4.02Å; I337-L341 PolarHBondContact O-N 3.13Å; I337-F402 HydrophobicContact CD1-CE2 4.18Å; I337-F402 HydrophobicContact CD1-CZ 3.98Å; I337-M757 HydrophobicContact CB-SD 4.35Å; I337-M757 HydrophobicContact CD1-SD 3.49Å; I337-M757 WeakPolarHBondContact CD1-SD 3.22Å; I337-M757 HydrophobicContact CG1-SD 3.77Å; I337-M757 HydrophobicContact CG2-CG 4.06Å; I337-M757 HydrophobicContact CG2-SD 3.62Å; I337-M807 HydrophobicContact CD1-CE 4.39Å; I337-M807 HydrophobicContact CG1-CE 3.73Å; I337-M807 HydrophobicContact CG1-SD 3.84Å; I337-F821 HydrophobicContact CD1-CD1 3.88Å; I337-F821 HydrophobicContact CD1-CE1 4.01Å
338	T	92.2	Very high	90	Very high	5 Å²	5	4 Å²	4	3%	0.031	2%	0.023	C	C	.	.	H	α-helix	trans	-69.4	-33.4	-179	55.4	0	0	0	0	111.4	I313 V334 P335 A340 A342 T406 A409	I313-T338 WeakPolarHBondContact CG1-OG1 3.22Å; V334-T338 HydrophobicContact CG1-CG2 3.71Å; V334-T338 WeakPolarHBondContact O-CG2 3.27Å; V334-T338 PolarHBondContact O-N 3.47Å; V334-T338 PolarHBondContact O-OG1 3.5Å; P335-T338 WeakPolarHBondContact CA-OG1 3.16Å; P335-T338 PolarHBondContact O-OG1 3Å; T338-A340 VanDerWaalsContact C-N 3.29Å; T338-A340 PolarHBondContact O-N 2.83Å; T338-A342 WeakPolarHBondContact O-CB 3.31Å; T338-A342 PolarHBondContact O-N 2.86Å; T338-T406 HydrophobicContact CG2-CG2 4.22Å; T338-A409 HydrophobicContact CG2-CB 3.44Å; T338-A409 VanDerWaalsContact CG2-CB 3.44Å
339	L	92.8	Very high	90.2	Very high	0 Å²	0	4.1 Å²	4.1	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-62.6	-37.9	169.9	-169.6	66.7	0	0	0	111.8	F274 V278 L281 L306 L310 I313 P335 I337 V343	F274-L339 HydrophobicContact CE2-CD2 3.98Å; F274-L339 HydrophobicContact CZ-CD2 4.17Å; V278-L339 HydrophobicContact CG2-CD2 3.93Å; L281-L339 HydrophobicContact CD1-CD2 3.59Å; L281-L339 HydrophobicContact CD1-CG 3.62Å; L306-L339 HydrophobicContact CD1-CD1 3.62Å; L306-L339 HydrophobicContact CD1-CG 4.27Å; L310-L339 HydrophobicContact CD2-CD1 4.06Å; L310-L339 HydrophobicContact CG-CD1 4.37Å; I313-L339 HydrophobicContact CD1-CB 3.98Å; I313-L339 HydrophobicContact CD1-CD1 4.19Å; P335-L339 WeakPolarHBondContact O-CB 3.16Å; P335-L339 PolarHBondContact O-N 3.02Å; P335-L339 VanDerWaalsContact O-N 3.07Å; I337-L339 VanDerWaalsContact C-N 3.31Å; I337-L339 PolarHBondContact O-N 3.23Å; L339-V343 HydrophobicContact CD1-CG2 4.33Å; L339-V343 WeakPolarHBondContact O-CB 3.5Å; L339-V343 WeakPolarHBondContact O-CG2 3.23Å; L339-V343 PolarHBondContact O-N 2.91Å
340	A	86.9	Confident	90.4	Very high	4 Å²	4	4 Å²	4	3%	0.033	2%	0.023	C	C	.	.	H	α-helix	trans	-65.2	-50.4	177.4	0	0	0	0	0	112	F336 I337 T338 D344 T803 A806	F336-A340 WeakPolarHBondContact O-CB 3.48Å; F336-A340 PolarHBondContact O-N 3.13Å; I337-A340 WeakPolarHBondContact O-CA 3.2Å; I337-A340 VanDerWaalsContact O-CB 3.24Å; I337-A340 WeakPolarHBondContact O-CB 3.4Å; I337-A340 PolarHBondContact O-N 3.35Å; I337-A340 VanDerWaalsContact O-N 3.09Å; T338-A340 VanDerWaalsContact C-N 3.29Å; T338-A340 PolarHBondContact O-N 2.83Å; A340-D344 PolarHBondContact O-N 3.44Å; A340-T803 HydrophobicContact CB-CG2 4Å; A340-A806 HydrophobicContact CB-CB 3.68Å
341	L	88.6	Confident	90.3	Very high	13 Å²	13	4.6 Å²	4.6	7%	0.068	3%	0.028	C	C	.	.	H	α-helix	trans	-59.5	-51.7	177	-75.4	165	0	0	0	111.5	I337 V343 D344 I410 L761	I337-L341 HydrophobicContact CG2-CD1 4.02Å; I337-L341 PolarHBondContact O-N 3.13Å; L341-V343 PolarHBondContact O-N 3.43Å; L341-D344 WeakPolarHBondContact O-CB 3.31Å; L341-D344 PolarHBondContact O-N 2.86Å; L341-I410 HydrophobicContact CD1-CD1 4.15Å; L341-L761 HydrophobicContact CD2-CD2 3.18Å; L341-L761 HydrophobicContact CD2-CG 3.97Å; L341-L761 HydrophobicContact CG-CD2 3.9Å
342	A	89.8	Confident	90.1	Very high	4 Å²	4	4.9 Å²	4.9	3%	0.033	3%	0.031	C	C	.	.	H	α-helix	trans	-66	-34.6	-172.9	0	0	0	0	0	114.3	S309 T338 D344 D413	S309-A342 WeakPolarHBondContact OG-CB 3.31Å; T338-A342 WeakPolarHBondContact O-CB 3.31Å; T338-A342 PolarHBondContact O-N 2.86Å; A342-D344 VanDerWaalsContact C-N 3.32Å; A342-D413 VanDerWaalsContact CA-OD2 3.31Å; A342-D413 WeakPolarHBondContact CA-OD2 3.37Å; A342-D413 HydrophobicContact CB-CB 4.33Å; A342-D413 WeakPolarHBondContact CB-OD1 3.35Å; A342-D413 WeakPolarHBondContact CB-OD2 3.29Å
343	V	89.8	Confident	90	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-77.1	-21.7	179.5	178.2	0	0	0	0	111.2	L281 L285 L306 L339 L341 T346 F347 C802	L281-V343 HydrophobicContact CD1-CG2 4.48Å; L285-V343 HydrophobicContact CD1-CG1 4.4Å; L285-V343 HydrophobicContact CD2-CG1 4.2Å; L306-V343 HydrophobicContact CD1-CG2 3.8Å; L339-V343 HydrophobicContact CD1-CG2 4.33Å; L339-V343 WeakPolarHBondContact O-CB 3.5Å; L339-V343 WeakPolarHBondContact O-CG2 3.23Å; L339-V343 PolarHBondContact O-N 2.91Å; L341-V343 PolarHBondContact O-N 3.43Å; V343-T346 VanDerWaalsContact O-CB 3.27Å; V343-T346 WeakPolarHBondContact O-CB 3.47Å; V343-T346 PolarHBondContact O-N 2.9Å; V343-F347 HydrophobicContact CG1-CD2 4.39Å; V343-F347 HydrophobicContact CG1-CE2 3.86Å; V343-F347 WeakPolarHBondContact O-CD2 3.33Å; V343-F347 PolarHBondContact O-N 3.43Å; V343-C802 VanDerWaalsContact CB-SG 3.57Å; V343-C802 WeakPolarHBondContact CG1-SG 3.25Å
344	D	88.1	Confident	89.8	Confident	3 Å²	3	7.6 Å²	7.6	2%	0.016	4%	0.043	C	C	.	.	H	α-helix	trans	-61	-51.8	173.1	-166.4	-5.9	0	0	0	111.2	A340 L341 A342 T346 F347 I348 G799	A340-D344 PolarHBondContact O-N 3.44Å; L341-D344 WeakPolarHBondContact O-CB 3.31Å; L341-D344 PolarHBondContact O-N 2.86Å; A342-D344 VanDerWaalsContact C-N 3.32Å; D344-T346 PolarHBondContact O-N 2.88Å; D344-F347 WeakPolarHBondContact O-CA 3.34Å; D344-F347 WeakPolarHBondContact O-CB 3.28Å; D344-F347 PolarHBondContact O-N 3.45Å; D344-I348 PolarHBondContact O-N 3.34Å; D344-I348 VanDerWaalsContact O-N 3.14Å; D344-G799 WeakPolarHBondContact OD1-CA 3.17Å
345	D	89.6	Confident	89.3	Confident	10 Å²	10	10.8 Å²	10.8	5%	0.053	6%	0.058	C	C	.	.	H	α-helix	trans	-56.4	-31.1	177.9	-69.8	-29.2	0	0	0	113.1	I348 L349 I377 Q417	D345-I348 PolarHBondContact O-N 3.33Å; D345-L349 WeakPolarHBondContact O-CB 3.47Å; D345-L349 PolarHBondContact O-N 3.3Å; D345-I377 HydrophobicContact CB-CD1 4.33Å; D345-I377 HydrophobicContact CB-CG1 4.47Å; D345-I377 HydrophobicContact CB-CG2 4.4Å; D345-Q417 VanDerWaalsContact CB-CD 3.47Å; D345-Q417 PolarHBondContact OD2-NE2 3.33Å; D345-Q417 PolarHBondContact OD2-OE1 3.18Å
346	T	91.5	Very high	88.9	Confident	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-60.2	-44.9	173.2	-64.4	0	0	0	0	110.9	V343 D344 L350 F421	V343-T346 VanDerWaalsContact O-CB 3.27Å; V343-T346 WeakPolarHBondContact O-CB 3.47Å; V343-T346 PolarHBondContact O-N 2.9Å; D344-T346 PolarHBondContact O-N 2.88Å; T346-L350 HydrophobicContact CG2-CD1 4.04Å; T346-L350 WeakPolarHBondContact O-CB 3.24Å; T346-L350 WeakPolarHBondContact O-CG 3.46Å; T346-L350 PolarHBondContact O-N 3.1Å; T346-F421 HydrophobicContact CG2-CE1 4.02Å; T346-F421 HydrophobicContact CG2-CE2 3.95Å; T346-F421 HydrophobicContact CG2-CZ 3.48Å; T346-F421 VanDerWaalsContact CG2-CZ 3.48Å
347	F	88.5	Confident	88.5	Confident	1 Å²	1	13.6 Å²	13.6	0%	0.004	7%	0.073	C	C	.	.	H	α-helix	trans	-64.9	-43.5	176.4	-71.6	-71.8	0	0	0	111.6	L284 L285 V288 L289 V343 D344 L349 L350 A351 E798 C802	L284-F347 HydrophobicContact CD2-CZ 4.3Å; L285-F347 HydrophobicContact CD2-CE1 3.83Å; L285-F347 HydrophobicContact CD2-CE2 4.03Å; L285-F347 HydrophobicContact CD2-CZ 3.4Å; L285-F347 HydrophobicContact CG-CZ 4.28Å; V288-F347 HydrophobicContact CG1-CE1 4.09Å; L289-F347 HydrophobicContact CD2-CD1 4.3Å; L289-F347 HydrophobicContact CD2-CE1 4.23Å; L289-F347 HydrophobicContact CG-CE1 4.37Å; V343-F347 HydrophobicContact CG1-CD2 4.39Å; V343-F347 HydrophobicContact CG1-CE2 3.86Å; V343-F347 WeakPolarHBondContact O-CD2 3.33Å; V343-F347 PolarHBondContact O-N 3.43Å; D344-F347 WeakPolarHBondContact O-CA 3.34Å; D344-F347 WeakPolarHBondContact O-CB 3.28Å; D344-F347 PolarHBondContact O-N 3.45Å; F347-L349 PolarHBondContact O-N 2.99Å; F347-L350 PolarHBondContact O-N 3.18Å; F347-A351 VanDerWaalsContact O-CB 3.3Å; F347-A351 WeakPolarHBondContact O-CB 3.19Å; F347-A351 PolarHBondContact O-N 2.99Å; F347-E798 HydrophobicContact CD1-CB 4Å; F347-E798 HydrophobicContact CD2-CB 4.46Å; F347-E798 HydrophobicContact CE1-CB 4.28Å; F347-E798 HydrophobicContact CG-CB 4.1Å; F347-C802 HydrophobicContact CE2-CB 3.87Å
348	I	87.8	Confident	88.1	Confident	12 Å²	12	16.4 Å²	16.4	6%	0.062	9%	0.091	C	C	.	.	H	α-helix	trans	-62.6	-46.3	-179	-60	178.5	0	0	0	111	D344 D345 A351 A352 A373 I377 H768	D344-I348 PolarHBondContact O-N 3.34Å; D344-I348 VanDerWaalsContact O-N 3.14Å; D345-I348 PolarHBondContact O-N 3.33Å; I348-A351 PolarHBondContact O-N 3.31Å; I348-A352 PolarHBondContact O-N 3.33Å; I348-A373 HydrophobicContact CG2-CB 4.23Å; I348-I377 HydrophobicContact CG2-CD1 4.4Å; I348-I377 HydrophobicContact CG2-CG1 4.32Å; I348-H768 VanDerWaalsContact CD1-NE2 3.34Å; I348-H768 WeakPolarHBondContact CD1-NE2 3.27Å
349	L	91.1	Very high	87.7	Confident	5 Å²	5	20.5 Å²	20.5	3%	0.026	12%	0.12	C	C	.	.	H	α-helix	trans	-67.3	-38.8	178.2	-169.9	70.2	0	0	0	112	D345 F347 A352 W353 L370 A373 I377 F421 T425	D345-L349 WeakPolarHBondContact O-CB 3.47Å; D345-L349 PolarHBondContact O-N 3.3Å; F347-L349 PolarHBondContact O-N 2.99Å; L349-A352 PolarHBondContact O-N 2.99Å; L349-W353 PolarHBondContact O-N 2.9Å; L349-L370 HydrophobicContact CD1-CD1 4.4Å; L349-A373 HydrophobicContact CD1-CB 4Å; L349-I377 HydrophobicContact CB-CD1 4.39Å; L349-F421 HydrophobicContact CB-CE1 4.02Å; L349-F421 HydrophobicContact CD2-CD1 3.38Å; L349-F421 HydrophobicContact CD2-CE1 3.46Å; L349-F421 VanDerWaalsContact CD2-CE1 3.46Å; L349-F421 HydrophobicContact CG-CE1 4.2Å; L349-T425 HydrophobicContact CD2-CG2 4.44Å
350	L	89.7	Confident	87.5	Confident	2 Å²	2	23.6 Å²	23.6	1%	0.01	14%	0.136	C	C	.	.	H	α-helix	trans	-67.7	-37.1	175.9	-72.3	176.1	0	0	0	112.2	L289 K298 E301 T346 F347 W353 Q354 F421 T425	L289-L350 HydrophobicContact CD1-CD1 3.95Å; L289-L350 HydrophobicContact CD2-CD1 4.05Å; K298-L350 HydrophobicContact CD-CD2 3.94Å; E301-L350 HydrophobicContact CB-CD2 4.09Å; T346-L350 HydrophobicContact CG2-CD1 4.04Å; T346-L350 WeakPolarHBondContact O-CB 3.24Å; T346-L350 WeakPolarHBondContact O-CG 3.46Å; T346-L350 PolarHBondContact O-N 3.1Å; F347-L350 PolarHBondContact O-N 3.18Å; L350-W353 WeakPolarHBondContact O-CB 3.21Å; L350-W353 PolarHBondContact O-N 2.93Å; L350-Q354 WeakPolarHBondContact O-CG 3.43Å; L350-Q354 PolarHBondContact O-N 3.42Å; L350-F421 HydrophobicContact CD1-CZ 4.29Å; L350-F421 HydrophobicContact CD2-CZ 4.08Å; L350-F421 HydrophobicContact CG-CZ 3.93Å; L350-T425 HydrophobicContact CD2-CG2 4.12Å
351	A	85.5	Confident	87.7	Confident	14 Å²	14	26.6 Å²	26.6	12%	0.116	16%	0.156	C	C	.	.	H	α-helix	trans	-62.7	-47.3	174.7	0	0	0	0	0	110.8	F347 I348 W353 Q354 Q355 P795	F347-A351 VanDerWaalsContact O-CB 3.3Å; F347-A351 WeakPolarHBondContact O-CB 3.19Å; F347-A351 PolarHBondContact O-N 2.99Å; I348-A351 PolarHBondContact O-N 3.31Å; A351-W353 VanDerWaalsContact C-N 3.28Å; A351-W353 PolarHBondContact O-N 3.35Å; A351-Q354 PolarHBondContact O-N 3.28Å; A351-Q354 VanDerWaalsContact O-N 3.16Å; A351-Q355 WeakPolarHBondContact O-CG 3.49Å; A351-Q355 PolarHBondContact O-N 3.23Å; A351-P795 HydrophobicContact CB-CB 4.27Å; A351-P795 HydrophobicContact CB-CG 3.56Å
352	A	87.6	Confident	87.8	Confident	6 Å²	6	26.7 Å²	26.7	5%	0.05	16%	0.157	C	C	.	.	H	α-helix	trans	-59.7	-39.1	173.6	0	0	0	0	0	111.8	I348 L349 Q354 Q355 T356 A373	I348-A352 PolarHBondContact O-N 3.33Å; L349-A352 PolarHBondContact O-N 2.99Å; A352-Q354 PolarHBondContact O-N 2.85Å; A352-Q355 PolarHBondContact O-N 3.37Å; A352-T356 PolarHBondContact O-N 3.49Å; A352-A373 HydrophobicContact CB-CB 3.69Å
353	W	89.9	Confident	87.9	Confident	2 Å²	2	28.2 Å²	28.2	1%	0.008	16%	0.164	C	C	.	.	H	α-helix	trans	-59.8	-44.6	173.2	-178.6	-78.1	0	0	0	113.8	L349 L350 A351 Q355 T356 P362 R365 L366 T369 E432	L349-W353 PolarHBondContact O-N 2.9Å; L350-W353 WeakPolarHBondContact O-CB 3.21Å; L350-W353 PolarHBondContact O-N 2.93Å; A351-W353 VanDerWaalsContact C-N 3.28Å; A351-W353 PolarHBondContact O-N 3.35Å; W353-Q355 PolarHBondContact O-N 2.91Å; W353-T356 PolarHBondContact O-N 2.85Å; W353-T356 PolarHBondContact O-OG1 3.33Å; W353-P362 HydrophobicContact CH2-CB 4.38Å; W353-R365 HydrophobicContact CE3-CB 4.38Å; W353-R365 HydrophobicContact CH2-CB 3.58Å; W353-R365 HydrophobicContact CZ2-CB 4.1Å; W353-R365 HydrophobicContact CZ3-CB 3.75Å; W353-R365 PolarHBondContact O-NH2 2.64Å; W353-L366 HydrophobicContact CZ3-CB 3.99Å; W353-T369 HydrophobicContact CB-CG2 3.74Å; W353-T369 HydrophobicContact CD2-CG2 4.24Å; W353-T369 HydrophobicContact CE3-CG2 3.73Å; W353-T369 HydrophobicContact CG-CG2 4.32Å; W353-E432 PolarHBondContact NE1-OE2 3.14Å
354	Q	85.4	Confident	88.1	Confident	61 Å²	61	32.7 Å²	32.7	29%	0.285	18%	0.181	S	C	.	.	H	α-helix	trans	-66.3	-26	179.9	-70.9	-179.8	10.7	0	0	112.7	L350 A351 A352 R475	L350-Q354 WeakPolarHBondContact O-CG 3.43Å; L350-Q354 PolarHBondContact O-N 3.42Å; A351-Q354 PolarHBondContact O-N 3.28Å; A351-Q354 VanDerWaalsContact O-N 3.16Å; A352-Q354 PolarHBondContact O-N 2.85Å; Q354-R475 PolarHBondContact O-NH1 2.96Å
355	Q	82.3	Confident	88.4	Confident	67 Å²	67	32.8 Å²	32.8	31%	0.313	18%	0.181	S	C	.	.	H	α-helix	trans	-76.8	-23.5	177	-66.3	172.2	28.2	0	0	113.1	A351 A352 W353 L791	A351-Q355 WeakPolarHBondContact O-CG 3.49Å; A351-Q355 PolarHBondContact O-N 3.23Å; A352-Q355 PolarHBondContact O-N 3.37Å; W353-Q355 PolarHBondContact O-N 2.91Å; Q355-L791 HydrophobicContact CG-CD2 4.25Å; Q355-L791 PolarHBondContact NE2-O 3.46Å
356	T	86.9	Confident	88.6	Confident	11 Å²	11	32.3 Å²	32.3	7%	0.067	18%	0.178	C	C	.	.	S	Bend	trans	-63.6	149.5	176.2	64.3	0	0	0	0	112.6	A352 W353 P358 R365 L368 T369	A352-T356 PolarHBondContact O-N 3.49Å; W353-T356 PolarHBondContact O-N 2.85Å; W353-T356 PolarHBondContact O-OG1 3.33Å; T356-P358 VanDerWaalsContact O-CD 3.26Å; T356-P358 WeakPolarHBondContact O-CD 3.32Å; T356-R365 PolarHBondContact OG1-NE 3.41Å; T356-R365 PolarHBondContact OG1-NH2 2.96Å; T356-L368 HydrophobicContact CG2-CB 4.1Å; T356-T369 HydrophobicContact CG2-CG2 3.51Å
357	N	84.8	Confident	88.7	Confident	64 Å²	64	32.3 Å²	32.3	34%	0.342	18%	0.178	S	C	.	.			trans	-66	119.6	177.5	-174.9	-7.7	0	0	0	110.7	S359 L360	N357-S359 PolarHBondContact ND2-OG 3.07Å; N357-S359 PolarHBondContact O-N 3.06Å; N357-S359 VanDerWaalsContact O-N 3.1Å; N357-S359 PolarHBondContact OD1-N 2.7Å; N357-S359 VanDerWaalsContact OD1-N 3.07Å; N357-S359 PolarHBondContact OD1-OG 3.19Å; N357-S359 VanDerWaalsContact OD1-OG 3.04Å; N357-L360 HydrophobicContact CB-CD1 4.12Å; N357-L360 HydrophobicContact CB-CG 4.19Å; N357-L360 PolarHBondContact O-N 2.95Å
358	P	81.8	Confident	88.9	Confident	61 Å²	61	34.6 Å²	34.6	40%	0.396	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-17.6	179.9	-23.1	34.3	0	0	0	114.8	T356 L360	T356-P358 VanDerWaalsContact O-CD 3.26Å; T356-P358 WeakPolarHBondContact O-CD 3.32Å; P358-L360 VanDerWaalsContact C-N 3.28Å; P358-L360 PolarHBondContact O-N 3.39Å
359	S	82.5	Confident	89.1	Confident	91 Å²	91	34 Å²	34	64%	0.636	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-13.2	179	71.6	0	0	0	0	114	N357	N357-S359 PolarHBondContact ND2-OG 3.07Å; N357-S359 PolarHBondContact O-N 3.06Å; N357-S359 VanDerWaalsContact O-N 3.1Å; N357-S359 PolarHBondContact OD1-N 2.7Å; N357-S359 VanDerWaalsContact OD1-N 3.07Å; N357-S359 PolarHBondContact OD1-OG 3.19Å; N357-S359 VanDerWaalsContact OD1-OG 3.04Å
360	L	89.2	Confident	89.2	Confident	65 Å²	65	34 Å²	34	34%	0.34	19%	0.187	S	C	.	.	S	Bend	trans	-79.3	153.9	179	-64.6	174.5	0	0	0	111.1	N357 P358 R365 L368	N357-L360 HydrophobicContact CB-CD1 4.12Å; N357-L360 HydrophobicContact CB-CG 4.19Å; N357-L360 PolarHBondContact O-N 2.95Å; P358-L360 VanDerWaalsContact C-N 3.28Å; P358-L360 PolarHBondContact O-N 3.39Å; L360-R365 HydrophobicContact CB-CG 3.8Å; L360-L368 HydrophobicContact CD1-CD1 3.6Å
361	C	91.5	Very high	89.3	Confident	66 Å²	66	36.4 Å²	36.4	45%	0.446	20%	0.197	S	C	.	.			trans	-61	143.9	173.6	60.1	0	0	0	0	110.8	E363 R364 R365	C361-E363 WeakPolarHBondContact CB-OE2 3.05Å; C361-E363 PolarHBondContact O-N 3.41Å; C361-E363 VanDerWaalsContact O-N 3.1Å; C361-R364 PolarHBondContact O-N 2.71Å; C361-R364 VanDerWaalsContact O-N 3.07Å; C361-R364 WeakPolarHBondContact SG-CB 3.24Å; C361-R365 WeakPolarHBondContact O-CG 3.49Å; C361-R365 PolarHBondContact O-N 2.93Å
362	P	90.4	Very high	89.3	Confident	15 Å²	15	38.2 Å²	38.2	10%	0.097	20%	0.204	C	C	.	.	H	α-helix	trans	-53.8	-32.9	-178.2	-28.8	36.8	0	0	0	114	W353 R365 L366 V426 R430 A433	W353-P362 HydrophobicContact CH2-CB 4.38Å; P362-R365 PolarHBondContact O-N 3.39Å; P362-L366 PolarHBondContact O-N 3.42Å; P362-V426 HydrophobicContact CB-CG1 4.38Å; P362-R430 HydrophobicContact CB-CG 4Å; P362-R430 HydrophobicContact CG-CG 3.87Å; P362-A433 HydrophobicContact CG-CB 4.27Å
363	E	92.3	Very high	89.3	Confident	37 Å²	37	38.1 Å²	38.1	17%	0.173	20%	0.203	C	C	.	.	H	α-helix	trans	-66.2	-46.4	178.7	-59.7	74.6	-160.6	0	0	111.5	R38 C361 R365 L366 G367 R430	R38-E363 HydrophobicContact CG-CG 4.24Å; C361-E363 WeakPolarHBondContact CB-OE2 3.05Å; C361-E363 PolarHBondContact O-N 3.41Å; C361-E363 VanDerWaalsContact O-N 3.1Å; E363-R365 VanDerWaalsContact C-N 3.34Å; E363-L366 PolarHBondContact O-N 2.91Å; E363-G367 PolarHBondContact O-N 2.83Å; E363-G367 VanDerWaalsContact O-N 3.12Å; E363-R430 IonicContact OE1-CZ 2.95Å; E363-R430 IonicContact OE1-NE 3.32Å; E363-R430 PolarHBondContact OE1-NE 2.91Å; E363-R430 IonicContact OE1-NH2 2.64Å; E363-R430 PolarHBondContact OE1-NH2 3.06Å
364	R	93.8	Very high	89.3	Confident	94 Å²	94	38 Å²	38	36%	0.355	20%	0.203	S	C	.	.	H	α-helix	trans	-70.5	-33.2	176.8	-176.5	60.2	171.4	-164.8	-4	111.4	Q30 E34 C361 G367 L368	Q30-R364 VanDerWaalsContact NE2-NH2 3.15Å; E34-R364 WeakPolarHBondContact OE1-CD 3.45Å; E34-R364 IonicContact OE1-CZ 2.73Å; E34-R364 IonicContact OE1-NE 3.33Å; E34-R364 IonicContact OE1-NH1 2.93Å; E34-R364 PolarHBondContact OE1-NH1 2.88Å; C361-R364 PolarHBondContact O-N 2.71Å; C361-R364 VanDerWaalsContact O-N 3.07Å; C361-R364 WeakPolarHBondContact SG-CB 3.24Å; R364-G367 PolarHBondContact O-N 3.19Å; R364-L368 HydrophobicContact CG-CD1 4.47Å; R364-L368 WeakPolarHBondContact O-CG 3.38Å; R364-L368 PolarHBondContact O-N 3.3Å
365	R	93.5	Very high	89.4	Confident	4 Å²	4	35.2 Å²	35.2	2%	0.015	19%	0.19	C	C	.	.	H	α-helix	trans	-58.5	-51.3	172.4	-70.8	-179.9	67.5	-176	3.5	110.1	W353 T356 L360 C361 P362 E363 G367 L368 T369 E432	W353-R365 HydrophobicContact CE3-CB 4.38Å; W353-R365 HydrophobicContact CH2-CB 3.58Å; W353-R365 HydrophobicContact CZ2-CB 4.1Å; W353-R365 HydrophobicContact CZ3-CB 3.75Å; W353-R365 PolarHBondContact O-NH2 2.64Å; T356-R365 PolarHBondContact OG1-NE 3.41Å; T356-R365 PolarHBondContact OG1-NH2 2.96Å; L360-R365 HydrophobicContact CB-CG 3.8Å; C361-R365 WeakPolarHBondContact O-CG 3.49Å; C361-R365 PolarHBondContact O-N 2.93Å; P362-R365 PolarHBondContact O-N 3.39Å; E363-R365 VanDerWaalsContact C-N 3.34Å; R365-G367 VanDerWaalsContact C-N 3.3Å; R365-G367 PolarHBondContact O-N 2.76Å; R365-L368 PolarHBondContact O-N 2.77Å; R365-T369 WeakPolarHBondContact O-CG2 3.13Å; R365-T369 PolarHBondContact O-N 3.45Å; R365-E432 IonicContact CZ-OE1 2.79Å; R365-E432 IonicContact NH1-OE1 3.43Å; R365-E432 PolarHBondContact NH1-OE1 3.28Å; R365-E432 IonicContact NH1-OE2 3.61Å; R365-E432 IonicContact NH2-OE1 3.19Å; R365-E432 PolarHBondContact NH2-OE1 2.91Å; R365-E432 IonicContact NH2-OE2 2.63Å
366	L	94.7	Very high	89.6	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-59	-40.9	177.3	-175.5	67.3	0	0	0	112.4	G33 V36 W353 P362 E363 L368 T369 L370 C422 V426	G33-L366 WeakPolarHBondContact O-CD2 3.39Å; V36-L366 HydrophobicContact CB-CD2 4.13Å; V36-L366 HydrophobicContact CG1-CD2 4.1Å; W353-L366 HydrophobicContact CZ3-CB 3.99Å; P362-L366 PolarHBondContact O-N 3.42Å; E363-L366 PolarHBondContact O-N 2.91Å; L366-L368 VanDerWaalsContact C-N 3.29Å; L366-L368 PolarHBondContact O-N 3.28Å; L366-T369 WeakPolarHBondContact CA-OG1 3.49Å; L366-T369 PolarHBondContact O-N 2.95Å; L366-T369 PolarHBondContact O-OG1 3.34Å; L366-L370 WeakPolarHBondContact O-CB 3.26Å; L366-L370 PolarHBondContact O-N 3.48Å; L366-C422 HydrophobicContact CD1-CB 4.19Å; L366-C422 HydrophobicContact CD2-CB 4.02Å; L366-V426 HydrophobicContact CB-CG2 3.5Å; L366-V426 HydrophobicContact CD1-CG2 4.22Å; L366-V426 HydrophobicContact CD2-CG2 3.25Å; L366-V426 HydrophobicContact CG-CG2 3.8Å
367	G	94.2	Very high	89.8	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-57.6	-43	174.4	0	0	0	0	0	112.4	Q30 E363 R364 R365 K371	Q30-G367 WeakPolarHBondContact CA-O 3.44Å; Q30-G367 WeakPolarHBondContact O-CA 3.42Å; E363-G367 PolarHBondContact O-N 2.83Å; E363-G367 VanDerWaalsContact O-N 3.12Å; R364-G367 PolarHBondContact O-N 3.19Å; R365-G367 VanDerWaalsContact C-N 3.3Å; R365-G367 PolarHBondContact O-N 2.76Å; G367-K371 WeakPolarHBondContact O-CB 3.44Å; G367-K371 PolarHBondContact O-N 2.95Å
368	L	92.2	Very high	90.1	Very high	50 Å²	50	29.7 Å²	29.7	26%	0.262	16%	0.163	S	C	.	.	H	α-helix	trans	-71.3	-36.9	177.5	-67.6	173.3	0	0	0	112.8	T356 L360 R364 R365 L366 K371 E372	T356-L368 HydrophobicContact CG2-CB 4.1Å; L360-L368 HydrophobicContact CD1-CD1 3.6Å; R364-L368 HydrophobicContact CG-CD1 4.47Å; R364-L368 WeakPolarHBondContact O-CG 3.38Å; R364-L368 PolarHBondContact O-N 3.3Å; R365-L368 PolarHBondContact O-N 2.77Å; L366-L368 VanDerWaalsContact C-N 3.29Å; L366-L368 PolarHBondContact O-N 3.28Å; L368-K371 WeakPolarHBondContact O-CB 3.1Å; L368-K371 PolarHBondContact O-N 3.23Å; L368-E372 PolarHBondContact O-N 2.68Å
369	T	92.7	Very high	90.3	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65.1	-44.4	176.5	57.6	0	0	0	0	111.8	W353 T356 R365 L366 K371 E372 A373	W353-T369 HydrophobicContact CB-CG2 3.74Å; W353-T369 HydrophobicContact CD2-CG2 4.24Å; W353-T369 HydrophobicContact CE3-CG2 3.73Å; W353-T369 HydrophobicContact CG-CG2 4.32Å; T356-T369 HydrophobicContact CG2-CG2 3.51Å; R365-T369 WeakPolarHBondContact O-CG2 3.13Å; R365-T369 PolarHBondContact O-N 3.45Å; L366-T369 WeakPolarHBondContact CA-OG1 3.49Å; L366-T369 PolarHBondContact O-N 2.95Å; L366-T369 PolarHBondContact O-OG1 3.34Å; T369-K371 VanDerWaalsContact C-N 3.31Å; T369-E372 PolarHBondContact O-N 3.35Å; T369-A373 WeakPolarHBondContact O-CB 3.31Å; T369-A373 PolarHBondContact O-N 2.93Å
370	L	93.4	Very high	90.6	Very high	3 Å²	3	23 Å²	23	2%	0.016	12%	0.116	C	C	.	.	I	π-helix	trans	-73	-29.1	-178.2	-163.6	64.8	0	0	0	111.5	F29 Y32 L349 L366 E372 G374 L418	F29-L370 HydrophobicContact CB-CB 4.33Å; F29-L370 HydrophobicContact CB-CD2 4.18Å; F29-L370 HydrophobicContact CB-CG 3.84Å; F29-L370 WeakPolarHBondContact CB-O 3.29Å; F29-L370 HydrophobicContact CD1-CD1 4.26Å; F29-L370 HydrophobicContact CD1-CD2 3.6Å; F29-L370 HydrophobicContact CD1-CG 3.62Å; F29-L370 HydrophobicContact CE1-CD2 4.45Å; F29-L370 HydrophobicContact CE1-CG 4.45Å; F29-L370 HydrophobicContact CG-CD2 4.27Å; F29-L370 HydrophobicContact CG-CG 3.92Å; Y32-L370 HydrophobicContact CD1-CD2 3.64Å; Y32-L370 HydrophobicContact CE1-CD2 4.35Å; L349-L370 HydrophobicContact CD1-CD1 4.4Å; L366-L370 WeakPolarHBondContact O-CB 3.26Å; L366-L370 PolarHBondContact O-N 3.48Å; L370-E372 VanDerWaalsContact C-N 3.31Å; L370-E372 PolarHBondContact O-N 3.45Å; L370-G374 WeakPolarHBondContact O-CA 3.4Å; L370-G374 PolarHBondContact O-N 3.01Å; L370-L418 HydrophobicContact CD1-CD2 3.73Å; L370-L418 HydrophobicContact CD2-CD2 4.26Å
371	K	90.8	Very high	90.8	Very high	53 Å²	53	20.3 Å²	20.3	23%	0.23	10%	0.103	C	C	.	.	I	π-helix	trans	-56.7	-46.6	168.7	-173.4	-180	-174.6	159.3	0	111.6	E26 Q30 G367 L368 T369	E26-K371 HydrophobicContact CB-CG 3.76Å; E26-K371 HydrophobicContact CG-CG 4.12Å; E26-K371 WeakPolarHBondContact CG-O 3.45Å; E26-K371 WeakPolarHBondContact OE2-CE 3.39Å; Q30-K371 HydrophobicContact CB-CB 4.22Å; Q30-K371 HydrophobicContact CB-CD 4.48Å; G367-K371 WeakPolarHBondContact O-CB 3.44Å; G367-K371 PolarHBondContact O-N 2.95Å; L368-K371 WeakPolarHBondContact O-CB 3.1Å; L368-K371 PolarHBondContact O-N 3.23Å; T369-K371 VanDerWaalsContact C-N 3.31Å
372	E	85	Confident	90.7	Very high	52 Å²	52	20.7 Å²	20.7	24%	0.243	10%	0.099	C	C	.	.	I	π-helix	trans	-82.3	-58.8	-175.9	-173.4	168.2	-169	0	0	112.4	L368 T369 L370 T375 Y771 H772	L368-E372 PolarHBondContact O-N 2.68Å; T369-E372 PolarHBondContact O-N 3.35Å; L370-E372 VanDerWaalsContact C-N 3.31Å; L370-E372 PolarHBondContact O-N 3.45Å; E372-T375 PolarHBondContact O-OG1 3.07Å; E372-Y771 HydrophobicContact CG-CE1 4.18Å; E372-H772 IonicContact OE1-CE1 3.06Å; E372-H772 PolarHBondContact OE1-CE1 2.96Å; E372-H772 IonicContact OE1-ND1 3.98Å; E372-H772 PolarHBondContact OE1-ND1 2.96Å
373	A	88.4	Confident	90.7	Very high	4 Å²	4	20 Å²	20	3%	0.033	9%	0.094	C	C	.	.	I	π-helix	trans	-78.8	-34.6	-176.6	0	0	0	0	0	113.3	I348 L349 A352 T369 T375 A376 I377	I348-A373 HydrophobicContact CG2-CB 4.23Å; L349-A373 HydrophobicContact CD1-CB 4Å; A352-A373 HydrophobicContact CB-CB 3.69Å; T369-A373 WeakPolarHBondContact O-CB 3.31Å; T369-A373 PolarHBondContact O-N 2.93Å; A373-T375 VanDerWaalsContact C-N 3.28Å; A373-T375 PolarHBondContact O-N 3.34Å; A373-A376 PolarHBondContact O-N 2.75Å; A373-I377 HydrophobicContact CB-CD1 4.19Å; A373-I377 VanDerWaalsContact O-CG1 3.29Å; A373-I377 WeakPolarHBondContact O-CG1 3.37Å; A373-I377 PolarHBondContact O-N 2.74Å
374	G	90.8	Very high	90.6	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.01	9%	0.088	C	C	.	.	I	π-helix	trans	-62.8	-34.7	-174.4	0	0	0	0	0	112.7	L370 T378	L370-G374 WeakPolarHBondContact O-CA 3.4Å; L370-G374 PolarHBondContact O-N 3.01Å; G374-T378 WeakPolarHBondContact O-CB 3.37Å; G374-T378 PolarHBondContact O-N 3.29Å; G374-T378 PolarHBondContact O-OG1 3.41Å
375	T	87.4	Confident	90.6	Very high	2 Å²	2	15.7 Å²	15.7	1%	0.012	8%	0.079	C	C	.	.	H	α-helix	trans	-67.4	-46.2	174.4	54.4	0	0	0	0	112.6	L25 E26 F29 E372 A373 T378 I379	L25-T375 HydrophobicContact CB-CG2 4.32Å; L25-T375 HydrophobicContact CD2-CG2 3.99Å; L25-T375 HydrophobicContact CG-CG2 4.03Å; E26-T375 HydrophobicContact CB-CG2 4.35Å; E26-T375 HydrophobicContact CG-CG2 3.37Å; F29-T375 HydrophobicContact CD2-CG2 3.85Å; F29-T375 HydrophobicContact CE2-CG2 4.15Å; E372-T375 PolarHBondContact O-OG1 3.07Å; A373-T375 VanDerWaalsContact C-N 3.28Å; A373-T375 PolarHBondContact O-N 3.34Å; T375-T378 WeakPolarHBondContact O-CB 3.19Å; T375-T378 PolarHBondContact O-N 3.46Å; T375-I379 VanDerWaalsContact O-CG1 3.28Å; T375-I379 WeakPolarHBondContact O-CG1 3.46Å; T375-I379 PolarHBondContact O-N 2.95Å
376	A	85.9	Confident	90.5	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-61.9	-46.5	178.1	0	0	0	0	0	111.7	A373 T378 I379 T380 H768	A373-A376 PolarHBondContact O-N 2.75Å; A376-T378 VanDerWaalsContact C-N 3.29Å; A376-T378 PolarHBondContact O-N 3.41Å; A376-I379 WeakPolarHBondContact O-CB 3.04Å; A376-I379 PolarHBondContact O-N 2.87Å; A376-I379 VanDerWaalsContact O-N 3.07Å; A376-T380 PolarHBondContact O-N 2.89Å; A376-H768 WeakPolarHBondContact CB-CE1 3.46Å
377	I	90.1	Very high	90.2	Very high	6 Å²	6	19.5 Å²	19.5	3%	0.031	10%	0.096	C	C	.	.	H	α-helix	trans	-60.6	-36.7	175.6	-64.6	166	0	0	0	111.6	D345 I348 L349 A373 I379 T380 V381 Y414	D345-I377 HydrophobicContact CB-CD1 4.33Å; D345-I377 HydrophobicContact CB-CG1 4.47Å; D345-I377 HydrophobicContact CB-CG2 4.4Å; I348-I377 HydrophobicContact CG2-CD1 4.4Å; I348-I377 HydrophobicContact CG2-CG1 4.32Å; L349-I377 HydrophobicContact CB-CD1 4.39Å; A373-I377 HydrophobicContact CB-CD1 4.19Å; A373-I377 VanDerWaalsContact O-CG1 3.29Å; A373-I377 WeakPolarHBondContact O-CG1 3.37Å; A373-I377 PolarHBondContact O-N 2.74Å; I377-I379 VanDerWaalsContact C-N 3.26Å; I377-I379 PolarHBondContact O-N 3.5Å; I377-T380 WeakPolarHBondContact CA-OG1 3.26Å; I377-T380 PolarHBondContact O-N 3.15Å; I377-T380 PolarHBondContact O-OG1 2.91Å; I377-V381 HydrophobicContact CG2-CG2 4.19Å; I377-V381 WeakPolarHBondContact O-CB 3.29Å; I377-V381 VanDerWaalsContact O-CG2 3.29Å; I377-V381 WeakPolarHBondContact O-CG2 3.31Å; I377-V381 PolarHBondContact O-N 3.1Å; I377-Y414 HydrophobicContact CG2-CD2 4.4Å
378	T	91.2	Very high	90.1	Very high	20 Å²	20	19.6 Å²	19.6	12%	0.123	10%	0.097	C	C	.	.	H	α-helix	trans	-64	-36.7	176.8	-57.5	0	0	0	0	111.5	L25 F29 G374 T375 A376 M382 Y414	L25-T378 HydrophobicContact CD2-CG2 4.27Å; F29-T378 WeakPolarHBondContact CE2-OG1 3.2Å; F29-T378 WeakPolarHBondContact CZ-OG1 3.48Å; G374-T378 WeakPolarHBondContact O-CB 3.37Å; G374-T378 PolarHBondContact O-N 3.29Å; G374-T378 PolarHBondContact O-OG1 3.41Å; T375-T378 WeakPolarHBondContact O-CB 3.19Å; T375-T378 PolarHBondContact O-N 3.46Å; A376-T378 VanDerWaalsContact C-N 3.29Å; A376-T378 PolarHBondContact O-N 3.41Å; T378-M382 WeakPolarHBondContact O-CB 3.16Å; T378-M382 PolarHBondContact O-N 2.88Å; T378-Y414 PolarHBondContact OG1-OH 3.38Å
379	I	87.3	Confident	90.2	Very high	8 Å²	8	19.4 Å²	19.4	4%	0.041	10%	0.098	C	C	.	.	H	α-helix	trans	-68.2	-46.4	-179.4	-57.5	164.2	0	0	0	110	T375 A376 I377 M382 T383 V711 F715 I767	T375-I379 VanDerWaalsContact O-CG1 3.28Å; T375-I379 WeakPolarHBondContact O-CG1 3.46Å; T375-I379 PolarHBondContact O-N 2.95Å; A376-I379 WeakPolarHBondContact O-CB 3.04Å; A376-I379 PolarHBondContact O-N 2.87Å; A376-I379 VanDerWaalsContact O-N 3.07Å; I377-I379 VanDerWaalsContact C-N 3.26Å; I377-I379 PolarHBondContact O-N 3.5Å; I379-M382 PolarHBondContact O-N 3.44Å; I379-T383 PolarHBondContact O-N 3.19Å; I379-T383 PolarHBondContact O-OG1 3.41Å; I379-T383 VanDerWaalsContact O-OG1 3.12Å; I379-V711 HydrophobicContact CG2-CG1 3.71Å; I379-F715 HydrophobicContact CD1-CB 3.56Å; I379-F715 HydrophobicContact CD1-CD1 3.48Å; I379-F715 VanDerWaalsContact CD1-CD1 3.48Å; I379-F715 HydrophobicContact CD1-CD2 4.17Å; I379-F715 HydrophobicContact CD1-CE1 4.1Å; I379-F715 HydrophobicContact CD1-CG 3.5Å; I379-F715 VanDerWaalsContact CD1-CG 3.5Å; I379-F715 HydrophobicContact CG1-CB 4.05Å; I379-F715 HydrophobicContact CG1-CD1 3.42Å; I379-F715 VanDerWaalsContact CG1-CD1 3.42Å; I379-F715 HydrophobicContact CG1-CD2 3.65Å; I379-F715 HydrophobicContact CG1-CE1 3.55Å; I379-F715 HydrophobicContact CG1-CE2 3.8Å; I379-F715 HydrophobicContact CG1-CG 3.45Å; I379-F715 VanDerWaalsContact CG1-CG 3.45Å; I379-F715 HydrophobicContact CG1-CZ 3.73Å; I379-F715 HydrophobicContact CG2-CD2 4.2Å; I379-I767 HydrophobicContact CB-CD1 4.2Å; I379-I767 HydrophobicContact CB-CG2 4.39Å; I379-I767 HydrophobicContact CD1-CG2 4.03Å; I379-I767 HydrophobicContact CG2-CD1 3.31Å; I379-I767 HydrophobicContact CG2-CG2 4.41Å
380	T	88.5	Confident	90.1	Very high	3 Å²	3	20.6 Å²	20.6	2%	0.018	10%	0.104	C	C	.	.	H	α-helix	trans	-62.5	-48.9	180	55.9	0	0	0	0	111.4	A376 I377 M382 T383 D384 D764	A376-T380 PolarHBondContact O-N 2.89Å; I377-T380 WeakPolarHBondContact CA-OG1 3.26Å; I377-T380 PolarHBondContact O-N 3.15Å; I377-T380 PolarHBondContact O-OG1 2.91Å; T380-M382 VanDerWaalsContact C-N 3.29Å; T380-M382 PolarHBondContact O-N 3.39Å; T380-T383 WeakPolarHBondContact CA-OG1 3.47Å; T380-T383 PolarHBondContact O-N 2.88Å; T380-T383 PolarHBondContact O-OG1 3.04Å; T380-D384 WeakPolarHBondContact O-CB 3.32Å; T380-D384 PolarHBondContact O-N 3.4Å; T380-D764 WeakPolarHBondContact CB-OD1 3.35Å; T380-D764 HydrophobicContact CG2-CB 4.42Å; T380-D764 WeakPolarHBondContact CG2-OD1 3.13Å
381	V	92.4	Very high	89.9	Confident	9 Å²	9	20.5 Å²	20.5	6%	0.055	10%	0.103	C	C	.	.	H	α-helix	trans	-58.5	-41.2	174.4	167.6	0	0	0	0	111.7	I377 D384 I385 I410 Y414	I377-V381 HydrophobicContact CG2-CG2 4.19Å; I377-V381 WeakPolarHBondContact O-CB 3.29Å; I377-V381 VanDerWaalsContact O-CG2 3.29Å; I377-V381 WeakPolarHBondContact O-CG2 3.31Å; I377-V381 PolarHBondContact O-N 3.1Å; V381-D384 PolarHBondContact O-N 3.38Å; V381-I385 HydrophobicContact CG1-CD1 3.63Å; V381-I385 HydrophobicContact CG1-CG1 4.3Å; V381-I385 WeakPolarHBondContact O-CB 3.3Å; V381-I385 WeakPolarHBondContact O-CG1 3.2Å; V381-I385 PolarHBondContact O-N 2.84Å; V381-I410 HydrophobicContact CG1-CG2 3.99Å; V381-Y414 HydrophobicContact CB-CD2 4.19Å; V381-Y414 HydrophobicContact CB-CG 4.45Å; V381-Y414 HydrophobicContact CG1-CD1 4.32Å; V381-Y414 HydrophobicContact CG1-CD2 4.05Å; V381-Y414 HydrophobicContact CG1-CG 3.81Å; V381-Y414 HydrophobicContact CG2-CD2 3.84Å; V381-Y414 HydrophobicContact CG2-CG 4.27Å
382	M	90.9	Very high	89.9	Confident	73 Å²	73	19.2 Å²	19.2	36%	0.36	10%	0.1	S	C	.	.	H	α-helix	trans	-67.4	-41.5	179.2	-174.4	171.5	-173.6	0	0	111.6	T378 I379 T380 F386 V711 F715	T378-M382 WeakPolarHBondContact O-CB 3.16Å; T378-M382 PolarHBondContact O-N 2.88Å; I379-M382 PolarHBondContact O-N 3.44Å; T380-M382 VanDerWaalsContact C-N 3.29Å; T380-M382 PolarHBondContact O-N 3.39Å; M382-F386 HydrophobicContact CE-CE2 3.43Å; M382-F386 VanDerWaalsContact CE-CE2 3.43Å; M382-F386 HydrophobicContact CE-CZ 3.9Å; M382-F386 HydrophobicContact CG-CD2 3.74Å; M382-F386 HydrophobicContact CG-CE2 3.36Å; M382-F386 HydrophobicContact CG-CZ 4.38Å; M382-F386 WeakPolarHBondContact O-CD2 3.21Å; M382-F386 PolarHBondContact O-N 3.03Å; M382-F386 HydrophobicContact SD-CE2 4.17Å; M382-V711 HydrophobicContact CB-CG1 4.46Å; M382-V711 HydrophobicContact CE-CG2 4.37Å; M382-V711 HydrophobicContact CG-CG1 4.28Å; M382-V711 HydrophobicContact CG-CG2 4.03Å; M382-V711 HydrophobicContact SD-CG1 4.29Å; M382-V711 HydrophobicContact SD-CG2 4.34Å; M382-F715 HydrophobicContact SD-CE2 4.14Å
383	T	89.4	Confident	90.1	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.006	12%	0.123	C	C	.	.	H	α-helix	trans	-64.7	-42.3	175.1	45.7	0	0	0	0	111.9	I379 T380 F386 S387 M708 V711 V763	I379-T383 PolarHBondContact O-N 3.19Å; I379-T383 PolarHBondContact O-OG1 3.41Å; I379-T383 VanDerWaalsContact O-OG1 3.12Å; T380-T383 WeakPolarHBondContact CA-OG1 3.47Å; T380-T383 PolarHBondContact O-N 2.88Å; T380-T383 PolarHBondContact O-OG1 3.04Å; T383-F386 PolarHBondContact O-N 2.87Å; T383-S387 WeakPolarHBondContact O-CB 3.49Å; T383-S387 PolarHBondContact O-N 3.24Å; T383-S387 PolarHBondContact O-OG 2.88Å; T383-M708 HydrophobicContact CG2-CG 4.39Å; T383-V711 HydrophobicContact CG2-CB 3.87Å; T383-V711 HydrophobicContact CG2-CG1 3.62Å; T383-V711 HydrophobicContact CG2-CG2 4.37Å; T383-V763 HydrophobicContact CG2-CG1 4.1Å; T383-V763 HydrophobicContact CG2-CG2 4.4Å; T383-V763 WeakPolarHBondContact OG1-CG1 3.13Å
384	D	90.7	Very high	90.1	Very high	7 Å²	7	25.1 Å²	25.1	4%	0.037	13%	0.126	C	C	.	.	H	α-helix	trans	-64	-49.9	177.9	-76	-5.5	0	0	0	111.3	T380 V381 F386 S387 F388 I410 G760	T380-D384 WeakPolarHBondContact O-CB 3.32Å; T380-D384 PolarHBondContact O-N 3.4Å; V381-D384 PolarHBondContact O-N 3.38Å; D384-F386 VanDerWaalsContact C-N 3.32Å; D384-F386 PolarHBondContact O-N 3.3Å; D384-S387 PolarHBondContact O-N 3.44Å; D384-S387 PolarHBondContact O-OG 3.38Å; D384-F388 WeakPolarHBondContact O-CD2 3.37Å; D384-F388 PolarHBondContact O-N 2.57Å; D384-I410 HydrophobicContact CB-CD1 3.89Å; D384-I410 HydrophobicContact CB-CG2 4.5Å; D384-G760 WeakPolarHBondContact OD1-CA 3.41Å
385	I	93.2	Very high	89.8	Confident	34 Å²	34	26.6 Å²	26.6	17%	0.174	14%	0.136	C	C	.	.	H	α-helix	trans	-56.9	-47.5	177.5	-72.4	171.9	0	0	0	110.2	V381 S387 F388 V389 V407 I410 L411	V381-I385 HydrophobicContact CG1-CD1 3.63Å; V381-I385 HydrophobicContact CG1-CG1 4.3Å; V381-I385 WeakPolarHBondContact O-CB 3.3Å; V381-I385 WeakPolarHBondContact O-CG1 3.2Å; V381-I385 PolarHBondContact O-N 2.84Å; I385-S387 PolarHBondContact O-N 2.92Å; I385-F388 PolarHBondContact O-N 3.34Å; I385-V389 HydrophobicContact CG2-CG2 3.94Å; I385-V389 WeakPolarHBondContact O-CB 3.36Å; I385-V389 WeakPolarHBondContact O-CG2 3.39Å; I385-V389 PolarHBondContact O-N 3.39Å; I385-V407 HydrophobicContact CG2-CG1 4.39Å; I385-I410 HydrophobicContact CD1-CG2 4.27Å; I385-I410 HydrophobicContact CG1-CB 4.44Å; I385-I410 HydrophobicContact CG1-CG2 3.82Å; I385-L411 HydrophobicContact CD1-CD1 4.3Å
386	F	91.2	Very high	89.9	Confident	81 Å²	81	26.6 Å²	26.6	36%	0.355	14%	0.136	S	C	.	.	H	α-helix	trans	-64.6	-41.5	179	-75.9	-54.2	0	0	0	112.8	M382 T383 D384 F388 V389 I390 C707 V711	M382-F386 HydrophobicContact CE-CE2 3.43Å; M382-F386 VanDerWaalsContact CE-CE2 3.43Å; M382-F386 HydrophobicContact CE-CZ 3.9Å; M382-F386 HydrophobicContact CG-CD2 3.74Å; M382-F386 HydrophobicContact CG-CE2 3.36Å; M382-F386 HydrophobicContact CG-CZ 4.38Å; M382-F386 WeakPolarHBondContact O-CD2 3.21Å; M382-F386 PolarHBondContact O-N 3.03Å; M382-F386 HydrophobicContact SD-CE2 4.17Å; T383-F386 PolarHBondContact O-N 2.87Å; D384-F386 VanDerWaalsContact C-N 3.32Å; D384-F386 PolarHBondContact O-N 3.3Å; F386-F388 PolarHBondContact O-N 3.18Å; F386-V389 PolarHBondContact O-N 2.95Å; F386-I390 VanDerWaalsContact O-CD1 3.29Å; F386-I390 WeakPolarHBondContact O-CD1 3.5Å; F386-I390 VanDerWaalsContact O-CG1 3.27Å; F386-I390 WeakPolarHBondContact O-CG1 3.43Å; F386-I390 PolarHBondContact O-N 2.97Å; F386-I390 VanDerWaalsContact O-N 3.08Å; F386-C707 HydrophobicContact CB-CB 4.12Å; F386-V711 HydrophobicContact CD2-CG2 3.68Å; F386-V711 HydrophobicContact CE2-CG2 3.81Å
387	S	88.8	Confident	90.1	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.014	15%	0.148	C	C	.	.	H	α-helix	trans	-58.3	-49.4	177.8	74.4	0	0	0	0	111	T383 D384 I385 I390 G391 L756	T383-S387 WeakPolarHBondContact O-CB 3.49Å; T383-S387 PolarHBondContact O-N 3.24Å; T383-S387 PolarHBondContact O-OG 2.88Å; D384-S387 PolarHBondContact O-N 3.44Å; D384-S387 PolarHBondContact O-OG 3.38Å; I385-S387 PolarHBondContact O-N 2.92Å; S387-I390 PolarHBondContact O-N 3.42Å; S387-G391 PolarHBondContact O-N 3.34Å; S387-L756 WeakPolarHBondContact O-CD1 3.41Å
388	F	91.8	Very high	90	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.009	15%	0.147	C	C	.	.	H	α-helix	trans	-73.7	-33.3	179.2	-67.9	-64.9	0	0	0	112.8	D384 I385 F386 I390 G391 T392 F402 C403 T406 V407 I410 L756 M757	D384-F388 WeakPolarHBondContact O-CD2 3.37Å; D384-F388 PolarHBondContact O-N 2.57Å; I385-F388 PolarHBondContact O-N 3.34Å; F386-F388 PolarHBondContact O-N 3.18Å; F388-I390 VanDerWaalsContact C-N 3.26Å; F388-I390 PolarHBondContact O-N 2.87Å; F388-G391 CarbonylContact O-C 3.53Å; F388-G391 WeakPolarHBondContact O-CA 3.48Å; F388-G391 PolarHBondContact O-N 2.92Å; F388-T392 WeakPolarHBondContact O-CG2 3.23Å; F388-T392 PolarHBondContact O-N 3.01Å; F388-F402 HydrophobicContact CD1-CE1 4.35Å; F388-F402 AromaticContact CE1-CE1 3.92Å; F388-F402 HydrophobicContact CE1-CE1 3.92Å; F388-C403 HydrophobicContact CB-CB 4.44Å; F388-C403 VanDerWaalsContact O-CB 3.3Å; F388-C403 WeakPolarHBondContact O-CB 3.41Å; F388-T406 HydrophobicContact CD1-CG2 4.11Å; F388-T406 HydrophobicContact CD2-CG2 3.73Å; F388-T406 HydrophobicContact CE1-CG2 4.01Å; F388-T406 HydrophobicContact CE2-CG2 3.62Å; F388-T406 HydrophobicContact CG-CG2 3.98Å; F388-T406 HydrophobicContact CZ-CG2 3.76Å; F388-V407 HydrophobicContact CB-CG2 3.46Å; F388-V407 VanDerWaalsContact CB-CG2 3.46Å; F388-I410 HydrophobicContact CD2-CD1 3.77Å; F388-I410 HydrophobicContact CE2-CD1 3.78Å; F388-L756 HydrophobicContact CD1-CD2 4.35Å; F388-M757 HydrophobicContact CE1-CB 4.11Å; F388-M757 HydrophobicContact CZ-CB 3.97Å; F388-M757 HydrophobicContact CZ-CG 4.15Å
389	V	93.4	Very high	90	Very high	47 Å²	47	27.3 Å²	27.3	29%	0.285	14%	0.141	S	C	.	.	H	α-helix	trans	-58.2	-40.3	173.7	164.7	0	0	0	0	110.9	I385 F386 G391 T392 F393 V407	I385-V389 HydrophobicContact CG2-CG2 3.94Å; I385-V389 WeakPolarHBondContact O-CB 3.36Å; I385-V389 WeakPolarHBondContact O-CG2 3.39Å; I385-V389 PolarHBondContact O-N 3.39Å; F386-V389 PolarHBondContact O-N 2.95Å; V389-G391 VanDerWaalsContact C-N 3.29Å; V389-G391 PolarHBondContact O-N 2.71Å; V389-T392 WeakPolarHBondContact O-CB 3.4Å; V389-T392 PolarHBondContact O-N 3.1Å; V389-T392 VanDerWaalsContact O-N 3.08Å; V389-T392 PolarHBondContact O-OG1 3.07Å; V389-F393 HydrophobicContact CG1-CE2 4.04Å; V389-F393 VanDerWaalsContact O-CD2 3.26Å; V389-F393 WeakPolarHBondContact O-CD2 3.35Å; V389-V407 HydrophobicContact CG2-CG1 4.17Å; V389-V407 HydrophobicContact CG2-CG2 3.94Å
390	I	90.5	Very high	90.2	Very high	25 Å²	25	28.2 Å²	28.2	13%	0.128	15%	0.148	C	C	.	.	H	α-helix	trans	-60	-43.5	173.8	-65.3	155.4	0	0	0	110.5	F386 S387 F388 T392 F393 E700 V703 A704 C707	F386-I390 VanDerWaalsContact O-CD1 3.29Å; F386-I390 WeakPolarHBondContact O-CD1 3.5Å; F386-I390 VanDerWaalsContact O-CG1 3.27Å; F386-I390 WeakPolarHBondContact O-CG1 3.43Å; F386-I390 PolarHBondContact O-N 2.97Å; F386-I390 VanDerWaalsContact O-N 3.08Å; S387-I390 PolarHBondContact O-N 3.42Å; F388-I390 VanDerWaalsContact C-N 3.26Å; F388-I390 PolarHBondContact O-N 2.87Å; I390-T392 PolarHBondContact O-N 3.46Å; I390-F393 PolarHBondContact O-N 3.24Å; I390-F393 VanDerWaalsContact O-N 3.11Å; I390-E700 HydrophobicContact CG2-CB 4.4Å; I390-E700 HydrophobicContact CG2-CG 4.35Å; I390-V703 HydrophobicContact CD1-CB 4.3Å; I390-V703 HydrophobicContact CD1-CG1 3.68Å; I390-V703 HydrophobicContact CG1-CG1 3.9Å; I390-V703 HydrophobicContact CG2-CB 4.28Å; I390-V703 HydrophobicContact CG2-CG1 4.24Å; I390-A704 VanDerWaalsContact CD1-CA 3.5Å; I390-A704 HydrophobicContact CD1-CB 4.1Å; I390-C707 HydrophobicContact CD1-CB 4.19Å
391	G	89.4	Confident	90.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-63.8	-21	175.3	0	0	0	0	0	114.6	S387 F388 V389 F393 S394	S387-G391 PolarHBondContact O-N 3.34Å; F388-G391 CarbonylContact O-C 3.53Å; F388-G391 WeakPolarHBondContact O-CA 3.48Å; F388-G391 PolarHBondContact O-N 2.92Å; V389-G391 VanDerWaalsContact C-N 3.29Å; V389-G391 PolarHBondContact O-N 2.71Å; G391-F393 PolarHBondContact O-N 2.73Å; G391-S394 WeakPolarHBondContact O-CB 3.22Å; G391-S394 PolarHBondContact O-N 3.17Å; G391-S394 VanDerWaalsContact O-N 3.15Å
392	T	91.6	Very high	90.5	Very high	26 Å²	26	27.9 Å²	27.9	16%	0.16	15%	0.147	C	C	.	.	H	α-helix	trans	-67.4	-26.5	173.1	70.9	0	0	0	0	112.9	F388 V389 I390 S394 S400 C403 L404	F388-T392 WeakPolarHBondContact O-CG2 3.23Å; F388-T392 PolarHBondContact O-N 3.01Å; V389-T392 WeakPolarHBondContact O-CB 3.4Å; V389-T392 PolarHBondContact O-N 3.1Å; V389-T392 VanDerWaalsContact O-N 3.08Å; V389-T392 PolarHBondContact O-OG1 3.07Å; I390-T392 PolarHBondContact O-N 3.46Å; T392-S394 PolarHBondContact O-N 3.48Å; T392-S400 WeakPolarHBondContact O-CB 3.37Å; T392-S400 PolarHBondContact O-OG 3.04Å; T392-C403 HydrophobicContact CG2-CB 3.75Å; T392-L404 HydrophobicContact CG2-CD2 3.78Å; T392-L404 HydrophobicContact CG2-CG 3.78Å
393	F	89.6	Confident	90.7	Very high	169 Å²	169	24.4 Å²	24.4	74%	0.741	13%	0.129	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.4	5.6	175.3	-61.6	-74.3	0	0	0	113.1	V389 I390 G391	V389-F393 HydrophobicContact CG1-CE2 4.04Å; V389-F393 VanDerWaalsContact O-CD2 3.26Å; V389-F393 WeakPolarHBondContact O-CD2 3.35Å; I390-F393 PolarHBondContact O-N 3.24Å; I390-F393 VanDerWaalsContact O-N 3.11Å; G391-F393 PolarHBondContact O-N 2.73Å
394	S	87.9	Confident	91	Very high	12 Å²	12	26.9 Å²	26.9	8%	0.084	14%	0.142	C	C	.	.			trans	-57.7	141.1	177.3	-164.6	0	0	0	0	110.9	G391 T392 T396 E700	G391-S394 WeakPolarHBondContact O-CB 3.22Å; G391-S394 PolarHBondContact O-N 3.17Å; G391-S394 VanDerWaalsContact O-N 3.15Å; T392-S394 PolarHBondContact O-N 3.48Å; S394-T396 PolarHBondContact O-N 3.16Å; S394-T396 VanDerWaalsContact O-N 3.16Å; S394-E700 WeakPolarHBondContact CA-OE1 3.48Å; S394-E700 WeakPolarHBondContact CB-OE1 3.35Å; S394-E700 PolarHBondContact OG-OE1 2.8Å
395	S	85.4	Confident	91.2	Very high	32 Å²	32	26.6 Å²	26.6	22%	0.224	14%	0.141	C	C	.	.	S	Bend	trans	-65.1	-15	174.3	58.2	0	0	0	0	112.5	P73 P74 P397 T696	P73-S395 VanDerWaalsContact CA-O 3.31Å; P73-S395 WeakPolarHBondContact CA-O 3.31Å; P74-S395 WeakPolarHBondContact CD-O 3.29Å; S395-P397 WeakPolarHBondContact O-CD 3.43Å; S395-T696 PolarHBondContact OG-OG1 2.81Å
396	T	88.9	Confident	91.3	Very high	1 Å²	1	25 Å²	25	1%	0.006	13%	0.133	C	C	.	.	S	Bend	trans	-96.3	112.9	-179.2	-48.1	0	0	0	0	110.6	Y71 S394 A398 I399 S400 Q689	Y71-T396 HydrophobicContact CD1-CG2 4.17Å; S394-T396 PolarHBondContact O-N 3.16Å; S394-T396 VanDerWaalsContact O-N 3.16Å; T396-A398 VanDerWaalsContact C-N 3.28Å; T396-A398 HydrophobicContact CG2-CB 4.41Å; T396-A398 PolarHBondContact O-N 3.31Å; T396-I399 HydrophobicContact CG2-CD1 4.2Å; T396-I399 HydrophobicContact CG2-CG1 3.97Å; T396-I399 WeakPolarHBondContact O-CB 3.21Å; T396-I399 PolarHBondContact O-N 2.99Å; T396-S400 PolarHBondContact O-N 3.01Å; T396-Q689 PolarHBondContact OG1-NE2 3.44Å; T396-Q689 PolarHBondContact OG1-OE1 3.47Å
397	P	89.8	Confident	91.5	Very high	39 Å²	39	22.3 Å²	22.3	25%	0.253	12%	0.123	S	C	.	.	H	α-helix	trans	-55.4	-37.6	-177.5	-30	37.6	0	0	0	114.4	E69 L70 T72 S395 I399 S400 S401	E69-P397 WeakPolarHBondContact O-CG 3.21Å; L70-P397 VanDerWaalsContact O-CD 3.29Å; L70-P397 WeakPolarHBondContact O-CD 3.2Å; T72-P397 WeakPolarHBondContact O-CD 3.37Å; S395-P397 WeakPolarHBondContact O-CD 3.43Å; P397-I399 VanDerWaalsContact C-N 3.31Å; P397-I399 PolarHBondContact O-N 3.33Å; P397-S400 PolarHBondContact O-N 3.04Å; P397-S401 PolarHBondContact O-N 2.89Å; P397-S401 PolarHBondContact O-OG 3.36Å; P397-S401 VanDerWaalsContact O-OG 3.11Å
398	A	89	Confident	91.9	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.008	12%	0.124	C	C	.	.	H	α-helix	trans	-59.4	-39.5	176.4	0	0	0	0	0	113.4	L70 Y71 T330 T396 F402	L70-A398 HydrophobicContact CB-CB 4.24Å; L70-A398 WeakPolarHBondContact O-CB 3.33Å; L70-A398 PolarHBondContact O-N 2.83Å; Y71-A398 HydrophobicContact CD1-CB 4.43Å; Y71-A398 HydrophobicContact CE1-CB 4.11Å; T330-A398 PolarHBondContact OG1-O 3.47Å; T396-A398 VanDerWaalsContact C-N 3.28Å; T396-A398 HydrophobicContact CG2-CB 4.41Å; T396-A398 PolarHBondContact O-N 3.31Å; A398-F402 WeakPolarHBondContact O-CB 3.37Å; A398-F402 PolarHBondContact O-N 3.13Å
399	I	90.2	Very high	92.1	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.01	13%	0.125	C	C	.	.	H	α-helix	trans	-69.8	-45.7	176.5	-58.8	-177	0	0	0	109.3	T396 P397 S401 F402 C403 P749 V752 I753	T396-I399 HydrophobicContact CG2-CD1 4.2Å; T396-I399 HydrophobicContact CG2-CG1 3.97Å; T396-I399 WeakPolarHBondContact O-CB 3.21Å; T396-I399 PolarHBondContact O-N 2.99Å; P397-I399 VanDerWaalsContact C-N 3.31Å; P397-I399 PolarHBondContact O-N 3.33Å; I399-S401 PolarHBondContact O-N 3.13Å; I399-F402 PolarHBondContact O-N 3.4Å; I399-C403 WeakPolarHBondContact O-CB 3.48Å; I399-C403 PolarHBondContact O-N 3.34Å; I399-C403 PolarHBondContact O-SG 3.16Å; I399-P749 HydrophobicContact CD1-CB 4.13Å; I399-P749 HydrophobicContact CG1-CB 4.4Å; I399-V752 HydrophobicContact CD1-CB 4.47Å; I399-V752 HydrophobicContact CD1-CG1 4.25Å; I399-I753 HydrophobicContact CB-CD1 4.41Å; I399-I753 HydrophobicContact CB-CG1 4.18Å; I399-I753 HydrophobicContact CD1-CG1 4.42Å; I399-I753 HydrophobicContact CG1-CD1 3.92Å; I399-I753 HydrophobicContact CG1-CG1 3.78Å; I399-I753 HydrophobicContact CG2-CG1 3.97Å
400	S	92.5	Very high	92.2	Very high	26 Å²	26	20.8 Å²	20.8	18%	0.182	11%	0.114	C	C	.	.	H	α-helix	trans	-59	-48.3	179.6	-178.6	0	0	0	0	111.8	T392 T396 P397 C403 L404	T392-S400 WeakPolarHBondContact O-CB 3.37Å; T392-S400 PolarHBondContact O-OG 3.04Å; T396-S400 PolarHBondContact O-N 3.01Å; P397-S400 PolarHBondContact O-N 3.04Å; S400-C403 PolarHBondContact O-N 2.91Å; S400-L404 WeakPolarHBondContact O-CB 3.12Å; S400-L404 VanDerWaalsContact O-CG 3.31Å; S400-L404 WeakPolarHBondContact O-CG 3.48Å; S400-L404 PolarHBondContact O-N 3.34Å
401	S	93.2	Very high	92.5	Very high	6 Å²	6	23.6 Å²	23.6	4%	0.042	13%	0.129	C	C	.	.	H	α-helix	trans	-61.1	-46.8	176.2	-55.6	0	0	0	0	111.9	P397 I399 C403 L404 F405	P397-S401 PolarHBondContact O-N 2.89Å; P397-S401 PolarHBondContact O-OG 3.36Å; P397-S401 VanDerWaalsContact O-OG 3.11Å; I399-S401 PolarHBondContact O-N 3.13Å; S401-C403 VanDerWaalsContact C-N 3.3Å; S401-C403 PolarHBondContact O-N 3.37Å; S401-L404 PolarHBondContact O-N 3.41Å; S401-F405 VanDerWaalsContact O-CD2 3.31Å; S401-F405 WeakPolarHBondContact O-CD2 3.45Å; S401-F405 PolarHBondContact O-N 2.66Å
402	F	93.5	Very high	92.9	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-54.2	-48.2	176	173	-83.7	0	0	0	111.9	T330 V334 I337 F388 A398 I399 F405 T406 I753 F821	T330-F402 WeakPolarHBondContact O-CD2 3.33Å; V334-F402 HydrophobicContact CG2-CD2 3.39Å; V334-F402 HydrophobicContact CG2-CE2 3.4Å; V334-F402 HydrophobicContact CG2-CG 4.17Å; V334-F402 HydrophobicContact CG2-CZ 4.16Å; I337-F402 HydrophobicContact CD1-CE2 4.18Å; I337-F402 HydrophobicContact CD1-CZ 3.98Å; F388-F402 HydrophobicContact CD1-CE1 4.35Å; F388-F402 AromaticContact CE1-CE1 3.92Å; F388-F402 HydrophobicContact CE1-CE1 3.92Å; A398-F402 WeakPolarHBondContact O-CB 3.37Å; A398-F402 PolarHBondContact O-N 3.13Å; I399-F402 PolarHBondContact O-N 3.4Å; F402-F405 PolarHBondContact O-N 3.16Å; F402-T406 WeakPolarHBondContact O-CB 3.41Å; F402-T406 PolarHBondContact O-N 3.35Å; F402-T406 PolarHBondContact O-OG1 3.3Å; F402-I753 HydrophobicContact CB-CD1 4.3Å; F402-I753 HydrophobicContact CD1-CG2 3.3Å; F402-I753 HydrophobicContact CD2-CG2 4.09Å; F402-I753 HydrophobicContact CE1-CG2 3.16Å; F402-I753 HydrophobicContact CE2-CG2 3.95Å; F402-I753 HydrophobicContact CG-CD1 4.31Å; F402-I753 HydrophobicContact CG-CG2 3.79Å; F402-I753 HydrophobicContact CZ-CG2 3.51Å; F402-F821 HydrophobicContact CE2-CE1 4.34Å; F402-F821 HydrophobicContact CE2-CZ 4.16Å; F402-F821 HydrophobicContact CZ-CE1 4.31Å
403	C	94.3	Very high	93.1	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-66.2	-40.4	-178.2	-67.6	0	0	0	0	111.6	F388 T392 I399 S400 S401 T406 V407	F388-C403 HydrophobicContact CB-CB 4.44Å; F388-C403 VanDerWaalsContact O-CB 3.3Å; F388-C403 WeakPolarHBondContact O-CB 3.41Å; T392-C403 HydrophobicContact CG2-CB 3.75Å; I399-C403 WeakPolarHBondContact O-CB 3.48Å; I399-C403 PolarHBondContact O-N 3.34Å; I399-C403 PolarHBondContact O-SG 3.16Å; S400-C403 PolarHBondContact O-N 2.91Å; S401-C403 VanDerWaalsContact C-N 3.3Å; S401-C403 PolarHBondContact O-N 3.37Å; C403-T406 PolarHBondContact O-N 3Å; C403-V407 WeakPolarHBondContact O-CB 3.27Å; C403-V407 VanDerWaalsContact O-CG2 3.26Å; C403-V407 WeakPolarHBondContact O-CG2 3.46Å; C403-V407 PolarHBondContact O-N 2.91Å
404	L	95.6	Very high	93.4	Very high	53 Å²	53	18 Å²	18	28%	0.277	10%	0.101	S	C	.	.	H	α-helix	trans	-58.4	-53.7	175.8	-77.6	165.5	0	0	0	111.1	M320 I325 T392 S400 S401 T406 V407 A408	M320-L404 VanDerWaalsContact CE-C 3.44Å; M320-L404 HydrophobicContact CE-CB 4.07Å; M320-L404 WeakPolarHBondContact CE-O 3.45Å; I325-L404 HydrophobicContact CD1-CB 4.38Å; I325-L404 HydrophobicContact CD1-CD1 4.14Å; I325-L404 HydrophobicContact CG2-CD1 4.25Å; T392-L404 HydrophobicContact CG2-CD2 3.78Å; T392-L404 HydrophobicContact CG2-CG 3.78Å; S400-L404 WeakPolarHBondContact O-CB 3.12Å; S400-L404 VanDerWaalsContact O-CG 3.31Å; S400-L404 WeakPolarHBondContact O-CG 3.48Å; S400-L404 PolarHBondContact O-N 3.34Å; S401-L404 PolarHBondContact O-N 3.41Å; L404-T406 VanDerWaalsContact C-N 3.27Å; L404-T406 PolarHBondContact O-N 3.4Å; L404-V407 PolarHBondContact O-N 3.5Å; L404-A408 PolarHBondContact O-N 3.42Å
405	F	95.7	Very high	93.8	Very high	1 Å²	1	20.5 Å²	20.5	0%	0.004	12%	0.116	C	C	.	.	H	α-helix	trans	-58.3	-40.2	178	-85.8	-95.7	0	0	0	112.2	F317 M320 I325 V331 V334 S401 F402 A409	F317-F405 AromaticContact CD1-CD1 3.95Å; F317-F405 HydrophobicContact CD1-CD1 3.95Å; F317-F405 AromaticContact CD1-CE1 3.7Å; F317-F405 HydrophobicContact CD1-CE1 3.7Å; F317-F405 HydrophobicContact CD2-CD1 4.18Å; F317-F405 AromaticContact CE1-CD1 3.89Å; F317-F405 HydrophobicContact CE1-CD1 3.89Å; F317-F405 AromaticContact CE1-CE1 3.93Å; F317-F405 HydrophobicContact CE1-CE1 3.93Å; F317-F405 HydrophobicContact CE2-CD1 4.15Å; F317-F405 HydrophobicContact CG-CD1 4.09Å; F317-F405 HydrophobicContact CG-CE1 4.07Å; F317-F405 AromaticContact CZ-CD1 3.99Å; F317-F405 HydrophobicContact CZ-CD1 3.99Å; F317-F405 HydrophobicContact CZ-CE1 4.49Å; M320-F405 HydrophobicContact CB-CD1 3.88Å; M320-F405 HydrophobicContact CB-CD2 4.24Å; M320-F405 HydrophobicContact CB-CE1 3.53Å; M320-F405 HydrophobicContact CB-CE2 3.93Å; M320-F405 HydrophobicContact CB-CG 4.23Å; M320-F405 HydrophobicContact CB-CZ 3.55Å; M320-F405 HydrophobicContact CG-CD1 3.99Å; M320-F405 HydrophobicContact CG-CD2 4.29Å; M320-F405 HydrophobicContact CG-CE1 4.18Å; M320-F405 HydrophobicContact CG-CE2 4.47Å; M320-F405 HydrophobicContact CG-CG 4.06Å; M320-F405 HydrophobicContact CG-CZ 4.42Å; I325-F405 HydrophobicContact CB-CE2 4.26Å; I325-F405 HydrophobicContact CG2-CD2 4.23Å; I325-F405 HydrophobicContact CG2-CE2 3.73Å; V331-F405 HydrophobicContact CG1-CB 4.16Å; V331-F405 HydrophobicContact CG1-CD1 3.87Å; V331-F405 HydrophobicContact CG1-CD2 3.84Å; V331-F405 HydrophobicContact CG1-CE1 4.16Å; V331-F405 HydrophobicContact CG1-CE2 4.13Å; V331-F405 HydrophobicContact CG1-CG 3.7Å; V331-F405 HydrophobicContact CG1-CZ 4.29Å; V331-F405 HydrophobicContact CG2-CD2 3.89Å; V331-F405 HydrophobicContact CG2-CE2 4.3Å; V331-F405 HydrophobicContact CG2-CG 4.39Å; V334-F405 HydrophobicContact CG1-CB 4.29Å; V334-F405 HydrophobicContact CG2-CB 4.43Å; S401-F405 VanDerWaalsContact O-CD2 3.31Å; S401-F405 WeakPolarHBondContact O-CD2 3.45Å; S401-F405 PolarHBondContact O-N 2.66Å; F402-F405 PolarHBondContact O-N 3.16Å; F405-A409 WeakPolarHBondContact O-CB 3.47Å; F405-A409 PolarHBondContact O-N 2.91Å
406	T	95	Very high	94.3	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-67.2	-45.1	179	-54.2	0	0	0	0	111.8	T338 F388 F402 C403 L404 A408 A409 I410	T338-T406 HydrophobicContact CG2-CG2 4.22Å; F388-T406 HydrophobicContact CD1-CG2 4.11Å; F388-T406 HydrophobicContact CD2-CG2 3.73Å; F388-T406 HydrophobicContact CE1-CG2 4.01Å; F388-T406 HydrophobicContact CE2-CG2 3.62Å; F388-T406 HydrophobicContact CG-CG2 3.98Å; F388-T406 HydrophobicContact CZ-CG2 3.76Å; F402-T406 WeakPolarHBondContact O-CB 3.41Å; F402-T406 PolarHBondContact O-N 3.35Å; F402-T406 PolarHBondContact O-OG1 3.3Å; C403-T406 PolarHBondContact O-N 3Å; L404-T406 VanDerWaalsContact C-N 3.27Å; L404-T406 PolarHBondContact O-N 3.4Å; T406-A408 VanDerWaalsContact C-N 3.35Å; T406-A408 PolarHBondContact O-N 2.95Å; T406-A409 PolarHBondContact O-N 2.93Å; T406-A409 VanDerWaalsContact O-N 3.17Å; T406-I410 HydrophobicContact CG2-CD1 3.84Å; T406-I410 HydrophobicContact CG2-CG1 4.41Å; T406-I410 WeakPolarHBondContact O-CG1 3.13Å; T406-I410 PolarHBondContact O-N 2.85Å
407	V	95.9	Very high	94.6	Very high	24 Å²	24	19.5 Å²	19.5	15%	0.145	11%	0.108	C	C	.	.	H	α-helix	trans	-59	-44.7	176.1	169.7	0	0	0	0	111.3	I385 F388 V389 C403 L404 I410 L411	I385-V407 HydrophobicContact CG2-CG1 4.39Å; F388-V407 HydrophobicContact CB-CG2 3.46Å; F388-V407 VanDerWaalsContact CB-CG2 3.46Å; V389-V407 HydrophobicContact CG2-CG1 4.17Å; V389-V407 HydrophobicContact CG2-CG2 3.94Å; C403-V407 WeakPolarHBondContact O-CB 3.27Å; C403-V407 VanDerWaalsContact O-CG2 3.26Å; C403-V407 WeakPolarHBondContact O-CG2 3.46Å; C403-V407 PolarHBondContact O-N 2.91Å; L404-V407 PolarHBondContact O-N 3.5Å; V407-I410 PolarHBondContact O-N 3.21Å; V407-L411 VanDerWaalsContact O-CB 3.28Å; V407-L411 WeakPolarHBondContact O-CB 3.34Å; V407-L411 PolarHBondContact O-N 3.41Å
408	A	96.7	Very high	94.8	Very high	6 Å²	6	19 Å²	19	5%	0.05	10%	0.103	C	C	.	.	H	α-helix	trans	-63.7	-42.3	176.2	0	0	0	0	0	112.1	A316 M320 L404 T406 I410 L411 F412	A316-A408 HydrophobicContact CB-CB 3.91Å; M320-A408 HydrophobicContact CE-CB 3.34Å; M320-A408 HydrophobicContact CG-CB 4.22Å; M320-A408 HydrophobicContact SD-CB 4.12Å; L404-A408 PolarHBondContact O-N 3.42Å; T406-A408 VanDerWaalsContact C-N 3.35Å; T406-A408 PolarHBondContact O-N 2.95Å; A408-I410 PolarHBondContact O-N 3.42Å; A408-L411 PolarHBondContact O-N 3.49Å; A408-F412 HydrophobicContact CB-CD2 4.26Å; A408-F412 HydrophobicContact CB-CE2 4.2Å; A408-F412 WeakPolarHBondContact O-CB 3.21Å; A408-F412 WeakPolarHBondContact O-CD2 3.32Å; A408-F412 PolarHBondContact O-N 3.08Å
409	A	96.7	Very high	95.1	Very high	2 Å²	2	19.9 Å²	19.9	2%	0.017	11%	0.108	C	C	.	.	H	α-helix	trans	-60	-46.4	178.4	0	0	0	0	0	111.7	A316 T338 F405 T406 D413	A316-A409 VanDerWaalsContact CB-CA 3.5Å; A316-A409 HydrophobicContact CB-CB 3.86Å; T338-A409 HydrophobicContact CG2-CB 3.44Å; T338-A409 VanDerWaalsContact CG2-CB 3.44Å; F405-A409 WeakPolarHBondContact O-CB 3.47Å; F405-A409 PolarHBondContact O-N 2.91Å; T406-A409 PolarHBondContact O-N 2.93Å; T406-A409 VanDerWaalsContact O-N 3.17Å; A409-D413 WeakPolarHBondContact O-CB 3.19Å; A409-D413 PolarHBondContact O-N 2.89Å
410	I	95.5	Very high	95.4	Very high	11 Å²	11	20 Å²	20	6%	0.056	11%	0.109	C	C	.	.	H	α-helix	trans	-65.8	-42.1	178.3	-64.5	173.3	0	0	0	111	L341 V381 D384 I385 F388 T406 V407 A408 D413 Y414	L341-I410 HydrophobicContact CD1-CD1 4.15Å; V381-I410 HydrophobicContact CG1-CG2 3.99Å; D384-I410 HydrophobicContact CB-CD1 3.89Å; D384-I410 HydrophobicContact CB-CG2 4.5Å; I385-I410 HydrophobicContact CD1-CG2 4.27Å; I385-I410 HydrophobicContact CG1-CB 4.44Å; I385-I410 HydrophobicContact CG1-CG2 3.82Å; F388-I410 HydrophobicContact CD2-CD1 3.77Å; F388-I410 HydrophobicContact CE2-CD1 3.78Å; T406-I410 HydrophobicContact CG2-CD1 3.84Å; T406-I410 HydrophobicContact CG2-CG1 4.41Å; T406-I410 WeakPolarHBondContact O-CG1 3.13Å; T406-I410 PolarHBondContact O-N 2.85Å; V407-I410 PolarHBondContact O-N 3.21Å; A408-I410 PolarHBondContact O-N 3.42Å; I410-D413 PolarHBondContact O-N 3.46Å; I410-Y414 WeakPolarHBondContact O-CB 3.19Å; I410-Y414 PolarHBondContact O-N 3.14Å
411	L	96.1	Very high	95.6	Very high	84 Å²	84	18.7 Å²	18.7	44%	0.44	10%	0.1	S	C	.	.	H	α-helix	trans	-64.1	-46.7	178.5	-177.2	66.5	0	0	0	112.1	I385 V407 A408 D413 V415	I385-L411 HydrophobicContact CD1-CD1 4.3Å; V407-L411 VanDerWaalsContact O-CB 3.28Å; V407-L411 WeakPolarHBondContact O-CB 3.34Å; V407-L411 PolarHBondContact O-N 3.41Å; A408-L411 PolarHBondContact O-N 3.49Å; L411-D413 VanDerWaalsContact C-N 3.32Å; L411-V415 WeakPolarHBondContact O-CG2 3.43Å; L411-V415 PolarHBondContact O-N 2.66Å; L411-V415 VanDerWaalsContact O-N 3.11Å
412	F	97.1	Very high	95.7	Very high	25 Å²	25	18.5 Å²	18.5	11%	0.11	10%	0.098	C	C	.	.	H	α-helix	trans	-65.1	-39.3	176.4	-75.9	-56.6	0	0	0	111.5	F50 A312 A315 A316 F319 A408 V415 F416	F50-F412 AromaticContact CE1-CD1 3.91Å; F50-F412 HydrophobicContact CE1-CD1 3.91Å; F50-F412 AromaticContact CE1-CE1 3.47Å; F50-F412 HydrophobicContact CE1-CE1 3.47Å; F50-F412 VanDerWaalsContact CE1-CE1 3.47Å; F50-F412 HydrophobicContact CE1-CZ 4.3Å; F50-F412 HydrophobicContact CZ-CD1 4.49Å; F50-F412 AromaticContact CZ-CE1 3.67Å; F50-F412 HydrophobicContact CZ-CE1 3.67Å; F50-F412 HydrophobicContact CZ-CZ 4.36Å; A312-F412 HydrophobicContact CB-CB 4.1Å; A315-F412 HydrophobicContact CB-CB 4.44Å; A315-F412 HydrophobicContact CB-CD1 4.25Å; A315-F412 HydrophobicContact CB-CD2 4.08Å; A315-F412 HydrophobicContact CB-CE2 4.42Å; A315-F412 HydrophobicContact CB-CG 4Å; A316-F412 HydrophobicContact CB-CD2 3.93Å; A316-F412 HydrophobicContact CB-CE2 4.49Å; F319-F412 HydrophobicContact CB-CE2 3.77Å; F319-F412 HydrophobicContact CB-CZ 3.98Å; F319-F412 HydrophobicContact CD1-CE2 4.16Å; F319-F412 HydrophobicContact CD1-CZ 4.31Å; F319-F412 HydrophobicContact CD2-CZ 4.38Å; F319-F412 HydrophobicContact CG-CE2 4.04Å; F319-F412 AromaticContact CG-CZ 3.97Å; F319-F412 HydrophobicContact CG-CZ 3.97Å; A408-F412 HydrophobicContact CB-CD2 4.26Å; A408-F412 HydrophobicContact CB-CE2 4.2Å; A408-F412 WeakPolarHBondContact O-CB 3.21Å; A408-F412 WeakPolarHBondContact O-CD2 3.32Å; A408-F412 PolarHBondContact O-N 3.08Å; F412-V415 PolarHBondContact O-N 3.19Å; F412-F416 VanDerWaalsContact O-CB 3.31Å; F412-F416 WeakPolarHBondContact O-CB 3.21Å; F412-F416 WeakPolarHBondContact O-CD1 3.46Å; F412-F416 WeakPolarHBondContact O-CG 3.47Å; F412-F416 PolarHBondContact O-N 2.9Å
413	D	96.1	Very high	95.8	Very high	10 Å²	10	18.5 Å²	18.5	5%	0.053	10%	0.098	C	C	.	.	H	α-helix	trans	-64.4	-47.1	179	-172.2	62.4	0	0	0	111.5	N308 A312 A342 A409 I410 L411 V415 F416 Q417	N308-D413 PolarHBondContact ND2-OD1 3.02Å; A312-D413 VanDerWaalsContact CB-CA 3.43Å; A312-D413 HydrophobicContact CB-CB 3.62Å; A342-D413 VanDerWaalsContact CA-OD2 3.31Å; A342-D413 WeakPolarHBondContact CA-OD2 3.37Å; A342-D413 HydrophobicContact CB-CB 4.33Å; A342-D413 WeakPolarHBondContact CB-OD1 3.35Å; A342-D413 WeakPolarHBondContact CB-OD2 3.29Å; A409-D413 WeakPolarHBondContact O-CB 3.19Å; A409-D413 PolarHBondContact O-N 2.89Å; I410-D413 PolarHBondContact O-N 3.46Å; L411-D413 VanDerWaalsContact C-N 3.32Å; D413-V415 PolarHBondContact O-N 2.94Å; D413-F416 CarbonylContact O-C 3.55Å; D413-F416 PolarHBondContact O-N 2.92Å; D413-F416 VanDerWaalsContact O-N 3.14Å; D413-Q417 WeakPolarHBondContact O-CB 3.29Å; D413-Q417 VanDerWaalsContact O-CG 3.31Å; D413-Q417 WeakPolarHBondContact O-CG 3.27Å; D413-Q417 PolarHBondContact O-N 2.65Å; D413-Q417 PolarHBondContact OD2-NE2 3.24Å
414	Y	95.9	Very high	95.8	Very high	42 Å²	42	19.4 Å²	19.4	17%	0.165	10%	0.103	C	C	.	.	H	α-helix	trans	-57.5	-46	174.7	176.1	-112.6	0	0	0	112.8	I377 T378 V381 I410 F416 Q417 L418	I377-Y414 HydrophobicContact CG2-CD2 4.4Å; T378-Y414 PolarHBondContact OG1-OH 3.38Å; V381-Y414 HydrophobicContact CB-CD2 4.19Å; V381-Y414 HydrophobicContact CB-CG 4.45Å; V381-Y414 HydrophobicContact CG1-CD1 4.32Å; V381-Y414 HydrophobicContact CG1-CD2 4.05Å; V381-Y414 HydrophobicContact CG1-CG 3.81Å; V381-Y414 HydrophobicContact CG2-CD2 3.84Å; V381-Y414 HydrophobicContact CG2-CG 4.27Å; I410-Y414 WeakPolarHBondContact O-CB 3.19Å; I410-Y414 PolarHBondContact O-N 3.14Å; Y414-F416 VanDerWaalsContact C-N 3.33Å; Y414-F416 PolarHBondContact O-N 2.97Å; Y414-Q417 PolarHBondContact O-N 3.07Å; Y414-L418 HydrophobicContact CD1-CD1 4.38Å; Y414-L418 HydrophobicContact CE1-CD1 3.77Å; Y414-L418 HydrophobicContact CE2-CD1 3.96Å; Y414-L418 HydrophobicContact CE2-CG 4.21Å; Y414-L418 WeakPolarHBondContact O-CG 3.46Å; Y414-L418 PolarHBondContact O-N 3.35Å; Y414-L418 VanDerWaalsContact O-N 3.08Å
415	V	96.4	Very high	95.7	Very high	66 Å²	66	17 Å²	17	40%	0.4	9%	0.091	S	C	.	.	H	α-helix	trans	-63.4	-40.7	177.1	172.7	0	0	0	0	111	L411 F412 D413 T419	L411-V415 WeakPolarHBondContact O-CG2 3.43Å; L411-V415 PolarHBondContact O-N 2.66Å; L411-V415 VanDerWaalsContact O-N 3.11Å; F412-V415 PolarHBondContact O-N 3.19Å; D413-V415 PolarHBondContact O-N 2.94Å; V415-T419 WeakPolarHBondContact O-CB 3.42Å; V415-T419 WeakPolarHBondContact O-CG2 3.34Å; V415-T419 PolarHBondContact O-N 3.03Å; V415-T419 VanDerWaalsContact O-N 3.13Å; V415-T419 PolarHBondContact O-OG1 3.33Å
416	F	96.8	Very high	95.5	Very high	5 Å²	5	17 Å²	17	2%	0.022	9%	0.091	C	C	.	.	H	α-helix	trans	-72.4	-35.5	179.2	-68.4	-3.1	0	0	0	112	P47 F50 T51 N308 L311 A312 A315 F412 D413 Y414 L418 T419 F420 F421	P47-F416 HydrophobicContact CB-CD1 3.76Å; P47-F416 HydrophobicContact CB-CE1 3.86Å; P47-F416 HydrophobicContact CB-CG 4.12Å; P47-F416 HydrophobicContact CB-CZ 4.29Å; P47-F416 HydrophobicContact CG-CD1 4.19Å; P47-F416 HydrophobicContact CG-CE1 4.5Å; F50-F416 HydrophobicContact CD1-CE1 4.03Å; F50-F416 AromaticContact CD1-CZ 3.78Å; F50-F416 HydrophobicContact CD1-CZ 3.78Å; F50-F416 HydrophobicContact CE1-CE1 4.38Å; F50-F416 HydrophobicContact CE1-CZ 4.18Å; T51-F416 VanDerWaalsContact OG1-CE2 3.27Å; T51-F416 WeakPolarHBondContact OG1-CE2 3.38Å; T51-F416 WeakPolarHBondContact OG1-CZ 3.38Å; N308-F416 WeakPolarHBondContact OD1-CB 3.18Å; N308-F416 PolarHBondContact OD1-O 3.02Å; L311-F416 HydrophobicContact CB-CD2 4.01Å; L311-F416 HydrophobicContact CB-CE2 3.94Å; A312-F416 HydrophobicContact CB-CD2 3.93Å; A312-F416 HydrophobicContact CB-CE2 4.39Å; A315-F416 HydrophobicContact CB-CE2 4.15Å; A315-F416 HydrophobicContact CB-CZ 4.13Å; F412-F416 VanDerWaalsContact O-CB 3.31Å; F412-F416 WeakPolarHBondContact O-CB 3.21Å; F412-F416 WeakPolarHBondContact O-CD1 3.46Å; F412-F416 WeakPolarHBondContact O-CG 3.47Å; F412-F416 PolarHBondContact O-N 2.9Å; D413-F416 CarbonylContact O-C 3.55Å; D413-F416 PolarHBondContact O-N 2.92Å; D413-F416 VanDerWaalsContact O-N 3.14Å; Y414-F416 VanDerWaalsContact C-N 3.33Å; Y414-F416 PolarHBondContact O-N 2.97Å; F416-L418 PolarHBondContact O-N 2.91Å; F416-T419 WeakPolarHBondContact CA-OG1 3.43Å; F416-T419 CarbonylContact O-C 3.43Å; F416-T419 PolarHBondContact O-N 2.66Å; F416-T419 PolarHBondContact O-OG1 3.24Å; F416-F420 WeakPolarHBondContact O-CA 3.3Å; F416-F420 VanDerWaalsContact O-CB 3.29Å; F416-F420 WeakPolarHBondContact O-CB 3.45Å; F416-F420 PolarHBondContact O-N 3.09Å; F416-F421 PolarHBondContact O-N 3.49Å; F416-F421 VanDerWaalsContact O-N 3.1Å
417	Q	94.5	Very high	95.4	Very high	7 Å²	7	20.4 Å²	20.4	3%	0.033	11%	0.108	C	C	.	.	I	π-helix	trans	-60.3	-46.8	173.1	-76.4	-176.5	27.6	0	0	111.4	N308 D345 D413 Y414 T419 C422	N308-Q417 PolarHBondContact OD1-N 3.01Å; D345-Q417 VanDerWaalsContact CB-CD 3.47Å; D345-Q417 PolarHBondContact OD2-NE2 3.33Å; D345-Q417 PolarHBondContact OD2-OE1 3.18Å; D413-Q417 WeakPolarHBondContact O-CB 3.29Å; D413-Q417 VanDerWaalsContact O-CG 3.31Å; D413-Q417 WeakPolarHBondContact O-CG 3.27Å; D413-Q417 PolarHBondContact O-N 2.65Å; D413-Q417 PolarHBondContact OD2-NE2 3.24Å; Y414-Q417 PolarHBondContact O-N 3.07Å; Q417-T419 PolarHBondContact O-N 3.03Å; Q417-C422 PolarHBondContact O-N 2.97Å; Q417-C422 PolarHBondContact O-SG 3.15Å; Q417-C422 VanDerWaalsContact O-SG 3.34Å
418	L	94.8	Very high	95	Very high	27 Å²	27	19.4 Å²	19.4	14%	0.141	10%	0.103	C	C	.	.	I	π-helix	trans	-65.2	-27.1	177.4	-70.7	-177.1	0	0	0	113.3	F29 Y32 L370 Y414 F416 C422	F29-L418 HydrophobicContact CD1-CD2 4.49Å; F29-L418 HydrophobicContact CE1-CD1 4.34Å; F29-L418 HydrophobicContact CE1-CD2 3.9Å; Y32-L418 HydrophobicContact CE1-CB 4.21Å; Y32-L418 WeakPolarHBondContact CE1-O 3.36Å; Y32-L418 PolarHBondContact OH-O 3.02Å; L370-L418 HydrophobicContact CD1-CD2 3.73Å; L370-L418 HydrophobicContact CD2-CD2 4.26Å; Y414-L418 HydrophobicContact CD1-CD1 4.38Å; Y414-L418 HydrophobicContact CE1-CD1 3.77Å; Y414-L418 HydrophobicContact CE2-CD1 3.96Å; Y414-L418 HydrophobicContact CE2-CG 4.21Å; Y414-L418 WeakPolarHBondContact O-CG 3.46Å; Y414-L418 PolarHBondContact O-N 3.35Å; Y414-L418 VanDerWaalsContact O-N 3.08Å; F416-L418 PolarHBondContact O-N 2.91Å; L418-C422 VanDerWaalsContact O-CB 3.29Å; L418-C422 WeakPolarHBondContact O-CB 3.3Å
419	T	95.1	Very high	94.7	Very high	21 Å²	21	19.1 Å²	19.1	13%	0.129	10%	0.1	C	C	.	.	I	π-helix	trans	-103	-76.8	-176.9	54.1	0	0	0	0	111.9	F43 P47 V415 F416 Q417 A423	F43-T419 HydrophobicContact CD1-CG2 3.86Å; F43-T419 HydrophobicContact CE1-CG2 4.3Å; P47-T419 WeakPolarHBondContact CG-OG1 3.49Å; V415-T419 WeakPolarHBondContact O-CB 3.42Å; V415-T419 WeakPolarHBondContact O-CG2 3.34Å; V415-T419 PolarHBondContact O-N 3.03Å; V415-T419 VanDerWaalsContact O-N 3.13Å; V415-T419 PolarHBondContact O-OG1 3.33Å; F416-T419 WeakPolarHBondContact CA-OG1 3.43Å; F416-T419 CarbonylContact O-C 3.43Å; F416-T419 PolarHBondContact O-N 2.66Å; F416-T419 PolarHBondContact O-OG1 3.24Å; Q417-T419 PolarHBondContact O-N 3.03Å; T419-A423 VanDerWaalsContact O-CB 3.28Å; T419-A423 WeakPolarHBondContact O-CB 3.29Å; T419-A423 PolarHBondContact O-N 3.12Å
420	F	96.4	Very high	94.3	Very high	3 Å²	3	23.5 Å²	23.5	1%	0.013	12%	0.117	C	C	.	.	I	π-helix	trans	-58.3	-56.8	-177.9	-177	-102	0	0	0	112.3	F43 V44 P47 I48 M304 N308 L311 F416 A423 I424	F43-F420 WeakPolarHBondContact O-CA 3.4Å; F43-F420 PolarHBondContact O-N 3.4Å; V44-F420 HydrophobicContact CG1-CD2 4.3Å; V44-F420 HydrophobicContact CG1-CE2 4.01Å; P47-F420 HydrophobicContact CB-CB 4.07Å; P47-F420 HydrophobicContact CB-CD2 4.48Å; P47-F420 HydrophobicContact CG-CB 3.96Å; I48-F420 HydrophobicContact CD1-CE2 3.89Å; I48-F420 HydrophobicContact CG1-CD2 4.39Å; I48-F420 HydrophobicContact CG1-CE2 3.87Å; M304-F420 HydrophobicContact CE-CE1 3.89Å; M304-F420 HydrophobicContact CE-CE2 4.3Å; M304-F420 HydrophobicContact CE-CZ 3.36Å; M304-F420 WeakPolarHBondContact O-CE1 3.33Å; N308-F420 HydrophobicContact CB-CD1 3.83Å; N308-F420 HydrophobicContact CB-CE1 4.2Å; N308-F420 WeakPolarHBondContact OD1-CD1 3.46Å; L311-F420 HydrophobicContact CD1-CE1 4.34Å; L311-F420 HydrophobicContact CD1-CE2 4.26Å; L311-F420 HydrophobicContact CD1-CZ 4.1Å; F416-F420 WeakPolarHBondContact O-CA 3.3Å; F416-F420 VanDerWaalsContact O-CB 3.29Å; F416-F420 WeakPolarHBondContact O-CB 3.45Å; F416-F420 PolarHBondContact O-N 3.09Å; F420-A423 PolarHBondContact O-N 3.34Å; F420-I424 HydrophobicContact CE1-CG1 4.36Å; F420-I424 HydrophobicContact CZ-CG1 4.44Å; F420-I424 WeakPolarHBondContact O-CG1 3.48Å; F420-I424 PolarHBondContact O-N 3.42Å
421	F	95.8	Very high	93.9	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.115	C	C	.	.	I	π-helix	trans	-68.9	-42.4	-173.2	-172	-123.6	0	0	0	112.5	E301 T346 L349 L350 F416 A423 I424 T425	E301-F421 WeakPolarHBondContact O-CE2 3.48Å; T346-F421 HydrophobicContact CG2-CE1 4.02Å; T346-F421 HydrophobicContact CG2-CE2 3.95Å; T346-F421 HydrophobicContact CG2-CZ 3.48Å; T346-F421 VanDerWaalsContact CG2-CZ 3.48Å; L349-F421 HydrophobicContact CB-CE1 4.02Å; L349-F421 HydrophobicContact CD2-CD1 3.38Å; L349-F421 HydrophobicContact CD2-CE1 3.46Å; L349-F421 VanDerWaalsContact CD2-CE1 3.46Å; L349-F421 HydrophobicContact CG-CE1 4.2Å; L350-F421 HydrophobicContact CD1-CZ 4.29Å; L350-F421 HydrophobicContact CD2-CZ 4.08Å; L350-F421 HydrophobicContact CG-CZ 3.93Å; F416-F421 PolarHBondContact O-N 3.49Å; F416-F421 VanDerWaalsContact O-N 3.1Å; F421-A423 VanDerWaalsContact C-N 3.29Å; F421-A423 PolarHBondContact O-N 3.17Å; F421-I424 PolarHBondContact O-N 3.05Å; F421-T425 HydrophobicContact CD1-CG2 4.33Å; F421-T425 HydrophobicContact CD2-CG2 4.39Å; F421-T425 HydrophobicContact CE1-CG2 3.94Å; F421-T425 HydrophobicContact CE2-CG2 3.98Å; F421-T425 HydrophobicContact CZ-CG2 3.72Å; F421-T425 WeakPolarHBondContact O-CG2 3.43Å; F421-T425 PolarHBondContact O-N 3.49Å; F421-T425 PolarHBondContact O-OG1 3.39Å
422	C	95.6	Very high	93.4	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.007	10%	0.1	C	C	.	.	H	α-helix	trans	-55	-41.6	169.8	-79.2	0	0	0	0	112.9	V36 L366 Q417 L418 T425 V426	V36-C422 HydrophobicContact CG1-CB 4.08Å; L366-C422 HydrophobicContact CD1-CB 4.19Å; L366-C422 HydrophobicContact CD2-CB 4.02Å; Q417-C422 PolarHBondContact O-N 2.97Å; Q417-C422 PolarHBondContact O-SG 3.15Å; Q417-C422 VanDerWaalsContact O-SG 3.34Å; L418-C422 VanDerWaalsContact O-CB 3.29Å; L418-C422 WeakPolarHBondContact O-CB 3.3Å; C422-T425 WeakPolarHBondContact CA-OG1 3.38Å; C422-T425 PolarHBondContact O-N 3.43Å; C422-T425 PolarHBondContact O-OG1 3.35Å; C422-V426 PolarHBondContact O-N 3.24Å
423	A	95.5	Very high	92.8	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-66.8	-40.3	177.3	0	0	0	0	0	112.2	V36 P40 F43 V44 T419 F420 F421 V426 L427	V36-A423 HydrophobicContact CG1-CB 4.22Å; P40-A423 HydrophobicContact CB-CB 4Å; F43-A423 HydrophobicContact CB-CB 3.77Å; V44-A423 HydrophobicContact CG2-CB 3.58Å; T419-A423 VanDerWaalsContact O-CB 3.28Å; T419-A423 WeakPolarHBondContact O-CB 3.29Å; T419-A423 PolarHBondContact O-N 3.12Å; F420-A423 PolarHBondContact O-N 3.34Å; F421-A423 VanDerWaalsContact C-N 3.29Å; F421-A423 PolarHBondContact O-N 3.17Å; A423-V426 PolarHBondContact O-N 3.28Å; A423-L427 WeakPolarHBondContact O-CG 3.5Å; A423-L427 PolarHBondContact O-N 2.97Å; A423-L427 VanDerWaalsContact O-N 3.14Å
424	I	94.4	Very high	92.2	Very high	19 Å²	19	24.6 Å²	24.6	10%	0.097	14%	0.14	C	C	.	.	H	α-helix	trans	-65.2	-43.1	175.4	-64.8	-57.9	0	0	0	111.8	V44 M304 F420 F421 V426 L427 G428	V44-I424 HydrophobicContact CG1-CD1 4.27Å; V44-I424 HydrophobicContact CG2-CD1 3.9Å; V44-I424 HydrophobicContact CG2-CG1 4.49Å; M304-I424 HydrophobicContact CB-CB 4.42Å; M304-I424 HydrophobicContact CB-CG1 4.27Å; M304-I424 HydrophobicContact CB-CG2 3.69Å; M304-I424 HydrophobicContact CE-CD1 3.97Å; M304-I424 HydrophobicContact CE-CG1 4.18Å; M304-I424 HydrophobicContact CG-CG2 3.87Å; F420-I424 HydrophobicContact CE1-CG1 4.36Å; F420-I424 HydrophobicContact CZ-CG1 4.44Å; F420-I424 WeakPolarHBondContact O-CG1 3.48Å; F420-I424 PolarHBondContact O-N 3.42Å; F421-I424 PolarHBondContact O-N 3.05Å; I424-V426 VanDerWaalsContact C-N 3.28Å; I424-V426 PolarHBondContact O-N 3.12Å; I424-L427 HydrophobicContact CD1-CD1 4.32Å; I424-L427 PolarHBondContact O-N 3.34Å; I424-L427 VanDerWaalsContact O-N 3.11Å; I424-G428 PolarHBondContact O-N 3Å
425	T	92.9	Very high	91.3	Very high	4 Å²	4	24 Å²	24	3%	0.025	15%	0.146	C	C	.	.	H	α-helix	trans	-61.4	-36.4	179	52.8	0	0	0	0	111.8	L349 L350 F421 C422 G428 G429	L349-T425 HydrophobicContact CD2-CG2 4.44Å; L350-T425 HydrophobicContact CD2-CG2 4.12Å; F421-T425 HydrophobicContact CD1-CG2 4.33Å; F421-T425 HydrophobicContact CD2-CG2 4.39Å; F421-T425 HydrophobicContact CE1-CG2 3.94Å; F421-T425 HydrophobicContact CE2-CG2 3.98Å; F421-T425 HydrophobicContact CZ-CG2 3.72Å; F421-T425 WeakPolarHBondContact O-CG2 3.43Å; F421-T425 PolarHBondContact O-N 3.49Å; F421-T425 PolarHBondContact O-OG1 3.39Å; C422-T425 WeakPolarHBondContact CA-OG1 3.38Å; C422-T425 PolarHBondContact O-N 3.43Å; C422-T425 PolarHBondContact O-OG1 3.35Å; T425-G428 PolarHBondContact O-N 3.44Å; T425-G429 PolarHBondContact O-N 2.95Å
426	V	93.2	Very high	90.5	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-67.2	-41.3	172.3	169.9	0	0	0	0	112.5	P362 L366 C422 A423 I424 G428 G429 R430	P362-V426 HydrophobicContact CB-CG1 4.38Å; L366-V426 HydrophobicContact CB-CG2 3.5Å; L366-V426 HydrophobicContact CD1-CG2 4.22Å; L366-V426 HydrophobicContact CD2-CG2 3.25Å; L366-V426 HydrophobicContact CG-CG2 3.8Å; C422-V426 PolarHBondContact O-N 3.24Å; A423-V426 PolarHBondContact O-N 3.28Å; I424-V426 VanDerWaalsContact C-N 3.28Å; I424-V426 PolarHBondContact O-N 3.12Å; V426-G428 VanDerWaalsContact C-N 3.3Å; V426-G428 PolarHBondContact O-N 3.25Å; V426-G429 CarbonylContact O-C 3.53Å; V426-G429 WeakPolarHBondContact O-CA 3.16Å; V426-G429 PolarHBondContact O-N 2.98Å; V426-G429 VanDerWaalsContact O-N 3.1Å; V426-R430 HydrophobicContact CG1-CG 4.49Å; V426-R430 WeakPolarHBondContact O-CG 3.4Å; V426-R430 PolarHBondContact O-N 2.78Å
427	L	91.4	Very high	89.6	Confident	71 Å²	71	26.7 Å²	26.7	37%	0.372	15%	0.15	S	C	.	.	H	α-helix	trans	-62.5	-40.5	175.3	-68	174.5	0	0	0	111.1	P40 V44 A423 I424 G429 R430 R431	P40-L427 HydrophobicContact CB-CD2 4.4Å; P40-L427 HydrophobicContact CB-CG 4.37Å; P40-L427 HydrophobicContact CG-CD2 4.04Å; V44-L427 HydrophobicContact CG2-CD1 4.27Å; A423-L427 WeakPolarHBondContact O-CG 3.5Å; A423-L427 PolarHBondContact O-N 2.97Å; A423-L427 VanDerWaalsContact O-N 3.14Å; I424-L427 HydrophobicContact CD1-CD1 4.32Å; I424-L427 PolarHBondContact O-N 3.34Å; I424-L427 VanDerWaalsContact O-N 3.11Å; L427-G429 VanDerWaalsContact C-N 3.33Å; L427-R430 PolarHBondContact O-N 3.05Å; L427-R431 PolarHBondContact O-N 2.73Å
428	G	89.4	Confident	88.7	Confident	3 Å²	3	26.3 Å²	26.3	3%	0.031	15%	0.148	C	C	.	.	H	α-helix	trans	-60.9	-40.1	169.3	0	0	0	0	0	112.5	E301 I424 T425 V426 R431 E432	E301-G428 VanDerWaalsContact OE1-CA 3.3Å; E301-G428 WeakPolarHBondContact OE1-CA 3.38Å; I424-G428 PolarHBondContact O-N 3Å; T425-G428 PolarHBondContact O-N 3.44Å; V426-G428 VanDerWaalsContact C-N 3.3Å; V426-G428 PolarHBondContact O-N 3.25Å; G428-R431 WeakPolarHBondContact O-CB 3.33Å; G428-R431 PolarHBondContact O-N 3.41Å; G428-E432 WeakPolarHBondContact O-CB 3.15Å; G428-E432 PolarHBondContact O-N 2.86Å
429	G	88.9	Confident	87.6	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.9	-40.1	173.8	0	0	0	0	0	113.9	T425 V426 L427 R431 E432 A433	T425-G429 PolarHBondContact O-N 2.95Å; V426-G429 CarbonylContact O-C 3.53Å; V426-G429 WeakPolarHBondContact O-CA 3.16Å; V426-G429 PolarHBondContact O-N 2.98Å; V426-G429 VanDerWaalsContact O-N 3.1Å; L427-G429 VanDerWaalsContact C-N 3.33Å; G429-R431 VanDerWaalsContact C-N 3.35Å; G429-E432 PolarHBondContact O-N 3.42Å; G429-A433 WeakPolarHBondContact O-CB 3.02Å; G429-A433 PolarHBondContact O-N 3.21Å
430	R	89.8	Confident	86.3	Confident	95 Å²	95	37 Å²	37	36%	0.358	19%	0.191	S	C	.	.	H	α-helix	trans	-66	-37.2	173.4	-73.2	178.3	174.5	174.4	2.6	111.5	G37 P362 E363 V426 L427 A434	G37-R430 PolarHBondContact O-NH2 3.25Å; P362-R430 HydrophobicContact CB-CG 4Å; P362-R430 HydrophobicContact CG-CG 3.87Å; E363-R430 IonicContact OE1-CZ 2.95Å; E363-R430 IonicContact OE1-NE 3.32Å; E363-R430 PolarHBondContact OE1-NE 2.91Å; E363-R430 IonicContact OE1-NH2 2.64Å; E363-R430 PolarHBondContact OE1-NH2 3.06Å; V426-R430 HydrophobicContact CG1-CG 4.49Å; V426-R430 WeakPolarHBondContact O-CG 3.4Å; V426-R430 PolarHBondContact O-N 2.78Å; L427-R430 PolarHBondContact O-N 3.05Å; R430-A434 WeakPolarHBondContact O-CB 3.48Å; R430-A434 PolarHBondContact O-N 3.04Å
431	R	87	Confident	84.9	Confident	4 Å²	4	42.1 Å²	42.1	2%	0.015	21%	0.211	C	C	.	.	H	α-helix	trans	-61.6	-47.6	171.8	176.6	-164.2	63.3	80.6	-10.2	111.3	V295 S297 E301 L427 G428 G429 A434 G435 R436 Y441	V295-R431 PolarHBondContact O-NH1 3.09Å; S297-R431 PolarHBondContact O-NH2 3.03Å; E301-R431 IonicContact OE1-CZ 3.54Å; E301-R431 IonicContact OE1-NE 3.19Å; E301-R431 IonicContact OE1-NH2 3.82Å; E301-R431 PolarHBondContact OE1-NH2 3.46Å; E301-R431 IonicContact OE2-NH2 3.87Å; L427-R431 PolarHBondContact O-N 2.73Å; G428-R431 WeakPolarHBondContact O-CB 3.33Å; G428-R431 PolarHBondContact O-N 3.41Å; G429-R431 VanDerWaalsContact C-N 3.35Å; R431-A434 PolarHBondContact O-N 3.37Å; R431-G435 PolarHBondContact O-N 2.92Å; R431-R436 HydrophobicContact CG-CB 3.66Å; R431-R436 PolarHBondContact NH1-O 3.19Å; R431-R436 PolarHBondContact O-N 3.47Å; R431-R436 VanDerWaalsContact O-N 3.13Å; R431-Y441 HydrophobicContact CB-CE1 4.2Å; R431-Y441 HydrophobicContact CG-CD1 4.05Å; R431-Y441 HydrophobicContact CG-CE1 3.9Å
432	E	85	Confident	83.5	Confident	27 Å²	27	51.6 Å²	51.6	13%	0.126	25%	0.246	C	C	.	.	H	α-helix	trans	-60.7	-47.6	178.6	-170.3	-172.4	138.1	0	0	111.1	K298 W353 R365 G428 G429 A434 G435	K298-E432 IonicContact NZ-OE2 3.49Å; K298-E432 PolarHBondContact NZ-OE2 2.88Å; W353-E432 PolarHBondContact NE1-OE2 3.14Å; R365-E432 IonicContact CZ-OE1 2.79Å; R365-E432 IonicContact NH1-OE1 3.43Å; R365-E432 PolarHBondContact NH1-OE1 3.28Å; R365-E432 IonicContact NH1-OE2 3.61Å; R365-E432 IonicContact NH2-OE1 3.19Å; R365-E432 PolarHBondContact NH2-OE1 2.91Å; R365-E432 IonicContact NH2-OE2 2.63Å; G428-E432 WeakPolarHBondContact O-CB 3.15Å; G428-E432 PolarHBondContact O-N 2.86Å; G429-E432 PolarHBondContact O-N 3.42Å; E432-A434 VanDerWaalsContact C-N 3.26Å; E432-A434 PolarHBondContact O-N 3.13Å; E432-G435 PolarHBondContact O-N 2.84Å
433	A	83.8	Confident	81.7	Confident	72 Å²	72	57.7 Å²	57.7	60%	0.595	28%	0.277	S	S	*	.	H	α-helix	trans	-62.7	-30.9	176.3	0	0	0	0	0	113.1	P362 G429 G435	P362-A433 HydrophobicContact CG-CB 4.27Å; G429-A433 WeakPolarHBondContact O-CB 3.02Å; G429-A433 PolarHBondContact O-N 3.21Å; A433-G435 VanDerWaalsContact C-N 3.27Å; A433-G435 PolarHBondContact O-N 3.32Å
434	A	83.9	Confident	79.4	Confident	49 Å²	49	64 Å²	64	41%	0.405	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-0.8	174.4	0	0	0	0	0	113.9	R430 R431 E432 R436	R430-A434 WeakPolarHBondContact O-CB 3.48Å; R430-A434 PolarHBondContact O-N 3.04Å; R431-A434 PolarHBondContact O-N 3.37Å; E432-A434 VanDerWaalsContact C-N 3.26Å; E432-A434 PolarHBondContact O-N 3.13Å; A434-R436 VanDerWaalsContact C-N 3.26Å; A434-R436 HydrophobicContact CB-CG 4.05Å; A434-R436 PolarHBondContact O-N 3.44Å
435	G	77.3	Confident	77	Confident	29 Å²	29	68.9 Å²	68.9	30%	0.299	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	25.3	-179.3	0	0	0	0	0	114.1	R431 E432 A433	R431-G435 PolarHBondContact O-N 2.92Å; E432-G435 PolarHBondContact O-N 2.84Å; A433-G435 VanDerWaalsContact C-N 3.27Å; A433-G435 PolarHBondContact O-N 3.32Å
436	R	78.9	Confident	74.8	Confident	110 Å²	110	72 Å²	72	42%	0.415	36%	0.36	S	S	.	.	B	Isolated β-bridge	trans	-85.6	142.9	-177.6	-68.5	178.5	-175.8	176.2	0.9	111.4	R431 A434 Y441 I443	R431-R436 HydrophobicContact CG-CB 3.66Å; R431-R436 PolarHBondContact NH1-O 3.19Å; R431-R436 PolarHBondContact O-N 3.47Å; R431-R436 VanDerWaalsContact O-N 3.13Å; A434-R436 VanDerWaalsContact C-N 3.26Å; A434-R436 HydrophobicContact CB-CG 4.05Å; A434-R436 PolarHBondContact O-N 3.44Å; R436-Y441 WeakPolarHBondContact CD-O 3.38Å; R436-I443 HydrophobicContact CG-CG1 4.4Å
437	H	78.4	Confident	72.1	Confident	18 Å²	18	76.7 Å²	76.7	8%	0.083	39%	0.393	C	S	.	.			trans	-59	141.6	175.3	-165.7	-74.9	0	0	0	111.8	P294 L439 W440 Y441 R442	P294-H437 WeakPolarHBondContact CB-NE2 3.47Å; H437-L439 PolarHBondContact ND1-N 3.02Å; H437-L439 VanDerWaalsContact ND1-N 3.19Å; H437-L439 PolarHBondContact O-N 3.19Å; H437-W440 AromaticContact CD2-CE3 3.93Å; H437-W440 AromaticContact CE1-CE3 3.44Å; H437-W440 VanDerWaalsContact CE1-CE3 3.44Å; H437-W440 AromaticContact CE1-CZ3 3.57Å; H437-W440 AromaticContact CG-CE3 3.93Å; H437-W440 AromaticContact ND1-CE3 3.62Å; H437-W440 AromaticContact NE2-CE3 3.63Å; H437-W440 AromaticContact NE2-CZ3 3.54Å; H437-Y441 PolarHBondContact O-N 3.05Å; H437-R442 WeakPolarHBondContact CB-O 3.27Å; H437-R442 PolarHBondContact N-O 2.81Å
438	C	75.9	Confident	69.5	Low	0 Å²	0	83.5 Å²	83.5	0%	0	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-48.1	-178.6	57.9	0	0	0	0	114	P294 P299 V300	P294-C438 WeakPolarHBondContact O-CB 3.31Å; P294-C438 PolarHBondContact O-N 3.4Å; P294-C438 PolarHBondContact O-SG 3.36Å; P299-C438 HydrophobicContact CG-CB 4.32Å; V300-C438 WeakPolarHBondContact CG2-O 3.48Å
439	L	70.6	Confident	67.2	Low	89 Å²	89	88.5 Å²	88.5	47%	0.466	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-54.1	-178.8	-63.4	171.2	0	0	0	114.2	P299 V300 H437	P299-L439 HydrophobicContact CG-CD2 4.39Å; V300-L439 HydrophobicContact CG2-CD2 4.35Å; H437-L439 PolarHBondContact ND1-N 3.02Å; H437-L439 VanDerWaalsContact ND1-N 3.19Å; H437-L439 PolarHBondContact O-N 3.19Å
440	W	68.9	Low	64.7	Low	184 Å²	184	92.5 Å²	92.5	70%	0.697	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-3	-169.1	-63.5	-58.6	0	0	0	115.2	H437 R442	H437-W440 AromaticContact CD2-CE3 3.93Å; H437-W440 AromaticContact CE1-CE3 3.44Å; H437-W440 VanDerWaalsContact CE1-CE3 3.44Å; H437-W440 AromaticContact CE1-CZ3 3.57Å; H437-W440 AromaticContact CG-CE3 3.93Å; H437-W440 AromaticContact ND1-CE3 3.62Å; H437-W440 AromaticContact NE2-CE3 3.63Å; H437-W440 AromaticContact NE2-CZ3 3.54Å; W440-R442 PolarHBondContact O-N 2.89Å
441	Y	66.3	Low	62	Low	110 Å²	110	95.1 Å²	95.1	43%	0.431	50%	0.503	S	S	.	.			trans	51.3	11.2	-175.4	-76.9	-97.3	0	0	0	115.3	R431 R436 H437	R431-Y441 HydrophobicContact CB-CE1 4.2Å; R431-Y441 HydrophobicContact CG-CD1 4.05Å; R431-Y441 HydrophobicContact CG-CE1 3.9Å; R436-Y441 WeakPolarHBondContact CD-O 3.38Å; H437-Y441 PolarHBondContact O-N 3.05Å
442	R	66.5	Low	59.4	Low	199 Å²	199	102.5 Å²	102.5	75%	0.751	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-83.3	146.7	176	-73.8	-174.3	178.9	-173	0.2	110.8	H437 W440	H437-R442 WeakPolarHBondContact CB-O 3.27Å; H437-R442 PolarHBondContact N-O 2.81Å; W440-R442 PolarHBondContact O-N 2.89Å
443	I	57.1	Low	56.6	Low	128 Å²	128	111.9 Å²	111.9	66%	0.656	58%	0.576	S	S	*	*	B	Isolated β-bridge	trans	-71.5	126.8	176.4	-63.1	165.2	0	0	0	108.6	R436	R436-I443 HydrophobicContact CG-CG1 4.4Å
444	R	48.7	Very low	54	Low	133 Å²	133	114 Å²	114	50%	0.502	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-73.9	130.8	159.2	-90.7	-171.8	173.2	-171.5	-2.2	107.9	A446	R444-A446 PolarHBondContact O-N 3.27Å
445	P	43	Very low	51.3	Low	121 Å²	121	121.3 Å²	121.3	79%	0.786	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-61.5	124.6	163.4	24.8	-29.2	0	0	0	107.8	S447	P445-S447 PolarHBondContact O-N 2.84Å; P445-S447 VanDerWaalsContact O-N 3.16Å
446	A	46.8	Very low	49.1	Very low	70 Å²	70	126.3 Å²	126.3	58%	0.579	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-50.3	121.7	-175.2	0	0	0	0	0	110.8	R444 K448	R444-A446 PolarHBondContact O-N 3.27Å; A446-K448 PolarHBondContact O-N 2.76Å
447	S	36.3	Very low	46.7	Very low	99 Å²	99	124.6 Å²	124.6	69%	0.692	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-55.1	134.8	161	-175.4	0	0	0	0	107.5	P445 S449	P445-S447 PolarHBondContact O-N 2.84Å; P445-S447 VanDerWaalsContact O-N 3.16Å; S447-S449 PolarHBondContact O-N 3.11Å
448	K	36.7	Very low	44.3	Very low	213 Å²	213	131.8 Å²	131.8	93%	0.926	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	16.5	-164.1	-76.2	-179	174.8	178.2	0	116.5	A446	A446-K448 PolarHBondContact O-N 2.76Å
449	S	41.3	Very low	42.1	Very low	108 Å²	108	137.5 Å²	137.5	76%	0.755	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	-0.2	-178.4	60.7	0	0	0	0	116.4	S447	S447-S449 PolarHBondContact O-N 3.11Å
450	S	37.1	Very low	40.2	Very low	85 Å²	85	138.6 Å²	138.6	59%	0.594	73%	0.728	S	S	*	*			trans	-122.5	18.8	-175.7	66.8	0	0	0	0	117.1	L452	S450-L452 PolarHBondContact O-N 2.62Å
451	L	31.8	Very low	38.7	Very low	150 Å²	150	137.1 Å²	137.1	79%	0.785	73%	0.734	S	S	*	*			trans	-72.9	26.8	172.1	-92.3	166.3	0	0	0	114.8	R453	L451-R453 VanDerWaalsContact C-N 3.35Å; L451-R453 PolarHBondContact O-N 3.07Å
452	L	33.5	Very low	36.9	Very low	158 Å²	158	143 Å²	143	83%	0.827	76%	0.756	S	S	*	*			trans	-86.8	81.8	161	-82.8	156.3	0	0	0	107.8	S450 P454	S450-L452 PolarHBondContact O-N 2.62Å; L452-P454 WeakPolarHBondContact O-CD 3.47Å
453	R	25.5	Very low	35	Very low	225 Å²	225	140.6 Å²	140.6	85%	0.849	76%	0.758	S	S	*	*			trans	-66.1	108.8	160.8	-73	-178.6	175.9	-169.3	-1.2	107.3	L451 K455	L451-R453 VanDerWaalsContact C-N 3.35Å; L451-R453 PolarHBondContact O-N 3.07Å; R453-K455 PolarHBondContact O-N 3.07Å
454	P	30	Very low	33.8	Very low	116 Å²	116	141.4 Å²	141.4	75%	0.753	77%	0.768	S	S	*	*			trans	-77	118.1	169.2	-0.2	21.1	0	0	0	106.3	L452 V456	L452-P454 WeakPolarHBondContact O-CD 3.47Å; P454-V456 PolarHBondContact O-N 3.37Å
455	K	27.5	Very low	32.6	Very low	202 Å²	202	142.7 Å²	142.7	88%	0.878	78%	0.78	S	S	*	*			trans	-54.1	137.5	167.6	-76.7	176.2	175.8	175.9	0	108.5	R453 A457	R453-K455 PolarHBondContact O-N 3.07Å; K455-A457 PolarHBondContact O-N 3.25Å
456	V	30	Very low	32.1	Very low	134 Å²	134	142.6 Å²	142.6	81%	0.812	78%	0.779	S	S	*	*			trans	-51.3	96.7	171.6	178.1	0	0	0	0	108.8	P454 L458	P454-V456 PolarHBondContact O-N 3.37Å; V456-L458 HydrophobicContact CG1-CD1 4.12Å
457	A	28.1	Very low	31.5	Very low	75 Å²	75	142.8 Å²	142.8	62%	0.62	77%	0.773	S	S	*	*			trans	-93.2	103.1	164.8	0	0	0	0	0	106	K455 T459	K455-A457 PolarHBondContact O-N 3.25Å; A457-T459 HydrophobicContact CB-CG2 4.27Å; A457-T459 PolarHBondContact O-N 2.94Å
458	L	29.1	Very low	31.1	Very low	169 Å²	169	141.8 Å²	141.8	89%	0.885	77%	0.766	S	S	*	*			trans	-63.2	88.3	158.8	-81.7	108.8	0	0	0	107.1	V456	V456-L458 HydrophobicContact CG1-CD1 4.12Å
459	T	30.2	Very low	31	Very low	120 Å²	120	135.1 Å²	135.1	74%	0.736	75%	0.751	S	S	*	*			trans	-109.3	124.2	165.5	52.4	0	0	0	0	108.5	A457	A457-T459 HydrophobicContact CB-CG2 4.27Å; A457-T459 PolarHBondContact O-N 2.94Å
460	S	29.7	Very low	30.4	Very low	111 Å²	111	134.3 Å²	134.3	78%	0.776	75%	0.745	S	S	*	*			trans	-38	144.8	-179.1	50.6	0	0	0	0	115.9	R462	S460-R462 PolarHBondContact O-N 3.16Å; S460-R462 VanDerWaalsContact O-N 3.09Å
461	D	36.7	Very low	30.5	Very low	154 Å²	154	132.3 Å²	132.3	82%	0.824	73%	0.731	S	S	*	*	S	Bend	trans	-37.4	109.9	162.3	-76.6	-40.6	0	0	0	111.6
462	R	29.7	Very low	30.9	Very low	234 Å²	234	129 Å²	129	88%	0.883	71%	0.714	S	S	*	*			trans	177.7	-8.5	138.4	-97.4	162.6	-173	-160.5	0.9	117.3	S460	S460-R462 PolarHBondContact O-N 3.16Å; S460-R462 VanDerWaalsContact O-N 3.09Å
463	D	26.5	Very low	31.3	Very low	148 Å²	148	128.2 Å²	128.2	79%	0.791	71%	0.71	S	S	*	*			trans	-113.5	80.3	180	-69.4	-37.4	0	0	0	112.8	Q465	D463-Q465 PolarHBondContact O-N 2.68Å
464	V	32.4	Very low	32.1	Very low	145 Å²	145	124.6 Å²	124.6	88%	0.879	70%	0.703	S	S	*	*			trans	-77.2	80	160	-176.5	0	0	0	0	107.3
465	Q	23.5	Very low	33.3	Very low	160 Å²	160	121.7 Å²	121.7	75%	0.748	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-70.9	127.2	162.9	-71.4	-167.7	3.2	0	0	108.3	D463 V467	D463-Q465 PolarHBondContact O-N 2.68Å; Q465-V467 PolarHBondContact O-N 3Å
466	P	32.2	Very low	35	Very low	118 Å²	118	114.4 Å²	114.4	77%	0.766	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-62.9	126.3	174.2	24.8	-30.6	0	0	0	108.8	S468	P466-S468 PolarHBondContact O-N 2.61Å
467	V	34.7	Very low	36.8	Very low	74 Å²	74	109 Å²	109	45%	0.448	62%	0.616	S	S	.	*	P	Polyproline II helix	trans	-49.1	136.4	-178.7	177.7	0	0	0	0	110.7	Q465 A469 S471	Q465-V467 PolarHBondContact O-N 3Å; V467-A469 PolarHBondContact O-N 3.45Å; V467-S471 VanDerWaalsContact CG1-OG 3.26Å; V467-S471 WeakPolarHBondContact CG1-OG 3.33Å
468	S	27.4	Very low	38.9	Very low	78 Å²	78	110.8 Å²	110.8	55%	0.545	62%	0.621	S	S	.	*	P	Polyproline II helix	trans	-56.8	134	-178.7	51.5	0	0	0	0	112.7	P466 S470 S471	P466-S468 PolarHBondContact O-N 2.61Å; S468-S470 PolarHBondContact O-N 3.4Å; S468-S471 PolarHBondContact O-N 3.27Å; S468-S471 PolarHBondContact O-OG 3.09Å
469	A	33.4	Very low	41.1	Very low	74 Å²	74	104.1 Å²	104.1	61%	0.612	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	-14.6	-175.5	0	0	0	0	0	115.6	V467	V467-A469 PolarHBondContact O-N 3.45Å
470	S	30.3	Very low	43.6	Very low	90 Å²	90	99.4 Å²	99.4	63%	0.629	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-31.6	178.7	53.8	0	0	0	0	113.4	S468 N472	S468-S470 PolarHBondContact O-N 3.4Å; S470-N472 VanDerWaalsContact C-N 3.29Å; S470-N472 PolarHBondContact O-N 3Å
471	S	38.4	Very low	46	Very low	43 Å²	43	102.5 Å²	102.5	30%	0.301	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.3	-13.6	179	69.4	0	0	0	0	114.1	V467 S468 R475	V467-S471 VanDerWaalsContact CG1-OG 3.26Å; V467-S471 WeakPolarHBondContact CG1-OG 3.33Å; S468-S471 PolarHBondContact O-N 3.27Å; S468-S471 PolarHBondContact O-OG 3.09Å; S471-R475 PolarHBondContact O-NE 3.31Å; S471-R475 PolarHBondContact O-NH2 3.37Å
472	N	41.2	Very low	48.3	Very low	80 Å²	80	100.4 Å²	100.4	43%	0.428	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-27.1	176.1	-72.2	-11.1	0	0	0	112	S470 Q474 R475 V476	S470-N472 VanDerWaalsContact C-N 3.29Å; S470-N472 PolarHBondContact O-N 3Å; N472-Q474 PolarHBondContact O-N 3.04Å; N472-Q474 VanDerWaalsContact O-N 3.15Å; N472-R475 PolarHBondContact O-N 2.88Å; N472-R475 VanDerWaalsContact O-N 3.17Å; N472-R475 PolarHBondContact OD1-NH2 2.93Å; N472-V476 WeakPolarHBondContact O-CG2 3.41Å
473	L	41.3	Very low	50.9	Low	143 Å²	143	92.3 Å²	92.3	75%	0.749	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-25.8	-175.7	-140.2	89.6	0	0	0	113.5
474	Q	41.4	Very low	53.8	Low	149 Å²	149	88.2 Å²	88.2	70%	0.696	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-7.5	-176.6	-140.4	146	-19.5	0	0	113.5	N472	N472-Q474 PolarHBondContact O-N 3.04Å; N472-Q474 VanDerWaalsContact O-N 3.15Å
475	R	54.7	Low	56.4	Low	54 Å²	54	86.5 Å²	86.5	20%	0.204	48%	0.478	C	S	.	.	S	Bend	trans	-103.3	-5.8	-178.9	-79.4	-175.9	-93.9	172.1	-3.9	114.3	Q354 S471 N472	Q354-R475 PolarHBondContact O-NH1 2.96Å; S471-R475 PolarHBondContact O-NE 3.31Å; S471-R475 PolarHBondContact O-NH2 3.37Å; N472-R475 PolarHBondContact O-N 2.88Å; N472-R475 VanDerWaalsContact O-N 3.17Å; N472-R475 PolarHBondContact OD1-NH2 2.93Å
476	V	64.1	Low	59.4	Low	49 Å²	49	87.9 Å²	87.9	30%	0.297	48%	0.477	S	S	.	.			trans	-87	127.8	-170.4	170.4	0	0	0	0	111.4	N472 Q480 R481	N472-V476 WeakPolarHBondContact O-CG2 3.41Å; V476-Q480 HydrophobicContact CG1-CB 3.87Å; V476-Q480 HydrophobicContact CG1-CG 3.95Å; V476-R481 HydrophobicContact CG1-CB 4.08Å
477	N	68.4	Low	62	Low	21 Å²	21	82.7 Å²	82.7	11%	0.112	44%	0.442	C	S	.	.			trans	-62.1	148	174.6	-75.9	-19.1	0	0	0	111.5	V288 G479 Q480 R481 W794	V288-N477 PolarHBondContact O-ND2 2.91Å; N477-G479 PolarHBondContact O-N 3.44Å; N477-Q480 HydrophobicContact CB-CB 4.39Å; N477-Q480 PolarHBondContact O-N 2.9Å; N477-Q480 VanDerWaalsContact O-N 3.16Å; N477-R481 PolarHBondContact O-N 3.44Å; N477-W794 HydrophobicContact CB-CZ2 4.43Å
478	P	72.5	Confident	64.6	Low	112 Å²	112	83.8 Å²	83.8	73%	0.727	44%	0.441	S	S	*	.	H	α-helix	trans	-57.1	-36.6	178.6	22	-32.3	0	0	0	112.6	R481 M482	P478-R481 PolarHBondContact O-N 3.24Å; P478-M482 PolarHBondContact O-N 2.86Å
479	G	74.8	Confident	67.4	Low	30 Å²	30	82.3 Å²	82.3	31%	0.309	43%	0.434	S	S	.	.	H	α-helix	trans	-62.7	-47.9	175.6	0	0	0	0	0	113.1	N477 R481 M482 L483	N477-G479 PolarHBondContact O-N 3.44Å; G479-R481 VanDerWaalsContact C-N 3.3Å; G479-R481 PolarHBondContact O-N 2.95Å; G479-M482 PolarHBondContact O-N 3.12Å; G479-L483 PolarHBondContact O-N 2.93Å
480	Q	81.4	Confident	70	Confident	21 Å²	21	80.7 Å²	80.7	10%	0.098	41%	0.413	C	S	.	.	H	α-helix	trans	-59.2	-41.5	175.5	-175.1	-177.7	16.4	0	0	111.3	V476 N477 M482 L483 K484 W794	V476-Q480 HydrophobicContact CG1-CB 3.87Å; V476-Q480 HydrophobicContact CG1-CG 3.95Å; N477-Q480 HydrophobicContact CB-CB 4.39Å; N477-Q480 PolarHBondContact O-N 2.9Å; N477-Q480 VanDerWaalsContact O-N 3.16Å; Q480-M482 PolarHBondContact O-N 2.97Å; Q480-L483 PolarHBondContact O-N 2.84Å; Q480-K484 WeakPolarHBondContact O-CB 3.22Å; Q480-K484 PolarHBondContact O-N 3.14Å; Q480-W794 HydrophobicContact CB-CD2 3.63Å; Q480-W794 HydrophobicContact CB-CE3 3.73Å; Q480-W794 HydrophobicContact CB-CG 4.31Å; Q480-W794 HydrophobicContact CB-CH2 3.99Å; Q480-W794 HydrophobicContact CB-CZ2 3.9Å; Q480-W794 HydrophobicContact CB-CZ3 3.92Å; Q480-W794 HydrophobicContact CG-CB 4.27Å; Q480-W794 HydrophobicContact CG-CD2 3.58Å; Q480-W794 HydrophobicContact CG-CE3 3.87Å; Q480-W794 HydrophobicContact CG-CG 3.76Å
481	R	81.4	Confident	72.6	Confident	175 Å²	175	76.8 Å²	76.8	66%	0.66	38%	0.384	S	S	*	.	H	α-helix	trans	-61.9	-44.9	177.5	-173.8	178.3	178.9	-177.3	-0.5	111.8	V476 N477 P478 G479 L485	V476-R481 HydrophobicContact CG1-CB 4.08Å; N477-R481 PolarHBondContact O-N 3.44Å; P478-R481 PolarHBondContact O-N 3.24Å; G479-R481 VanDerWaalsContact C-N 3.3Å; G479-R481 PolarHBondContact O-N 2.95Å; R481-L485 WeakPolarHBondContact O-CG 3.06Å; R481-L485 PolarHBondContact O-N 3.4Å; R481-L485 VanDerWaalsContact O-N 3.15Å
482	M	84.4	Confident	74.8	Confident	110 Å²	110	78.1 Å²	78.1	54%	0.542	39%	0.391	S	S	.	.	H	α-helix	trans	-63.2	-51.6	178	-175.2	179.5	71	0	0	110.9	P478 G479 Q480 K484 L485 W486	P478-M482 PolarHBondContact O-N 2.86Å; G479-M482 PolarHBondContact O-N 3.12Å; Q480-M482 PolarHBondContact O-N 2.97Å; M482-K484 VanDerWaalsContact C-N 3.28Å; M482-K484 PolarHBondContact O-N 3.36Å; M482-L485 WeakPolarHBondContact O-CB 3.28Å; M482-L485 PolarHBondContact O-N 2.86Å; M482-W486 PolarHBondContact O-N 3.26Å; M482-W486 VanDerWaalsContact O-N 3.13Å
483	L	85.4	Confident	77.1	Confident	64 Å²	64	77.8 Å²	77.8	34%	0.335	39%	0.392	S	S	.	.	H	α-helix	trans	-62.1	-36.5	-179.9	-78.2	159.4	0	0	0	112.3	G479 Q480 L485 W486 Y487 F789 W794 I797	G479-L483 PolarHBondContact O-N 2.93Å; Q480-L483 PolarHBondContact O-N 2.84Å; L483-L485 VanDerWaalsContact C-N 3.31Å; L483-L485 PolarHBondContact O-N 3.37Å; L483-W486 WeakPolarHBondContact O-CB 3.46Å; L483-W486 PolarHBondContact O-N 3Å; L483-Y487 WeakPolarHBondContact O-CB 3.47Å; L483-Y487 PolarHBondContact O-N 3.08Å; L483-F789 HydrophobicContact CB-CZ 3.93Å; L483-W794 HydrophobicContact CD1-CE3 4.36Å; L483-W794 HydrophobicContact CD1-CZ3 3.67Å; L483-I797 HydrophobicContact CD1-CD1 4.42Å
484	K	86.1	Confident	79	Confident	62 Å²	62	77 Å²	77	27%	0.27	40%	0.395	S	S	.	.	H	α-helix	trans	-62.2	-36.5	173.2	-174.9	177.3	-170.5	160.9	0	112.9	Q480 M482 K488 F789 D790	Q480-K484 WeakPolarHBondContact O-CB 3.22Å; Q480-K484 PolarHBondContact O-N 3.14Å; M482-K484 VanDerWaalsContact C-N 3.28Å; M482-K484 PolarHBondContact O-N 3.36Å; K484-K488 VanDerWaalsContact O-CB 3.28Å; K484-K488 WeakPolarHBondContact O-CB 3.35Å; K484-K488 PolarHBondContact O-N 3.3Å; K484-F789 HydrophobicContact CB-CD1 4.3Å; K484-F789 HydrophobicContact CB-CE1 3.98Å; K484-F789 HydrophobicContact CG-CD1 4.43Å; K484-D790 WeakPolarHBondContact CD-OD1 3.24Å; K484-D790 VanDerWaalsContact CE-OD1 3.25Å; K484-D790 WeakPolarHBondContact CE-OD1 3.2Å; K484-D790 WeakPolarHBondContact CE-OD2 3.34Å; K484-D790 IonicContact NZ-OD1 3.97Å; K484-D790 PolarHBondContact NZ-OD1 3.35Å; K484-D790 IonicContact NZ-OD2 2.67Å; K484-D790 PolarHBondContact NZ-OD2 2.99Å
485	L	87	Confident	81.1	Confident	109 Å²	109	71.5 Å²	71.5	57%	0.571	38%	0.378	S	S	*	.	H	α-helix	trans	-66.9	-42.3	175.3	-69.8	168.9	0	0	0	111.3	R481 M482 L483 K488 A489	R481-L485 WeakPolarHBondContact O-CG 3.06Å; R481-L485 PolarHBondContact O-N 3.4Å; R481-L485 VanDerWaalsContact O-N 3.15Å; M482-L485 WeakPolarHBondContact O-CB 3.28Å; M482-L485 PolarHBondContact O-N 2.86Å; L483-L485 VanDerWaalsContact C-N 3.31Å; L483-L485 PolarHBondContact O-N 3.37Å; L485-K488 PolarHBondContact O-N 2.9Å; L485-A489 WeakPolarHBondContact O-CB 3.28Å; L485-A489 PolarHBondContact O-N 3.48Å
486	W	87.1	Confident	82.7	Confident	190 Å²	190	69.4 Å²	69.4	72%	0.72	37%	0.372	S	S	*	.	H	α-helix	trans	-62.1	-45.8	173.5	-82	88.4	0	0	0	111.9	M482 L483 K488 A489 F490	M482-W486 PolarHBondContact O-N 3.26Å; M482-W486 VanDerWaalsContact O-N 3.13Å; L483-W486 WeakPolarHBondContact O-CB 3.46Å; L483-W486 PolarHBondContact O-N 3Å; W486-K488 VanDerWaalsContact C-N 3.33Å; W486-K488 PolarHBondContact O-N 2.65Å; W486-A489 WeakPolarHBondContact O-CB 3.07Å; W486-A489 PolarHBondContact O-N 3.42Å; W486-A489 VanDerWaalsContact O-N 3.16Å; W486-F490 PolarHBondContact O-N 3.15Å
487	Y	87.3	Confident	83.8	Confident	9 Å²	9	71.9 Å²	71.9	4%	0.035	38%	0.376	C	S	.	.	H	α-helix	trans	-63.8	-40.1	177.8	-167.3	-112.3	0	0	0	111.7	L483 F490 W491 M785 L786 F789 L837	L483-Y487 WeakPolarHBondContact O-CB 3.47Å; L483-Y487 PolarHBondContact O-N 3.08Å; Y487-F490 WeakPolarHBondContact O-CB 3.04Å; Y487-F490 PolarHBondContact O-N 3.41Å; Y487-W491 AromaticContact CD1-CD1 3.88Å; Y487-W491 AromaticContact CE1-CD1 3.58Å; Y487-W491 AromaticContact CE1-NE1 3.31Å; Y487-W491 VanDerWaalsContact CE1-NE1 3.31Å; Y487-W491 AromaticContact CE2-NE1 3.44Å; Y487-W491 AromaticContact CZ-CD1 3.7Å; Y487-W491 AromaticContact CZ-NE1 2.99Å; Y487-W491 VanDerWaalsContact O-CD1 3.24Å; Y487-W491 PolarHBondContact O-N 3.24Å; Y487-W491 VanDerWaalsContact O-N 3.16Å; Y487-W491 PolarHBondContact OH-NE1 3.3Å; Y487-M785 HydrophobicContact CE1-CB 4.3Å; Y487-M785 WeakPolarHBondContact CE1-O 3.41Å; Y487-L786 HydrophobicContact CD1-CD2 4.1Å; Y487-F789 HydrophobicContact CD1-CB 3.59Å; Y487-F789 HydrophobicContact CD1-CD1 4.46Å; Y487-F789 AromaticContact CD1-CD2 3.81Å; Y487-F789 HydrophobicContact CD1-CD2 3.81Å; Y487-F789 AromaticContact CD1-CG 3.69Å; Y487-F789 HydrophobicContact CD1-CG 3.69Å; Y487-F789 HydrophobicContact CD2-CD2 4.16Å; Y487-F789 HydrophobicContact CE1-CB 3.51Å; Y487-F789 HydrophobicContact CE1-CD2 4.1Å; Y487-F789 HydrophobicContact CE1-CG 4.04Å; Y487-F789 HydrophobicContact CE2-CD2 4.43Å; Y487-F789 HydrophobicContact CG-CB 4.47Å; Y487-F789 AromaticContact CG-CD2 3.84Å; Y487-F789 HydrophobicContact CG-CD2 3.84Å; Y487-F789 HydrophobicContact CG-CE2 4.33Å; Y487-F789 HydrophobicContact CG-CG 4.12Å; Y487-L837 VanDerWaalsContact CE2-O 3.25Å; Y487-L837 WeakPolarHBondContact CE2-O 3.17Å; Y487-L837 PolarHBondContact OH-O 3.23Å
488	K	87.7	Confident	84.8	Confident	97 Å²	97	80.5 Å²	80.5	42%	0.422	41%	0.407	S	S	.	.	H	α-helix	trans	-59.4	-48.2	170.7	-173.6	175.4	179.3	-175.8	0	111.5	K484 L485 W486 F490 W491 T492 E782 L786	K484-K488 VanDerWaalsContact O-CB 3.28Å; K484-K488 WeakPolarHBondContact O-CB 3.35Å; K484-K488 PolarHBondContact O-N 3.3Å; L485-K488 PolarHBondContact O-N 2.9Å; W486-K488 VanDerWaalsContact C-N 3.33Å; W486-K488 PolarHBondContact O-N 2.65Å; K488-F490 VanDerWaalsContact C-N 3.26Å; K488-F490 PolarHBondContact O-N 2.98Å; K488-W491 PolarHBondContact O-N 3.16Å; K488-W491 VanDerWaalsContact O-N 3.09Å; K488-T492 HydrophobicContact CG-CG2 4.09Å; K488-T492 WeakPolarHBondContact O-CG2 3.49Å; K488-T492 PolarHBondContact O-N 3.34Å; K488-T492 PolarHBondContact O-OG1 3.17Å; K488-T492 VanDerWaalsContact O-OG1 3.11Å; K488-E782 WeakPolarHBondContact CE-OE1 3.5Å; K488-L786 HydrophobicContact CB-CD2 3.75Å; K488-L786 HydrophobicContact CD-CD1 4.24Å; K488-L786 HydrophobicContact CG-CD1 4.12Å; K488-L786 HydrophobicContact CG-CD2 4.24Å
489	A	87.2	Confident	85.6	Confident	47 Å²	47	80.2 Å²	80.2	39%	0.388	40%	0.398	S	S	.	.	H	α-helix	trans	-57.8	-39.8	178.7	0	0	0	0	0	112	L485 W486 T492 T493	L485-A489 WeakPolarHBondContact O-CB 3.28Å; L485-A489 PolarHBondContact O-N 3.48Å; W486-A489 WeakPolarHBondContact O-CB 3.07Å; W486-A489 PolarHBondContact O-N 3.42Å; W486-A489 VanDerWaalsContact O-N 3.16Å; A489-T492 WeakPolarHBondContact CA-OG1 3.25Å; A489-T492 PolarHBondContact O-N 3.04Å; A489-T492 PolarHBondContact O-OG1 3.01Å; A489-T492 VanDerWaalsContact O-OG1 3.08Å; A489-T493 WeakPolarHBondContact O-CB 3.36Å; A489-T493 PolarHBondContact O-N 3.41Å; A489-T493 PolarHBondContact O-OG1 2.87Å
490	F	88.4	Confident	86.4	Confident	40 Å²	40	79.1 Å²	79.1	18%	0.175	39%	0.387	C	S	.	.	H	α-helix	trans	-59	-48	173.8	175.3	-97.6	0	0	0	111.8	W486 Y487 K488 S496 A500 F838	W486-F490 PolarHBondContact O-N 3.15Å; Y487-F490 WeakPolarHBondContact O-CB 3.04Å; Y487-F490 PolarHBondContact O-N 3.41Å; K488-F490 VanDerWaalsContact C-N 3.26Å; K488-F490 PolarHBondContact O-N 2.98Å; F490-S496 VanDerWaalsContact O-CB 3.27Å; F490-S496 WeakPolarHBondContact O-CB 3.37Å; F490-S496 PolarHBondContact O-OG 2.89Å; F490-A500 HydrophobicContact CE2-CB 4.16Å; F490-A500 HydrophobicContact CZ-CB 3.85Å; F490-F838 HydrophobicContact CD1-CD1 4.17Å; F490-F838 HydrophobicContact CD1-CE1 4.45Å; F490-F838 HydrophobicContact CD2-CD1 4.29Å; F490-F838 HydrophobicContact CD2-CE1 4.32Å; F490-F838 AromaticContact CE1-CD1 3.96Å; F490-F838 HydrophobicContact CE1-CD1 3.96Å; F490-F838 HydrophobicContact CE2-CD1 4.08Å; F490-F838 HydrophobicContact CG-CD1 4.34Å; F490-F838 HydrophobicContact CG-CE1 4.28Å; F490-F838 AromaticContact CZ-CD1 3.91Å; F490-F838 HydrophobicContact CZ-CD1 3.91Å
491	W	84.5	Confident	86.8	Confident	7 Å²	7	80.3 Å²	80.3	3%	0.027	39%	0.393	C	S	.	.	H	α-helix	trans	-72.6	-27.8	-179.3	-76.9	102.5	0	0	0	114.6	Y487 K488 T781 E782 M785 P841 V842 T845	Y487-W491 AromaticContact CD1-CD1 3.88Å; Y487-W491 AromaticContact CE1-CD1 3.58Å; Y487-W491 AromaticContact CE1-NE1 3.31Å; Y487-W491 VanDerWaalsContact CE1-NE1 3.31Å; Y487-W491 AromaticContact CE2-NE1 3.44Å; Y487-W491 AromaticContact CZ-CD1 3.7Å; Y487-W491 AromaticContact CZ-NE1 2.99Å; Y487-W491 VanDerWaalsContact O-CD1 3.24Å; Y487-W491 PolarHBondContact O-N 3.24Å; Y487-W491 VanDerWaalsContact O-N 3.16Å; Y487-W491 PolarHBondContact OH-NE1 3.3Å; K488-W491 PolarHBondContact O-N 3.16Å; K488-W491 VanDerWaalsContact O-N 3.09Å; W491-T781 HydrophobicContact CZ3-CG2 4.33Å; W491-E782 HydrophobicContact CB-CG 4.33Å; W491-M785 HydrophobicContact CD2-CB 4.1Å; W491-M785 HydrophobicContact CD2-CG 4.07Å; W491-M785 HydrophobicContact CE3-CG 4.25Å; W491-M785 HydrophobicContact CG-CB 4.38Å; W491-M785 HydrophobicContact CH2-CE 4.15Å; W491-M785 HydrophobicContact CH2-CG 3.82Å; W491-M785 HydrophobicContact CH2-SD 4.36Å; W491-M785 HydrophobicContact CZ2-CB 4.1Å; W491-M785 HydrophobicContact CZ2-CG 3.61Å; W491-M785 HydrophobicContact CZ2-SD 4.18Å; W491-M785 HydrophobicContact CZ3-CG 4.13Å; W491-P841 HydrophobicContact CH2-CB 4.07Å; W491-P841 HydrophobicContact CZ2-CB 3.57Å; W491-V842 HydrophobicContact CH2-CG2 3.91Å; W491-V842 HydrophobicContact CZ2-CG2 4.42Å; W491-T845 HydrophobicContact CH2-CG2 4.27Å; W491-T845 HydrophobicContact CZ3-CG2 4.25Å
492	T	85.4	Confident	87.4	Confident	71 Å²	71	75.9 Å²	75.9	44%	0.436	39%	0.385	S	S	.	.	H	α-helix	trans	-81.4	-26	178.5	54.9	0	0	0	0	113.4	K488 A489 P494 E782	K488-T492 HydrophobicContact CG-CG2 4.09Å; K488-T492 WeakPolarHBondContact O-CG2 3.49Å; K488-T492 PolarHBondContact O-N 3.34Å; K488-T492 PolarHBondContact O-OG1 3.17Å; K488-T492 VanDerWaalsContact O-OG1 3.11Å; A489-T492 WeakPolarHBondContact CA-OG1 3.25Å; A489-T492 PolarHBondContact O-N 3.04Å; A489-T492 PolarHBondContact O-OG1 3.01Å; A489-T492 VanDerWaalsContact O-OG1 3.08Å; T492-P494 WeakPolarHBondContact O-CD 3.37Å; T492-E782 WeakPolarHBondContact CG2-OE1 3.12Å
493	T	87.8	Confident	87.9	Confident	74 Å²	74	74.8 Å²	74.8	45%	0.454	38%	0.38	S	S	.	.	S	Bend	trans	-77.1	121.4	-175.3	-57.6	0	0	0	0	110.9	A489 G495 S496	A489-T493 WeakPolarHBondContact O-CB 3.36Å; A489-T493 PolarHBondContact O-N 3.41Å; A489-T493 PolarHBondContact O-OG1 2.87Å; T493-G495 PolarHBondContact O-N 3.2Å; T493-S496 PolarHBondContact O-N 3.39Å; T493-S496 PolarHBondContact O-OG 2.89Å
494	P	82.1	Confident	88.3	Confident	126 Å²	126	72 Å²	72	82%	0.818	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	130.5	175.9	27.1	-32.8	0	0	0	110.2	T492	T492-P494 WeakPolarHBondContact O-CD 3.37Å
495	G	85.6	Confident	88.8	Confident	33 Å²	33	73.4 Å²	73.4	34%	0.34	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.1	-17.7	179.4	0	0	0	0	0	115.7	T493 R497 W498 I499	T493-G495 PolarHBondContact O-N 3.2Å; G495-R497 PolarHBondContact O-N 3.48Å; G495-R497 VanDerWaalsContact O-N 3.16Å; G495-W498 PolarHBondContact O-N 3.46Å; G495-I499 WeakPolarHBondContact O-CG1 3.37Å; G495-I499 PolarHBondContact O-N 3.3Å
496	S	87.8	Confident	89.2	Confident	11 Å²	11	73.4 Å²	73.4	8%	0.077	38%	0.379	C	S	.	.	H	α-helix	trans	-54.4	-36.7	177.9	62.2	0	0	0	0	113.3	F490 T493 I499 A500	F490-S496 VanDerWaalsContact O-CB 3.27Å; F490-S496 WeakPolarHBondContact O-CB 3.37Å; F490-S496 PolarHBondContact O-OG 2.89Å; T493-S496 PolarHBondContact O-N 3.39Å; T493-S496 PolarHBondContact O-OG 2.89Å; S496-I499 PolarHBondContact O-N 3.49Å; S496-A500 WeakPolarHBondContact O-CB 3.34Å; S496-A500 PolarHBondContact O-N 3.17Å
497	R	87.1	Confident	89.7	Confident	100 Å²	100	65.4 Å²	65.4	38%	0.377	35%	0.349	S	S	.	.	H	α-helix	trans	-65	-43.8	177	-56	-179.8	-165.1	169.4	5.8	112.3	G495 I499 A500 M501 V842	G495-R497 PolarHBondContact O-N 3.48Å; G495-R497 VanDerWaalsContact O-N 3.16Å; R497-I499 VanDerWaalsContact C-N 3.32Å; R497-A500 PolarHBondContact O-N 2.93Å; R497-M501 WeakPolarHBondContact O-CG 3.38Å; R497-M501 PolarHBondContact O-N 3.24Å; R497-V842 HydrophobicContact CG-CG2 4.48Å
498	W	89.3	Confident	90.1	Very high	202 Å²	202	66.5 Å²	66.5	77%	0.765	36%	0.356	S	S	*	.	H	α-helix	trans	-65.9	-38.1	176.7	-72.4	114.9	0	0	0	111.2	G495 M501 T502	G495-W498 PolarHBondContact O-N 3.46Å; W498-M501 PolarHBondContact O-N 2.8Å; W498-T502 WeakPolarHBondContact O-CB 3.35Å; W498-T502 PolarHBondContact O-N 3.1Å; W498-T502 PolarHBondContact O-OG1 3.33Å
499	I	90.5	Very high	90.5	Very high	106 Å²	106	64 Å²	64	54%	0.544	36%	0.357	S	S	.	.	H	α-helix	trans	-62.8	-48.9	174.1	-64.1	168.1	0	0	0	110.3	G495 S496 R497 M501 T502 I503	G495-I499 WeakPolarHBondContact O-CG1 3.37Å; G495-I499 PolarHBondContact O-N 3.3Å; S496-I499 PolarHBondContact O-N 3.49Å; R497-I499 VanDerWaalsContact C-N 3.32Å; I499-M501 VanDerWaalsContact C-N 3.34Å; I499-M501 PolarHBondContact O-N 2.91Å; I499-T502 WeakPolarHBondContact O-CB 3.37Å; I499-T502 PolarHBondContact O-N 2.89Å; I499-T502 VanDerWaalsContact O-N 3.13Å; I499-I503 HydrophobicContact CG2-CD1 3.91Å; I499-I503 WeakPolarHBondContact O-CG1 3.26Å; I499-I503 PolarHBondContact O-N 3.29Å
500	A	90	Very high	91	Very high	8 Å²	8	66 Å²	66	7%	0.066	36%	0.36	C	S	.	.	H	α-helix	trans	-59.4	-43.1	177.9	0	0	0	0	0	112.3	F490 S496 R497 T502 I503 Y504	F490-A500 HydrophobicContact CE2-CB 4.16Å; F490-A500 HydrophobicContact CZ-CB 3.85Å; S496-A500 WeakPolarHBondContact O-CB 3.34Å; S496-A500 PolarHBondContact O-N 3.17Å; R497-A500 PolarHBondContact O-N 2.93Å; A500-T502 VanDerWaalsContact C-N 3.35Å; A500-T502 PolarHBondContact O-N 3.19Å; A500-I503 PolarHBondContact O-N 2.95Å; A500-Y504 WeakPolarHBondContact O-CB 3.38Å; A500-Y504 PolarHBondContact O-N 3.32Å
501	M	91	Very high	91.4	Very high	45 Å²	45	64 Å²	64	22%	0.222	35%	0.352	C	S	.	.	H	α-helix	trans	-66.5	-35.1	175.3	-70.1	-56.1	-62.1	0	0	112.7	R497 W498 I499 Y504 V505 V842 L843	R497-M501 WeakPolarHBondContact O-CG 3.38Å; R497-M501 PolarHBondContact O-N 3.24Å; W498-M501 PolarHBondContact O-N 2.8Å; I499-M501 VanDerWaalsContact C-N 3.34Å; I499-M501 PolarHBondContact O-N 2.91Å; M501-Y504 HydrophobicContact CE-CD1 4.11Å; M501-Y504 WeakPolarHBondContact O-CB 3.31Å; M501-Y504 PolarHBondContact O-N 3.45Å; M501-V505 WeakPolarHBondContact O-CG2 3.42Å; M501-V505 PolarHBondContact O-N 3.47Å; M501-V842 HydrophobicContact CG-CG1 3.87Å; M501-V842 HydrophobicContact SD-CG1 3.73Å; M501-L843 HydrophobicContact CE-CD2 3.94Å; M501-L843 HydrophobicContact SD-CD2 4.24Å
502	T	93.8	Very high	92	Very high	82 Å²	82	69.8 Å²	69.8	50%	0.503	38%	0.377	S	S	.	.	H	α-helix	trans	-66.4	-45.1	175.8	-55.8	0	0	0	0	110.8	W498 I499 A500 Y504 V505 L506	W498-T502 WeakPolarHBondContact O-CB 3.35Å; W498-T502 PolarHBondContact O-N 3.1Å; W498-T502 PolarHBondContact O-OG1 3.33Å; I499-T502 WeakPolarHBondContact O-CB 3.37Å; I499-T502 PolarHBondContact O-N 2.89Å; I499-T502 VanDerWaalsContact O-N 3.13Å; A500-T502 VanDerWaalsContact C-N 3.35Å; A500-T502 PolarHBondContact O-N 3.19Å; T502-Y504 VanDerWaalsContact C-N 3.27Å; T502-Y504 PolarHBondContact O-N 3.11Å; T502-V505 PolarHBondContact O-N 2.88Å; T502-L506 HydrophobicContact CG2-CD1 4.42Å; T502-L506 WeakPolarHBondContact O-CG 3.47Å; T502-L506 PolarHBondContact O-N 3.22Å
503	I	94.6	Very high	92.5	Very high	87 Å²	87	72.2 Å²	72.2	45%	0.446	38%	0.379	S	S	.	.	H	α-helix	trans	-59.8	-41.8	174	-66.6	168.2	0	0	0	110.1	I499 A500 L506 Y507 F834	I499-I503 HydrophobicContact CG2-CD1 3.91Å; I499-I503 WeakPolarHBondContact O-CG1 3.26Å; I499-I503 PolarHBondContact O-N 3.29Å; A500-I503 PolarHBondContact O-N 2.95Å; I503-L506 PolarHBondContact O-N 3.08Å; I503-Y507 VanDerWaalsContact O-CB 3.32Å; I503-Y507 WeakPolarHBondContact O-CB 3.32Å; I503-Y507 PolarHBondContact O-N 2.91Å; I503-F834 HydrophobicContact CG2-CE2 4.3Å; I503-F834 HydrophobicContact CG2-CZ 3.86Å
504	Y	95	Very high	92.9	Very high	6 Å²	6	68.7 Å²	68.7	2%	0.024	36%	0.357	C	S	.	.	H	α-helix	trans	-63.3	-43.8	177.6	179.9	-117.5	0	0	0	113	A500 M501 T502 Y507 L508 W727 S731 F834 H835 V839	A500-Y504 WeakPolarHBondContact O-CB 3.38Å; A500-Y504 PolarHBondContact O-N 3.32Å; M501-Y504 HydrophobicContact CE-CD1 4.11Å; M501-Y504 WeakPolarHBondContact O-CB 3.31Å; M501-Y504 PolarHBondContact O-N 3.45Å; T502-Y504 VanDerWaalsContact C-N 3.27Å; T502-Y504 PolarHBondContact O-N 3.11Å; Y504-Y507 AromaticContact CD2-CD1 3.92Å; Y504-Y507 HydrophobicContact CD2-CD1 3.92Å; Y504-Y507 HydrophobicContact CD2-CE1 4.48Å; Y504-Y507 HydrophobicContact CE2-CD1 4.01Å; Y504-Y507 HydrophobicContact CE2-CE1 4.17Å; Y504-Y507 WeakPolarHBondContact O-CB 3.34Å; Y504-Y507 PolarHBondContact O-N 3.16Å; Y504-L508 HydrophobicContact CD1-CD1 4.17Å; Y504-L508 HydrophobicContact CE1-CD1 3.63Å; Y504-L508 HydrophobicContact CE1-CG 4.28Å; Y504-L508 HydrophobicContact CE2-CD1 4.37Å; Y504-L508 HydrophobicContact CE2-CD2 4.26Å; Y504-L508 HydrophobicContact CE2-CG 4.13Å; Y504-L508 WeakPolarHBondContact O-CG 3.38Å; Y504-L508 PolarHBondContact O-N 3.45Å; Y504-W727 AromaticContact CZ-NE1 3.98Å; Y504-W727 PolarHBondContact OH-NE1 3.07Å; Y504-S731 VanDerWaalsContact CE2-OG 3.22Å; Y504-S731 WeakPolarHBondContact CE2-OG 3.29Å; Y504-S731 VanDerWaalsContact OH-CB 3.28Å; Y504-S731 WeakPolarHBondContact OH-CB 3.45Å; Y504-S731 PolarHBondContact OH-OG 3.44Å; Y504-F834 HydrophobicContact CD2-CE1 4.41Å; Y504-H835 AromaticContact CE2-NE2 3.55Å; Y504-V839 HydrophobicContact CD1-CG1 4.13Å; Y504-V839 HydrophobicContact CD2-CB 4.46Å; Y504-V839 HydrophobicContact CD2-CG1 3.75Å; Y504-V839 HydrophobicContact CD2-CG2 3.81Å; Y504-V839 HydrophobicContact CE1-CG1 4.14Å; Y504-V839 HydrophobicContact CE2-CG1 3.78Å; Y504-V839 HydrophobicContact CE2-CG2 4.41Å; Y504-V839 HydrophobicContact CG-CG1 3.94Å; Y504-V839 HydrophobicContact CG-CG2 4.23Å
505	V	95.2	Very high	93.3	Very high	92 Å²	92	64.7 Å²	64.7	56%	0.558	33%	0.331	S	S	*	.	H	α-helix	trans	-64.9	-40.3	175.9	171.8	0	0	0	0	111.5	M501 T502 L508 G509	M501-V505 WeakPolarHBondContact O-CG2 3.42Å; M501-V505 PolarHBondContact O-N 3.47Å; T502-V505 PolarHBondContact O-N 2.88Å; V505-L508 PolarHBondContact O-N 2.95Å; V505-G509 PolarHBondContact O-N 3.3Å
506	L	96.2	Very high	93.7	Very high	108 Å²	108	67.2 Å²	67.2	57%	0.565	34%	0.342	S	S	*	.	H	α-helix	trans	-62.3	-44.1	173.6	-71.9	171.4	0	0	0	111.5	T502 I503 L508 G509 I510	T502-L506 HydrophobicContact CG2-CD1 4.42Å; T502-L506 WeakPolarHBondContact O-CG 3.47Å; T502-L506 PolarHBondContact O-N 3.22Å; I503-L506 PolarHBondContact O-N 3.08Å; L506-L508 PolarHBondContact O-N 2.81Å; L506-G509 PolarHBondContact O-N 2.68Å; L506-I510 WeakPolarHBondContact O-CG1 3.23Å; L506-I510 PolarHBondContact O-N 3.16Å
507	Y	96.7	Very high	93.9	Very high	22 Å²	22	71.9 Å²	71.9	9%	0.086	36%	0.361	C	S	.	.	H	α-helix	trans	-57.5	-46.6	174.5	157.5	-96.6	0	0	0	111.7	I503 Y504 G509 I510 S511 S731 G735 L739 L831 H835	I503-Y507 VanDerWaalsContact O-CB 3.32Å; I503-Y507 WeakPolarHBondContact O-CB 3.32Å; I503-Y507 PolarHBondContact O-N 2.91Å; Y504-Y507 AromaticContact CD2-CD1 3.92Å; Y504-Y507 HydrophobicContact CD2-CD1 3.92Å; Y504-Y507 HydrophobicContact CD2-CE1 4.48Å; Y504-Y507 HydrophobicContact CE2-CD1 4.01Å; Y504-Y507 HydrophobicContact CE2-CE1 4.17Å; Y504-Y507 WeakPolarHBondContact O-CB 3.34Å; Y504-Y507 PolarHBondContact O-N 3.16Å; Y507-G509 VanDerWaalsContact C-N 3.32Å; Y507-G509 PolarHBondContact O-N 2.72Å; Y507-I510 PolarHBondContact O-N 3.12Å; Y507-S511 WeakPolarHBondContact CD2-OG 3.49Å; Y507-S511 WeakPolarHBondContact CE2-OG 3.49Å; Y507-S511 WeakPolarHBondContact O-CB 3.4Å; Y507-S511 PolarHBondContact O-N 3.47Å; Y507-S511 PolarHBondContact O-OG 3.46Å; Y507-S731 WeakPolarHBondContact CE1-OG 3.38Å; Y507-S731 PolarHBondContact OH-O 3.47Å; Y507-G735 VanDerWaalsContact OH-CA 3.29Å; Y507-G735 WeakPolarHBondContact OH-CA 3.28Å; Y507-L739 HydrophobicContact CE2-CD1 4.45Å; Y507-L831 HydrophobicContact CD2-CD2 4.02Å; Y507-L831 HydrophobicContact CE2-CD1 4.1Å; Y507-L831 HydrophobicContact CE2-CD2 3.34Å; Y507-L831 HydrophobicContact CE2-CG 4.34Å; Y507-H835 AromaticContact CE1-CE1 3.58Å; Y507-H835 AromaticContact CE1-NE2 3.69Å; Y507-H835 AromaticContact CZ-CE1 3.68Å
508	L	96.4	Very high	93.9	Very high	33 Å²	33	70.1 Å²	70.1	17%	0.173	36%	0.359	C	S	.	.	H	α-helix	trans	-60	-42.3	176.9	-73.8	175.3	0	0	0	111.7	Y504 V505 L506 S511 F512 W727 S731 M734	Y504-L508 HydrophobicContact CD1-CD1 4.17Å; Y504-L508 HydrophobicContact CE1-CD1 3.63Å; Y504-L508 HydrophobicContact CE1-CG 4.28Å; Y504-L508 HydrophobicContact CE2-CD1 4.37Å; Y504-L508 HydrophobicContact CE2-CD2 4.26Å; Y504-L508 HydrophobicContact CE2-CG 4.13Å; Y504-L508 WeakPolarHBondContact O-CG 3.38Å; Y504-L508 PolarHBondContact O-N 3.45Å; V505-L508 PolarHBondContact O-N 2.95Å; L506-L508 PolarHBondContact O-N 2.81Å; L508-S511 PolarHBondContact O-N 3.11Å; L508-F512 VanDerWaalsContact O-CB 3.31Å; L508-F512 WeakPolarHBondContact O-CB 3.47Å; L508-F512 PolarHBondContact O-N 3.29Å; L508-W727 HydrophobicContact CD1-CZ2 4.37Å; L508-S731 WeakPolarHBondContact CD2-OG 3.15Å; L508-M734 HydrophobicContact CD2-CE 3.62Å
509	G	97	Very high	93.8	Very high	44 Å²	44	69.3 Å²	69.3	45%	0.454	36%	0.355	S	S	.	.	H	α-helix	trans	-63.1	-45.3	177	0	0	0	0	0	113.3	V505 L506 Y507 Y513	V505-G509 PolarHBondContact O-N 3.3Å; L506-G509 PolarHBondContact O-N 2.68Å; Y507-G509 VanDerWaalsContact C-N 3.32Å; Y507-G509 PolarHBondContact O-N 2.72Å; G509-Y513 WeakPolarHBondContact O-CB 3.48Å; G509-Y513 PolarHBondContact O-N 2.97Å
510	I	97	Very high	93.4	Very high	88 Å²	88	66 Å²	66	45%	0.451	34%	0.339	S	S	.	.	H	α-helix	trans	-65.4	-43.5	177.1	-66.8	167.5	0	0	0	110.6	L506 Y507 Y513 G514 L739 L742	L506-I510 WeakPolarHBondContact O-CG1 3.23Å; L506-I510 PolarHBondContact O-N 3.16Å; Y507-I510 PolarHBondContact O-N 3.12Å; I510-Y513 PolarHBondContact O-N 3.21Å; I510-G514 PolarHBondContact O-N 3.47Å; I510-L739 HydrophobicContact CG2-CD2 4.07Å; I510-L742 HydrophobicContact CG2-CD1 3.54Å
511	S	96.5	Very high	93	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-61.8	-48.8	179.4	-61.3	0	0	0	0	111.2	Y507 L508 Y513 G514 T515 G735 G738	Y507-S511 WeakPolarHBondContact CD2-OG 3.49Å; Y507-S511 WeakPolarHBondContact CE2-OG 3.49Å; Y507-S511 WeakPolarHBondContact O-CB 3.4Å; Y507-S511 PolarHBondContact O-N 3.47Å; Y507-S511 PolarHBondContact O-OG 3.46Å; L508-S511 PolarHBondContact O-N 3.11Å; S511-Y513 PolarHBondContact O-N 3.08Å; S511-G514 PolarHBondContact O-N 3.46Å; S511-T515 PolarHBondContact O-N 3.09Å; S511-T515 PolarHBondContact O-OG1 3.05Å; S511-T515 VanDerWaalsContact O-OG1 3.07Å; S511-G735 VanDerWaalsContact OG-CA 3.26Å; S511-G735 WeakPolarHBondContact OG-CA 3.21Å; S511-G738 WeakPolarHBondContact O-CA 3.4Å
512	F	96.3	Very high	92.2	Very high	127 Å²	127	66.4 Å²	66.4	56%	0.557	34%	0.34	S	S	*	.	H	α-helix	trans	-60.4	-44.7	176.3	-177.5	-102.6	0	0	0	111.9	L508 G514 T515 C516 M734	L508-F512 VanDerWaalsContact O-CB 3.31Å; L508-F512 WeakPolarHBondContact O-CB 3.47Å; L508-F512 PolarHBondContact O-N 3.29Å; F512-G514 VanDerWaalsContact C-N 3.33Å; F512-G514 PolarHBondContact O-N 3.15Å; F512-T515 PolarHBondContact O-N 3.36Å; F512-C516 PolarHBondContact O-N 3.34Å; F512-C516 PolarHBondContact O-SG 3.01Å; F512-C516 VanDerWaalsContact O-SG 3.35Å; F512-M734 HydrophobicContact CB-CE 4.46Å; F512-M734 HydrophobicContact CB-SD 4.15Å; F512-M734 HydrophobicContact CD2-SD 4.16Å
513	Y	96.9	Very high	91.3	Very high	122 Å²	122	63.1 Å²	63.1	48%	0.478	32%	0.32	S	S	.	.	H	α-helix	trans	-59.2	-42.9	175.9	175.4	-100.4	0	0	0	112.8	G509 I510 S511 C516 K517 L742	G509-Y513 WeakPolarHBondContact O-CB 3.48Å; G509-Y513 PolarHBondContact O-N 2.97Å; I510-Y513 PolarHBondContact O-N 3.21Å; S511-Y513 PolarHBondContact O-N 3.08Å; Y513-C516 PolarHBondContact O-N 3.26Å; Y513-K517 HydrophobicContact CE1-CD 3.85Å; Y513-K517 HydrophobicContact CE2-CD 4.33Å; Y513-K517 VanDerWaalsContact CZ-CE 3.45Å; Y513-K517 PolarHBondContact O-N 2.72Å; Y513-K517 WeakPolarHBondContact OH-CE 3.33Å; Y513-K517 PolarHBondContact OH-NZ 3.46Å; Y513-L742 HydrophobicContact CD1-CD2 3.96Å; Y513-L742 HydrophobicContact CE1-CD2 3.97Å
514	G	95	Very high	90.4	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-61.3	-48.4	175.1	0	0	0	0	0	111.9	I510 S511 F512 C516 K517 I518 G738 T741	I510-G514 PolarHBondContact O-N 3.47Å; S511-G514 PolarHBondContact O-N 3.46Å; F512-G514 VanDerWaalsContact C-N 3.33Å; F512-G514 PolarHBondContact O-N 3.15Å; G514-C516 VanDerWaalsContact C-N 3.3Å; G514-C516 PolarHBondContact O-N 3.39Å; G514-K517 PolarHBondContact O-N 3.11Å; G514-I518 PolarHBondContact O-N 2.92Å; G514-G738 WeakPolarHBondContact CA-O 3.27Å; G514-T741 WeakPolarHBondContact O-CG2 3.15Å
515	T	92.4	Very high	89.3	Confident	42 Å²	42	59.8 Å²	59.8	26%	0.258	31%	0.307	S	S	.	.	H	α-helix	trans	-61.7	-36.6	-180	-58.6	0	0	0	0	112.2	S511 F512 K517 I518 M734 I737 G738	S511-T515 PolarHBondContact O-N 3.09Å; S511-T515 PolarHBondContact O-OG1 3.05Å; S511-T515 VanDerWaalsContact O-OG1 3.07Å; F512-T515 PolarHBondContact O-N 3.36Å; T515-K517 PolarHBondContact O-N 3.27Å; T515-I518 WeakPolarHBondContact O-CG2 3.33Å; T515-I518 PolarHBondContact O-N 3.04Å; T515-M734 PolarHBondContact OG1-O 3.3Å; T515-I737 HydrophobicContact CG2-CG2 4.14Å; T515-G738 PolarHBondContact OG1-N 2.84Å
516	C	92.8	Very high	88.6	Confident	87 Å²	87	58.3 Å²	58.3	59%	0.588	29%	0.294	S	S	*	.	H	α-helix	trans	-67.5	-18	174.1	-68.8	0	0	0	0	114.1	F512 Y513 G514	F512-C516 PolarHBondContact O-N 3.34Å; F512-C516 PolarHBondContact O-SG 3.01Å; F512-C516 VanDerWaalsContact O-SG 3.35Å; Y513-C516 PolarHBondContact O-N 3.26Å; G514-C516 VanDerWaalsContact C-N 3.3Å; G514-C516 PolarHBondContact O-N 3.39Å
517	K	91.9	Very high	87.7	Confident	109 Å²	109	53.5 Å²	53.5	47%	0.474	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	3.8	-177.9	-84.8	-166.8	163	-169.3	0	114.3	Y513 G514 T515 R519 T741	Y513-K517 HydrophobicContact CE1-CD 3.85Å; Y513-K517 HydrophobicContact CE2-CD 4.33Å; Y513-K517 VanDerWaalsContact CZ-CE 3.45Å; Y513-K517 PolarHBondContact O-N 2.72Å; Y513-K517 WeakPolarHBondContact OH-CE 3.33Å; Y513-K517 PolarHBondContact OH-NZ 3.46Å; G514-K517 PolarHBondContact O-N 3.11Å; T515-K517 PolarHBondContact O-N 3.27Å; K517-R519 PolarHBondContact O-N 2.81Å; K517-T741 HydrophobicContact CB-CG2 4.18Å
518	I	88.3	Confident	86.9	Confident	62 Å²	62	52.5 Å²	52.5	32%	0.318	27%	0.265	S	S	.	.			trans	-58.3	124.7	-177.9	-165.2	168.1	0	0	0	110.6	G514 T515 I737 T741 M747	G514-I518 PolarHBondContact O-N 2.92Å; T515-I518 WeakPolarHBondContact O-CG2 3.33Å; T515-I518 PolarHBondContact O-N 3.04Å; I518-I737 HydrophobicContact CD1-CG2 4.06Å; I518-T741 HydrophobicContact CB-CG2 4.35Å; I518-M747 HydrophobicContact CD1-CB 4.03Å; I518-M747 HydrophobicContact CD1-CG 4.28Å; I518-M747 HydrophobicContact CD1-SD 3.88Å; I518-M747 HydrophobicContact CG1-CB 3.95Å; I518-M747 HydrophobicContact CG1-SD 4.38Å
519	R	86.6	Confident	86.3	Confident	185 Å²	185	51 Å²	51	70%	0.698	26%	0.257	S	S	*	.			trans	-108.7	142.3	177.9	-67	-176.6	178.1	-166.8	-3.9	109.1	K517 M747	K517-R519 PolarHBondContact O-N 2.81Å; R519-M747 WeakPolarHBondContact O-CB 3.5Å; R519-M747 PolarHBondContact O-N 3.47Å
520	I	82.8	Confident	85.5	Confident	38 Å²	38	50.9 Å²	50.9	20%	0.195	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-94.1	121.3	173	-59.8	170.1	0	0	0	107	V656 V690 L693 K694 M747	I520-V656 HydrophobicContact CB-CG2 4.28Å; I520-V656 HydrophobicContact CG2-CG2 4.48Å; I520-V656 WeakPolarHBondContact O-CG2 3.44Å; I520-V690 HydrophobicContact CG2-CG1 4.23Å; I520-L693 HydrophobicContact CG2-CD2 4.32Å; I520-K694 HydrophobicContact CD1-CB 3.78Å; I520-K694 HydrophobicContact CD1-CD 4.21Å; I520-K694 HydrophobicContact CD1-CG 4Å; I520-M747 HydrophobicContact CG1-CB 4.23Å; I520-M747 HydrophobicContact CG1-CG 4.46Å; I520-M747 HydrophobicContact CG1-SD 4.08Å
521	N	80.1	Confident	84.8	Confident	47 Å²	47	52.5 Å²	52.5	25%	0.251	26%	0.261	S	S	.	.			trans	-147.6	113.1	176.6	-168.8	16.2	0	0	0	109.6	D746 M747	N521-D746 HydrophobicContact CB-CB 3.64Å; N521-D746 VanDerWaalsContact CB-OD2 3.25Å; N521-D746 WeakPolarHBondContact CB-OD2 3.14Å; N521-D746 PolarHBondContact ND2-OD2 2.73Å; N521-M747 PolarHBondContact N-O 3.41Å
522	L	74.8	Confident	84.3	Confident	14 Å²	14	52.8 Å²	52.8	7%	0.073	26%	0.263	C	S	.	.			trans	-106.6	74.1	-178.9	-172.4	58.3	0	0	0	109.8	I686 Q689 V690 D748 P749	L522-I686 HydrophobicContact CB-CG2 4.09Å; L522-I686 HydrophobicContact CD2-CG2 3.71Å; L522-I686 HydrophobicContact CG-CG2 3.89Å; L522-Q689 HydrophobicContact CD2-CB 3.89Å; L522-Q689 HydrophobicContact CD2-CG 3.62Å; L522-V690 HydrophobicContact CB-CG2 3.85Å; L522-V690 HydrophobicContact CD2-CG2 4.19Å; L522-D748 HydrophobicContact CD1-CB 4.28Å; L522-P749 HydrophobicContact CD1-CG 4.29Å
523	T	75.5	Confident	83.6	Confident	13 Å²	13	50.4 Å²	50.4	8%	0.08	26%	0.26	C	S	.	.			trans	-84.9	126.1	174.2	15.6	0	0	0	0	110.4	G525 H526 E542	T523-G525 PolarHBondContact O-N 2.87Å; T523-H526 WeakPolarHBondContact O-CB 3.45Å; T523-H526 PolarHBondContact O-N 3.29Å; T523-H526 PolarHBondContact OG1-CE1 3.42Å; T523-H526 PolarHBondContact OG1-ND1 3.4Å; T523-H526 PolarHBondContact OG1-NE2 3.11Å; T523-E542 WeakPolarHBondContact CG2-OE1 3.25Å
524	P	74.1	Confident	83.2	Confident	11 Å²	11	44.7 Å²	44.7	7%	0.071	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-53.9	-29.8	175.2	-26.9	34.4	0	0	0	113.1	H526 L527 W655 I686	P524-H526 PolarHBondContact O-N 3.13Å; P524-L527 PolarHBondContact O-N 3.15Å; P524-L527 VanDerWaalsContact O-N 3.08Å; P524-W655 HydrophobicContact CG-CZ2 4.34Å; P524-I686 HydrophobicContact CG-CD1 3.82Å
525	G	73.3	Confident	82.8	Confident	11 Å²	11	49.3 Å²	49.3	11%	0.113	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-59.8	-21.4	176.2	0	0	0	0	0	115.1	T523 L527 N816	T523-G525 PolarHBondContact O-N 2.87Å; G525-L527 VanDerWaalsContact C-N 3.3Å; G525-N816 PolarHBondContact O-ND2 2.99Å
526	H	79.8	Confident	82.6	Confident	61 Å²	61	50.8 Å²	50.8	28%	0.282	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-75.5	-17.1	176.2	-67.5	178.2	0	0	0	113.3	T523 P524 D746 N816	T523-H526 WeakPolarHBondContact O-CB 3.45Å; T523-H526 PolarHBondContact O-N 3.29Å; T523-H526 PolarHBondContact OG1-CE1 3.42Å; T523-H526 PolarHBondContact OG1-ND1 3.4Å; T523-H526 PolarHBondContact OG1-NE2 3.11Å; P524-H526 PolarHBondContact O-N 3.13Å; H526-D746 IonicContact CE1-OD2 3.19Å; H526-N816 WeakPolarHBondContact O-CB 3.44Å
527	L	76.7	Confident	82.5	Confident	7 Å²	7	46.9 Å²	46.9	4%	0.037	23%	0.232	C	C	.	.	S	Bend	trans	-92.7	-9.9	177.2	-61	174.4	0	0	0	112.8	M67 Y71 I263 P524 G525 V817	M67-L527 HydrophobicContact SD-CD1 3.45Å; M67-L527 WeakPolarHBondContact SD-CD1 3.1Å; Y71-L527 HydrophobicContact CD2-CD1 4.41Å; Y71-L527 HydrophobicContact CE1-CD1 4.34Å; Y71-L527 HydrophobicContact CE2-CD1 3.8Å; Y71-L527 WeakPolarHBondContact OH-CD2 3.45Å; I263-L527 HydrophobicContact CD1-CB 4.32Å; I263-L527 HydrophobicContact CG1-CB 4.36Å; P524-L527 PolarHBondContact O-N 3.15Å; P524-L527 VanDerWaalsContact O-N 3.08Å; G525-L527 VanDerWaalsContact C-N 3.3Å; L527-V817 HydrophobicContact CD2-CG2 4.09Å
528	L	81.5	Confident	82.3	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	21%	0.213	C	C	.	.	S	Bend	trans	-86.5	154.7	-175.6	-61.5	177.6	0	0	0	113.2	L259 E262 I263 L534	L259-L528 HydrophobicContact CD1-CD2 3.81Å; E262-L528 HydrophobicContact CB-CD2 3.89Å; I263-L528 HydrophobicContact CG1-CD2 4.13Å; L528-L534 HydrophobicContact CD1-CB 3.9Å; L528-L534 HydrophobicContact CD1-CD2 3.97Å; L528-L534 HydrophobicContact CD1-CG 4.12Å; L528-L534 HydrophobicContact CD2-CD2 3.93Å
529	V	82.9	Confident	82.3	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.006	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-66.2	143.9	166.4	-175.5	0	0	0	0	109.7	R265 Y269 D531 S532 P814	R265-V529 HydrophobicContact CB-CG2 4.32Å; Y269-V529 HydrophobicContact CD2-CG1 4.01Å; Y269-V529 HydrophobicContact CD2-CG2 4.12Å; Y269-V529 HydrophobicContact CE2-CG1 3.76Å; Y269-V529 HydrophobicContact CE2-CG2 4.26Å; V529-D531 VanDerWaalsContact C-N 3.26Å; V529-D531 PolarHBondContact O-N 2.77Å; V529-S532 WeakPolarHBondContact O-CB 3.47Å; V529-S532 PolarHBondContact O-N 2.91Å; V529-P814 CarbonylContact C-O 3.55Å; V529-P814 VanDerWaalsContact CA-O 3.23Å; V529-P814 WeakPolarHBondContact CA-O 3.4Å; V529-P814 HydrophobicContact CG1-CB 4.25Å; V529-P814 HydrophobicContact CG1-CG 3.86Å; V529-P814 WeakPolarHBondContact CG1-O 3.38Å
530	A	80.3	Confident	82.4	Confident	42 Å²	42	35.4 Å²	35.4	35%	0.347	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-36.9	-175.4	0	0	0	0	0	113.3	S532 P814	A530-S532 VanDerWaalsContact C-N 3.29Å; A530-S532 PolarHBondContact O-N 3.25Å; A530-P814 HydrophobicContact CB-CB 4.07Å; A530-P814 PolarHBondContact N-O 3.03Å
531	D	82.9	Confident	82.7	Confident	123 Å²	123	33.8 Å²	33.8	66%	0.658	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.3	17.5	178.6	-58.7	-30.5	0	0	0	113	V529	V529-D531 VanDerWaalsContact C-N 3.26Å; V529-D531 PolarHBondContact O-N 2.77Å
532	S	85.4	Confident	83	Confident	6 Å²	6	34.1 Å²	34.1	4%	0.042	18%	0.175	C	C	.	.			trans	-71.2	127.2	178.4	-173.4	0	0	0	0	111.3	E262 R265 V529 A530 L534 K535	E262-S532 VanDerWaalsContact OE2-CB 3.27Å; E262-S532 WeakPolarHBondContact OE2-CB 3.42Å; E262-S532 PolarHBondContact OE2-OG 2.92Å; R265-S532 VanDerWaalsContact NH2-CA 3.31Å; V529-S532 WeakPolarHBondContact O-CB 3.47Å; V529-S532 PolarHBondContact O-N 2.91Å; A530-S532 VanDerWaalsContact C-N 3.29Å; A530-S532 PolarHBondContact O-N 3.25Å; S532-L534 PolarHBondContact O-N 3.4Å; S532-L534 VanDerWaalsContact O-N 3.15Å; S532-L534 WeakPolarHBondContact OG-CB 3.29Å; S532-L534 PolarHBondContact OG-N 3.5Å; S532-K535 VanDerWaalsContact O-CB 3.27Å; S532-K535 WeakPolarHBondContact O-CB 3.35Å; S532-K535 PolarHBondContact O-N 3.42Å
533	P	82.6	Confident	83.7	Confident	76 Å²	76	37.2 Å²	37.2	49%	0.494	19%	0.192	S	C	.	.	H	α-helix	trans	-60.6	-25.1	173.3	26.2	-34.1	0	0	0	111.6	K535 R536	P533-K535 PolarHBondContact O-N 3.22Å; P533-R536 PolarHBondContact O-N 2.87Å
534	L	86.8	Confident	84.3	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-64.2	-26.3	177.5	-160.1	66.7	0	0	0	112.5	S253 F254 I258 L259 L528 S532 R536 Y537 V538	S253-L534 WeakPolarHBondContact O-CD1 3.49Å; F254-L534 HydrophobicContact CB-CD1 3.81Å; F254-L534 HydrophobicContact CD2-CD1 3.45Å; F254-L534 VanDerWaalsContact CD2-CD1 3.45Å; F254-L534 HydrophobicContact CD2-CD2 4.18Å; F254-L534 HydrophobicContact CD2-CG 4.01Å; F254-L534 HydrophobicContact CE2-CD1 4.41Å; F254-L534 HydrophobicContact CE2-CD2 4.38Å; F254-L534 HydrophobicContact CG-CD1 4.02Å; I258-L534 HydrophobicContact CG2-CD1 3.86Å; I258-L534 HydrophobicContact CG2-CD2 4.35Å; L259-L534 HydrophobicContact CB-CD2 3.94Å; L259-L534 HydrophobicContact CD1-CD2 3.59Å; L259-L534 HydrophobicContact CG-CD2 4.32Å; L528-L534 HydrophobicContact CD1-CB 3.9Å; L528-L534 HydrophobicContact CD1-CD2 3.97Å; L528-L534 HydrophobicContact CD1-CG 4.12Å; L528-L534 HydrophobicContact CD2-CD2 3.93Å; S532-L534 PolarHBondContact O-N 3.4Å; S532-L534 VanDerWaalsContact O-N 3.15Å; S532-L534 WeakPolarHBondContact OG-CB 3.29Å; S532-L534 PolarHBondContact OG-N 3.5Å; L534-R536 VanDerWaalsContact C-N 3.27Å; L534-R536 PolarHBondContact O-N 3.46Å; L534-Y537 WeakPolarHBondContact O-CB 3.23Å; L534-Y537 PolarHBondContact O-N 2.93Å; L534-V538 WeakPolarHBondContact O-CG2 3.46Å; L534-V538 PolarHBondContact O-N 3.29Å
535	K	87.4	Confident	84.9	Confident	97 Å²	97	37.7 Å²	37.7	42%	0.422	19%	0.192	S	C	.	.	H	α-helix	trans	-61.8	-35.9	176.5	-168.5	173.9	-177.8	176	0	111.9	S532 P533 W539	S532-K535 VanDerWaalsContact O-CB 3.27Å; S532-K535 WeakPolarHBondContact O-CB 3.35Å; S532-K535 PolarHBondContact O-N 3.42Å; P533-K535 PolarHBondContact O-N 3.22Å; K535-W539 WeakPolarHBondContact O-CB 3.44Å; K535-W539 PolarHBondContact O-N 3.32Å
536	R	88.3	Confident	85.5	Confident	74 Å²	74	38 Å²	38	28%	0.279	19%	0.19	S	C	.	.	H	α-helix	trans	-68.4	-42.6	175.9	-178.2	60.8	172.6	160.8	7.2	111.3	N109 N252 P533 L534 W539 L540	N109-R536 PolarHBondContact OD1-NH2 3.29Å; N252-R536 WeakPolarHBondContact OD1-CG 3.26Å; P533-R536 PolarHBondContact O-N 2.87Å; L534-R536 VanDerWaalsContact C-N 3.27Å; L534-R536 PolarHBondContact O-N 3.46Å; R536-W539 PolarHBondContact O-N 3.15Å; R536-L540 HydrophobicContact CG-CD1 4.29Å; R536-L540 VanDerWaalsContact O-CG 3.31Å; R536-L540 WeakPolarHBondContact O-CG 3.38Å; R536-L540 PolarHBondContact O-N 3.42Å
537	Y	89.9	Confident	85.7	Confident	5 Å²	5	36.1 Å²	36.1	2%	0.02	18%	0.183	C	C	.	.	H	α-helix	trans	-59.1	-51.1	173.7	173.2	-90.7	0	0	0	111.5	F101 H216 N252 F254 L534 W539 L540 A541	F101-Y537 HydrophobicContact CB-CE2 4.07Å; F101-Y537 WeakPolarHBondContact CB-OH 3.48Å; H216-Y537 AromaticContact NE2-CE2 3.8Å; H216-Y537 AromaticContact NE2-CZ 3.74Å; H216-Y537 PolarHBondContact NE2-OH 2.85Å; N252-Y537 HydrophobicContact CB-CD2 4.36Å; N252-Y537 WeakPolarHBondContact O-CD2 3.29Å; F254-Y537 HydrophobicContact CB-CD1 3.37Å; F254-Y537 HydrophobicContact CB-CD2 3.9Å; F254-Y537 HydrophobicContact CB-CE1 3.17Å; F254-Y537 HydrophobicContact CB-CE2 3.71Å; F254-Y537 HydrophobicContact CB-CG 3.71Å; F254-Y537 HydrophobicContact CD1-CE1 4.06Å; F254-Y537 AromaticContact CD2-CD1 3.61Å; F254-Y537 HydrophobicContact CD2-CD1 3.61Å; F254-Y537 AromaticContact CD2-CE1 3.49Å; F254-Y537 HydrophobicContact CD2-CE1 3.49Å; F254-Y537 VanDerWaalsContact CD2-CE1 3.49Å; F254-Y537 HydrophobicContact CE2-CE1 4.4Å; F254-Y537 AromaticContact CG-CD1 3.73Å; F254-Y537 HydrophobicContact CG-CD1 3.73Å; F254-Y537 AromaticContact CG-CE1 3.31Å; F254-Y537 HydrophobicContact CG-CE1 3.31Å; F254-Y537 AromaticContact CG-CZ 3.81Å; L534-Y537 WeakPolarHBondContact O-CB 3.23Å; L534-Y537 PolarHBondContact O-N 2.93Å; Y537-W539 VanDerWaalsContact C-N 3.3Å; Y537-W539 PolarHBondContact O-N 2.63Å; Y537-L540 WeakPolarHBondContact O-CB 3.3Å; Y537-L540 PolarHBondContact O-N 2.61Å; Y537-L540 VanDerWaalsContact O-N 3.08Å; Y537-A541 HydrophobicContact CE1-CB 4.38Å; Y537-A541 PolarHBondContact O-N 3.41Å
538	V	88.5	Confident	86.1	Confident	11 Å²	11	37.7 Å²	37.7	7%	0.067	19%	0.19	C	C	.	.	H	α-helix	trans	-58.5	-44.7	-179.1	171.8	0	0	0	0	110.3	L534 L540 A541 E542	L534-V538 WeakPolarHBondContact O-CG2 3.46Å; L534-V538 PolarHBondContact O-N 3.29Å; V538-L540 PolarHBondContact O-N 3.06Å; V538-A541 PolarHBondContact O-N 3.39Å; V538-E542 HydrophobicContact CG1-CG 4.29Å; V538-E542 VanDerWaalsContact CG1-OE1 3.23Å; V538-E542 WeakPolarHBondContact CG1-OE1 3.08Å; V538-E542 WeakPolarHBondContact O-CB 3.36Å; V538-E542 WeakPolarHBondContact O-CG 3.12Å; V538-E542 PolarHBondContact O-N 2.96Å
539	W	88.5	Confident	86.3	Confident	102 Å²	102	37.6 Å²	37.6	39%	0.386	19%	0.19	S	C	.	.	H	α-helix	trans	-61	-40.6	175.7	-178.5	89	0	0	0	113.1	K535 R536 Y537 N543 F544	K535-W539 WeakPolarHBondContact O-CB 3.44Å; K535-W539 PolarHBondContact O-N 3.32Å; R536-W539 PolarHBondContact O-N 3.15Å; Y537-W539 VanDerWaalsContact C-N 3.3Å; Y537-W539 PolarHBondContact O-N 2.63Å; W539-N543 VanDerWaalsContact CD1-ND2 3.28Å; W539-N543 PolarHBondContact NE1-ND2 3.15Å; W539-N543 WeakPolarHBondContact O-CB 3.48Å; W539-N543 PolarHBondContact O-N 3.1Å; W539-N543 VanDerWaalsContact O-N 3.12Å; W539-N543 PolarHBondContact O-ND2 3.49Å; W539-F544 HydrophobicContact CH2-CE2 4.01Å; W539-F544 HydrophobicContact CH2-CZ 4.43Å; W539-F544 AromaticContact CZ3-CE2 3.75Å; W539-F544 HydrophobicContact CZ3-CE2 3.75Å
540	L	89.4	Confident	86.5	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-65.9	-42.3	176.1	-73.3	168.6	0	0	0	111.1	A105 L214 N252 R536 Y537 V538 F544	A105-L540 HydrophobicContact CB-CD1 4.29Å; A105-L540 HydrophobicContact CB-CD2 4.37Å; L214-L540 HydrophobicContact CD1-CB 4.21Å; L214-L540 HydrophobicContact CD1-CD1 4.05Å; L214-L540 HydrophobicContact CD1-CD2 4.38Å; L214-L540 HydrophobicContact CD1-CG 4.45Å; L214-L540 HydrophobicContact CD2-CB 4.21Å; N252-L540 HydrophobicContact CB-CD1 4.39Å; N252-L540 VanDerWaalsContact ND2-CD1 3.34Å; N252-L540 WeakPolarHBondContact ND2-CD1 3.41Å; R536-L540 HydrophobicContact CG-CD1 4.29Å; R536-L540 VanDerWaalsContact O-CG 3.31Å; R536-L540 WeakPolarHBondContact O-CG 3.38Å; R536-L540 PolarHBondContact O-N 3.42Å; Y537-L540 WeakPolarHBondContact O-CB 3.3Å; Y537-L540 PolarHBondContact O-N 2.61Å; Y537-L540 VanDerWaalsContact O-N 3.08Å; V538-L540 PolarHBondContact O-N 3.06Å; L540-F544 HydrophobicContact CD2-CD2 3.75Å; L540-F544 HydrophobicContact CD2-CE2 3.82Å; L540-F544 VanDerWaalsContact O-CB 3.32Å; L540-F544 WeakPolarHBondContact O-CB 3.31Å; L540-F544 PolarHBondContact O-N 3.31Å
541	A	88.4	Confident	86.9	Confident	3 Å²	3	37.8 Å²	37.8	3%	0.025	19%	0.185	C	C	.	.	I	π-helix	trans	-63.5	-47.1	177.8	0	0	0	0	0	111.7	Y537 V538 N543 V545 Y546	Y537-A541 HydrophobicContact CE1-CB 4.38Å; Y537-A541 PolarHBondContact O-N 3.41Å; V538-A541 PolarHBondContact O-N 3.39Å; A541-N543 PolarHBondContact O-N 2.95Å; A541-V545 WeakPolarHBondContact O-CA 3.35Å; A541-V545 WeakPolarHBondContact O-CB 3.48Å; A541-V545 PolarHBondContact O-N 2.99Å; A541-Y546 HydrophobicContact CB-CE1 4.19Å; A541-Y546 HydrophobicContact CB-CE2 4.26Å; A541-Y546 PolarHBondContact O-N 3.45Å
542	E	86.8	Confident	87.3	Confident	55 Å²	55	32 Å²	32	26%	0.257	15%	0.154	S	C	.	.	I	π-helix	trans	-64.6	-37.1	-179.7	-74.2	172.8	179.5	0	0	113.5	T523 V538 Y546 P547	T523-E542 WeakPolarHBondContact CG2-OE1 3.25Å; V538-E542 HydrophobicContact CG1-CG 4.29Å; V538-E542 VanDerWaalsContact CG1-OE1 3.23Å; V538-E542 WeakPolarHBondContact CG1-OE1 3.08Å; V538-E542 WeakPolarHBondContact O-CB 3.36Å; V538-E542 WeakPolarHBondContact O-CG 3.12Å; V538-E542 PolarHBondContact O-N 2.96Å; E542-Y546 HydrophobicContact CB-CD2 4.35Å; E542-Y546 HydrophobicContact CG-CD2 3.94Å; E542-Y546 HydrophobicContact CG-CE2 3.82Å; E542-P547 WeakPolarHBondContact O-CD 3.36Å; E542-P547 WeakPolarHBondContact O-CG 3.38Å
543	N	88.1	Confident	87.6	Confident	79 Å²	79	33.2 Å²	33.2	42%	0.422	16%	0.158	S	C	.	.	I	π-helix	trans	-91.9	-30.1	-176.6	-69.7	-63.8	0	0	0	114	W539 A541	W539-N543 VanDerWaalsContact CD1-ND2 3.28Å; W539-N543 PolarHBondContact NE1-ND2 3.15Å; W539-N543 WeakPolarHBondContact O-CB 3.48Å; W539-N543 PolarHBondContact O-N 3.1Å; W539-N543 VanDerWaalsContact O-N 3.12Å; W539-N543 PolarHBondContact O-ND2 3.49Å; A541-N543 PolarHBondContact O-N 2.95Å
544	F	88.2	Confident	88.1	Confident	31 Å²	31	29.6 Å²	29.6	14%	0.136	14%	0.135	C	C	.	.	I	π-helix	trans	-116.3	-27.8	-172.2	-62.9	-60.8	0	0	0	114.8	G200 G201 K213 L214 W539 L540 Q548	G200-F544 CarbonylContact C-O 3.49Å; G200-F544 WeakPolarHBondContact CA-O 3.22Å; G201-F544 PolarHBondContact N-O 3.35Å; G201-F544 VanDerWaalsContact N-O 3.11Å; K213-F544 HydrophobicContact CD-CE1 3.85Å; K213-F544 HydrophobicContact CD-CZ 4.3Å; L214-F544 HydrophobicContact CB-CB 4.31Å; L214-F544 HydrophobicContact CD2-CB 4.1Å; W539-F544 HydrophobicContact CH2-CE2 4.01Å; W539-F544 HydrophobicContact CH2-CZ 4.43Å; W539-F544 AromaticContact CZ3-CE2 3.75Å; W539-F544 HydrophobicContact CZ3-CE2 3.75Å; L540-F544 HydrophobicContact CD2-CD2 3.75Å; L540-F544 HydrophobicContact CD2-CE2 3.82Å; L540-F544 VanDerWaalsContact O-CB 3.32Å; L540-F544 WeakPolarHBondContact O-CB 3.31Å; L540-F544 PolarHBondContact O-N 3.31Å; F544-Q548 WeakPolarHBondContact O-CG 3.28Å
545	V	86.9	Confident	88.4	Confident	2 Å²	2	29.6 Å²	29.6	1%	0.012	13%	0.134	C	C	.	.	I	π-helix	trans	-96.1	-62.3	-176.8	-176.2	0	0	0	0	110.8	L214 H216 A541 P547 Q548 G549 F550	L214-V545 HydrophobicContact CD2-CG2 3.35Å; H216-V545 HydrophobicContact CB-CG2 4.48Å; A541-V545 WeakPolarHBondContact O-CA 3.35Å; A541-V545 WeakPolarHBondContact O-CB 3.48Å; A541-V545 PolarHBondContact O-N 2.99Å; V545-P547 VanDerWaalsContact C-CD 3.46Å; V545-P547 VanDerWaalsContact C-N 3.32Å; V545-Q548 PolarHBondContact O-N 3.28Å; V545-G549 PolarHBondContact O-N 2.9Å; V545-G549 VanDerWaalsContact O-N 3.12Å; V545-F550 HydrophobicContact CG1-CD2 3.79Å; V545-F550 HydrophobicContact CG1-CE2 4.16Å
546	Y	86.2	Confident	88.7	Confident	17 Å²	17	25 Å²	25	7%	0.067	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-39.5	-175.7	-56	-22.6	0	0	0	113.2	A541 E542 Q548 G549 V652 W655	A541-Y546 HydrophobicContact CB-CE1 4.19Å; A541-Y546 HydrophobicContact CB-CE2 4.26Å; A541-Y546 PolarHBondContact O-N 3.45Å; E542-Y546 HydrophobicContact CB-CD2 4.35Å; E542-Y546 HydrophobicContact CG-CD2 3.94Å; E542-Y546 HydrophobicContact CG-CE2 3.82Å; Y546-Q548 PolarHBondContact O-N 3.24Å; Y546-G549 PolarHBondContact O-N 3.5Å; Y546-V652 WeakPolarHBondContact CB-O 3.27Å; Y546-W655 HydrophobicContact CE2-CZ2 4.28Å
547	P	84.6	Confident	88.9	Confident	22 Å²	22	23.4 Å²	23.4	14%	0.143	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-10.7	178.5	-20.2	35.6	0	0	0	115.6	E542 V545 R651 N653	E542-P547 WeakPolarHBondContact O-CD 3.36Å; E542-P547 WeakPolarHBondContact O-CG 3.38Å; V545-P547 VanDerWaalsContact C-CD 3.46Å; V545-P547 VanDerWaalsContact C-N 3.32Å; P547-R651 PolarHBondContact O-NE 3Å; P547-R651 PolarHBondContact O-NH2 3.44Å; P547-N653 WeakPolarHBondContact CA-OD1 3.44Å
548	Q	84.8	Confident	89	Confident	40 Å²	40	26.3 Å²	26.3	19%	0.187	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-16.9	177.6	-49	-162.9	-42.4	0	0	112.9	Y183 V202 F544 V545 Y546	Y183-Q548 HydrophobicContact CE1-CB 4.42Å; Y183-Q548 WeakPolarHBondContact OH-CB 3.45Å; Y183-Q548 PolarHBondContact OH-OE1 3.42Å; V202-Q548 VanDerWaalsContact N-CD 3.35Å; V202-Q548 PolarHBondContact O-NE2 3.28Å; F544-Q548 WeakPolarHBondContact O-CG 3.28Å; V545-Q548 PolarHBondContact O-N 3.28Å; Y546-Q548 PolarHBondContact O-N 3.24Å
549	G	84.8	Confident	89.2	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.125	C	C	.	.			trans	126	149.3	170.7	0	0	0	0	0	111.9	G196 G197 V545 Y546 F650	G196-G549 CarbonylContact C-O 3.2Å; G197-G549 PolarHBondContact N-O 3.33Å; V545-G549 PolarHBondContact O-N 2.9Å; V545-G549 VanDerWaalsContact O-N 3.12Å; Y546-G549 PolarHBondContact O-N 3.5Å; G549-F650 CarbonylContact C-O 3.51Å; G549-F650 WeakPolarHBondContact CA-O 3.39Å
550	F	87.3	Confident	89.3	Confident	19 Å²	19	21.2 Å²	21.2	8%	0.083	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	171.5	176.5	-155.2	-111.4	0	0	0	110	F101 V545 G649 F650	F101-F550 HydrophobicContact CE1-CZ 4.39Å; V545-F550 HydrophobicContact CG1-CD2 3.79Å; V545-F550 HydrophobicContact CG1-CE2 4.16Å; F550-G649 VanDerWaalsContact O-CA 3.3Å; F550-G649 WeakPolarHBondContact O-CA 3.4Å; F550-F650 HydrophobicContact CB-CE1 4.09Å; F550-F650 HydrophobicContact CB-CE2 4.15Å; F550-F650 HydrophobicContact CB-CZ 3.78Å; F550-F650 HydrophobicContact CD1-CE1 4.26Å; F550-F650 HydrophobicContact CD1-CZ 4.01Å; F550-F650 HydrophobicContact CG-CZ 4.38Å; F550-F650 PolarHBondContact N-O 2.9Å; F550-F650 PolarHBondContact O-N 3.39Å
551	V	88.6	Confident	89.3	Confident	27 Å²	27	22.5 Å²	22.5	16%	0.164	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	132	-176.9	-179.5	0	0	0	0	109.7	Y194 T647	Y194-V551 HydrophobicContact CD1-CG2 3.53Å; Y194-V551 HydrophobicContact CE1-CG2 3.56Å; V551-T647 VanDerWaalsContact CG1-CB 3.41Å; V551-T647 HydrophobicContact CG1-CG2 4.11Å
552	A	91	Very high	89.3	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.008	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	145	166.9	0	0	0	0	0	110.1	T647 T648 F650 W665	A552-T647 VanDerWaalsContact O-CA 3.3Å; A552-T647 WeakPolarHBondContact O-CA 3.34Å; A552-T648 PolarHBondContact N-O 2.93Å; A552-T648 PolarHBondContact O-N 3.46Å; A552-F650 HydrophobicContact CB-CD1 3.79Å; A552-F650 HydrophobicContact CB-CE1 3.73Å; A552-W665 HydrophobicContact CB-CH2 3.87Å; A552-W665 HydrophobicContact CB-CZ3 3.46Å; A552-W665 VanDerWaalsContact CB-CZ3 3.46Å
553	Y	91.7	Very high	89.4	Confident	33 Å²	33	23.6 Å²	23.6	13%	0.129	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	128.7	176	-65.4	-93.4	0	0	0	109.3	Y645 T647 Y680	Y553-Y645 AromaticContact CD1-CD2 3.95Å; Y553-Y645 HydrophobicContact CD1-CD2 3.95Å; Y553-Y645 HydrophobicContact CD1-CE2 4.02Å; Y553-Y645 HydrophobicContact CE1-CE2 4.2Å; Y553-T647 HydrophobicContact CD1-CG2 3.69Å; Y553-T647 HydrophobicContact CE1-CG2 3.73Å; Y553-T647 HydrophobicContact CG-CG2 4.49Å; Y553-Y680 HydrophobicContact CD2-CD1 4.17Å; Y553-Y680 PolarHBondContact N-O 3.03Å; Y553-Y680 PolarHBondContact O-N 3.49Å
554	V	93.9	Very high	89.4	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	113.5	175.8	-173.6	0	0	0	0	108.4	I556 F574 L578 Y645 F646 T648 V678 V679	V554-I556 HydrophobicContact CG1-CD1 4.46Å; V554-F574 HydrophobicContact CG1-CE1 4.28Å; V554-F574 HydrophobicContact CG1-CZ 4.19Å; V554-L578 HydrophobicContact CG1-CD1 4.49Å; V554-L578 HydrophobicContact CG2-CD1 4.03Å; V554-Y645 WeakPolarHBondContact O-CA 3.43Å; V554-Y645 WeakPolarHBondContact O-CB 3.46Å; V554-F646 HydrophobicContact CB-CD1 4.19Å; V554-F646 HydrophobicContact CB-CD2 4.19Å; V554-F646 HydrophobicContact CB-CE1 3.73Å; V554-F646 HydrophobicContact CB-CE2 3.73Å; V554-F646 HydrophobicContact CB-CG 4.42Å; V554-F646 HydrophobicContact CB-CZ 3.5Å; V554-F646 VanDerWaalsContact CB-CZ 3.5Å; V554-F646 HydrophobicContact CG1-CD1 4.5Å; V554-F646 HydrophobicContact CG1-CE1 3.64Å; V554-F646 HydrophobicContact CG1-CE2 4.22Å; V554-F646 HydrophobicContact CG1-CZ 3.48Å; V554-F646 VanDerWaalsContact CG1-CZ 3.48Å; V554-F646 HydrophobicContact CG2-CD2 4.49Å; V554-F646 HydrophobicContact CG2-CE2 3.87Å; V554-F646 HydrophobicContact CG2-CZ 4Å; V554-F646 PolarHBondContact N-O 3.48Å; V554-F646 PolarHBondContact O-N 3.26Å; V554-T648 HydrophobicContact CG2-CG2 4Å; V554-V678 WeakPolarHBondContact CA-O 3.39Å; V554-V679 HydrophobicContact CG1-CG2 4.41Å; V554-V679 HydrophobicContact CG2-CG2 4.31Å
555	Y	93	Very high	89.4	Confident	1 Å²	1	30.5 Å²	30.5	0%	0.004	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	131.9	178.5	-66.2	-84.7	0	0	0	110.1	L84 H85 F88 Y645 P677 V678 Y680	L84-Y555 HydrophobicContact CD2-CG 4.42Å; H85-Y555 HydrophobicContact CB-CE2 4.13Å; H85-Y555 AromaticContact ND1-CE2 3.89Å; H85-Y555 AromaticContact ND1-CZ 3.65Å; H85-Y555 PolarHBondContact ND1-OH 3.12Å; F88-Y555 HydrophobicContact CB-CD1 4.18Å; F88-Y555 HydrophobicContact CB-CE1 3.7Å; F88-Y555 HydrophobicContact CD1-CD1 4.46Å; F88-Y555 AromaticContact CD1-CE1 3.84Å; F88-Y555 HydrophobicContact CD1-CE1 3.84Å; F88-Y555 AromaticContact CD2-CD1 3.81Å; F88-Y555 HydrophobicContact CD2-CD1 3.81Å; F88-Y555 AromaticContact CD2-CE1 3.98Å; F88-Y555 HydrophobicContact CD2-CE1 3.98Å; F88-Y555 HydrophobicContact CE2-CD1 4.34Å; F88-Y555 AromaticContact CG-CD1 3.87Å; F88-Y555 HydrophobicContact CG-CD1 3.87Å; F88-Y555 AromaticContact CG-CE1 3.54Å; F88-Y555 HydrophobicContact CG-CE1 3.54Å; Y555-Y645 VanDerWaalsContact CD1-CB 3.49Å; Y555-Y645 HydrophobicContact CD1-CD1 4.48Å; Y555-Y645 HydrophobicContact CD1-CG 4.27Å; Y555-Y645 AromaticContact CE1-CD1 3.92Å; Y555-Y645 HydrophobicContact CE1-CD1 3.92Å; Y555-Y645 AromaticContact CE1-CG 3.83Å; Y555-Y645 HydrophobicContact CE1-CG 3.83Å; Y555-P677 CarbonylContact O-C 3.59Å; Y555-P677 WeakPolarHBondContact O-CA 3.26Å; Y555-V678 PolarHBondContact N-O 3.49Å; Y555-V678 PolarHBondContact O-N 3.18Å; Y555-Y680 HydrophobicContact CE2-CG 4.43Å
556	I	94.4	Very high	89.6	Confident	1 Å²	1	35 Å²	35	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	108.9	172.1	-57.4	-58.2	0	0	0	107.3	V554 F571 F574 Q643 F644 F646 L675 P677	V554-I556 HydrophobicContact CG1-CD1 4.46Å; I556-F571 HydrophobicContact CD1-CE2 4.27Å; I556-F571 HydrophobicContact CG1-CE2 4.05Å; I556-F574 HydrophobicContact CD1-CE1 3.89Å; I556-Q643 VanDerWaalsContact O-CA 3.27Å; I556-Q643 WeakPolarHBondContact O-CA 3.25Å; I556-F644 HydrophobicContact CB-CD1 4.1Å; I556-F644 HydrophobicContact CB-CE1 3.73Å; I556-F644 HydrophobicContact CB-CE2 4.2Å; I556-F644 HydrophobicContact CB-CG 4.48Å; I556-F644 HydrophobicContact CB-CZ 3.8Å; I556-F644 HydrophobicContact CG1-CD2 4.42Å; I556-F644 HydrophobicContact CG1-CE1 4.11Å; I556-F644 HydrophobicContact CG1-CE2 3.79Å; I556-F644 HydrophobicContact CG1-CZ 3.62Å; I556-F644 HydrophobicContact CG2-CD1 4.36Å; I556-F644 HydrophobicContact CG2-CE1 3.7Å; I556-F644 HydrophobicContact CG2-CZ 3.99Å; I556-F644 PolarHBondContact N-O 3.06Å; I556-F644 PolarHBondContact O-N 3.37Å; I556-F644 VanDerWaalsContact O-N 3.16Å; I556-F646 HydrophobicContact CD1-CE1 4.23Å; I556-F646 HydrophobicContact CG1-CE1 4.12Å; I556-L675 HydrophobicContact CG2-CB 4.28Å; I556-P677 HydrophobicContact CD1-CB 3.79Å
557	L	91.2	Very high	89.8	Confident	40 Å²	40	38.2 Å²	38.2	21%	0.209	18%	0.183	C	C	.	.	S	Bend	trans	-83.8	-21.2	-176.3	-61.8	175.6	0	0	0	113.6	L84 Q643 L675 Q676 V678	L84-L557 HydrophobicContact CD1-CD1 4.18Å; L84-L557 HydrophobicContact CD1-CD2 3.48Å; L84-L557 VanDerWaalsContact CD1-CD2 3.48Å; L84-L557 HydrophobicContact CD1-CG 4.43Å; L84-L557 HydrophobicContact CD2-CD1 3.97Å; L84-L557 HydrophobicContact CD2-CD2 3.86Å; L84-L557 HydrophobicContact CD2-CG 4.19Å; L84-L557 HydrophobicContact CG-CD2 4.15Å; L557-Q643 WeakPolarHBondContact O-CG 3.26Å; L557-L675 PolarHBondContact N-O 3.25Å; L557-Q676 HydrophobicContact CB-CB 3.91Å; L557-Q676 HydrophobicContact CD1-CB 4.47Å; L557-Q676 PolarHBondContact N-O 2.93Å; L557-V678 HydrophobicContact CD1-CG2 3.89Å; L557-V678 HydrophobicContact CG-CG2 4.42Å
558	N	92.5	Very high	90.1	Very high	67 Å²	67	38.4 Å²	38.4	36%	0.358	18%	0.184	S	C	.	.	S	Bend	trans	-124.8	91.3	170.3	-175.2	30	0	0	0	109	K639 E674 L675	N558-K639 PolarHBondContact OD1-NZ 3.2Å; N558-E674 PolarHBondContact ND2-O 3.42Å; N558-L675 PolarHBondContact N-O 3.19Å
559	A	92.7	Very high	90.5	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.008	20%	0.198	C	C	.	.			trans	-61.1	140.4	179.3	0	0	0	0	0	111.2	K639 V641 Q642 F644	A559-K639 WeakPolarHBondContact O-CD 3.4Å; A559-K639 WeakPolarHBondContact O-CE 3.46Å; A559-K639 PolarHBondContact O-NZ 3.27Å; A559-V641 HydrophobicContact CB-CG1 3.96Å; A559-V641 WeakPolarHBondContact CB-O 3.4Å; A559-Q642 WeakPolarHBondContact CB-O 3.15Å; A559-Q642 PolarHBondContact N-O 3.09Å; A559-F644 HydrophobicContact CB-CD1 3.72Å; A559-F644 HydrophobicContact CB-CE1 3.7Å
560	P	91.7	Very high	90.9	Very high	5 Å²	5	47 Å²	47	3%	0.032	22%	0.221	C	C	.	.			trans	-65.9	152.5	171.1	31.4	-33.9	0	0	0	109.6	F562 Q567 F571 L675	P560-F562 HydrophobicContact CG-CD1 4.22Å; P560-F562 HydrophobicContact CG-CE1 3.64Å; P560-F562 HydrophobicContact CG-CE2 4.26Å; P560-F562 HydrophobicContact CG-CZ 3.67Å; P560-F562 WeakPolarHBondContact O-CD2 3.45Å; P560-F562 WeakPolarHBondContact O-CE2 3.3Å; P560-F562 PolarHBondContact O-N 3.02Å; P560-Q567 HydrophobicContact CB-CB 3.76Å; P560-F571 HydrophobicContact CG-CB 3.97Å; P560-F571 HydrophobicContact CG-CG 4.24Å; P560-L675 HydrophobicContact CB-CD2 4.34Å; P560-L675 HydrophobicContact CG-CD2 4.4Å
561	D	89.3	Confident	91.2	Very high	28 Å²	28	46 Å²	46	15%	0.15	22%	0.217	C	C	.	.			trans	-74.4	109.1	166.1	-170.5	0.1	0	0	0	108.8	R563 N564 Y612 K639	D561-R563 PolarHBondContact O-N 3.11Å; D561-R563 WeakPolarHBondContact OD1-CG 3.4Å; D561-R563 IonicContact OD1-CZ 2.57Å; D561-R563 PolarHBondContact OD1-N 3.2Å; D561-R563 IonicContact OD1-NE 3.18Å; D561-R563 PolarHBondContact OD1-NE 3.22Å; D561-R563 VanDerWaalsContact OD1-NE 3.1Å; D561-R563 IonicContact OD1-NH2 2.77Å; D561-R563 IonicContact OD2-CZ 2.65Å; D561-R563 IonicContact OD2-NE 2.82Å; D561-R563 PolarHBondContact OD2-NE 2.98Å; D561-R563 IonicContact OD2-NH2 2.68Å; D561-R563 PolarHBondContact OD2-NH2 3.13Å; D561-N564 PolarHBondContact O-N 3.46Å; D561-Y612 WeakPolarHBondContact OD1-CE2 3.42Å; D561-Y612 PolarHBondContact OD1-OH 3.34Å; D561-K639 HydrophobicContact CB-CD 4.42Å
562	F	88.3	Confident	91.5	Very high	8 Å²	8	48.1 Å²	48.1	4%	0.035	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-18	-174.3	-66.3	-75.2	0	0	0	113.6	P560 N564 T568 F571 W593 L594 F611 Y612 V641 F644	P560-F562 HydrophobicContact CG-CD1 4.22Å; P560-F562 HydrophobicContact CG-CE1 3.64Å; P560-F562 HydrophobicContact CG-CE2 4.26Å; P560-F562 HydrophobicContact CG-CZ 3.67Å; P560-F562 WeakPolarHBondContact O-CD2 3.45Å; P560-F562 WeakPolarHBondContact O-CE2 3.3Å; P560-F562 PolarHBondContact O-N 3.02Å; F562-N564 PolarHBondContact O-N 3.33Å; F562-T568 WeakPolarHBondContact CA-OG1 3.45Å; F562-T568 HydrophobicContact CD1-CG2 4.34Å; F562-T568 PolarHBondContact O-OG1 2.88Å; F562-F571 HydrophobicContact CE1-CD1 4.34Å; F562-W593 AromaticContact CD2-CH2 3.87Å; F562-W593 HydrophobicContact CD2-CH2 3.87Å; F562-W593 HydrophobicContact CD2-CZ2 4.03Å; F562-W593 HydrophobicContact CE1-CZ2 4.24Å; F562-W593 AromaticContact CE2-CH2 3.75Å; F562-W593 HydrophobicContact CE2-CH2 3.75Å; F562-W593 AromaticContact CE2-CZ2 3.41Å; F562-W593 HydrophobicContact CE2-CZ2 3.41Å; F562-W593 VanDerWaalsContact CE2-CZ2 3.41Å; F562-W593 HydrophobicContact CG-CH2 4.33Å; F562-W593 HydrophobicContact CZ-CH2 4.1Å; F562-W593 AromaticContact CZ-CZ2 3.52Å; F562-W593 HydrophobicContact CZ-CZ2 3.52Å; F562-L594 HydrophobicContact CD1-CD1 3.89Å; F562-L594 HydrophobicContact CD1-CD2 4.07Å; F562-L594 HydrophobicContact CE1-CD1 4.11Å; F562-L594 HydrophobicContact CE1-CD2 3.75Å; F562-L594 HydrophobicContact CG-CD1 4.49Å; F562-F611 HydrophobicContact CB-CD1 3.99Å; F562-F611 HydrophobicContact CB-CD2 4.37Å; F562-F611 HydrophobicContact CB-CE1 3.42Å; F562-F611 VanDerWaalsContact CB-CE1 3.42Å; F562-F611 HydrophobicContact CB-CE2 3.82Å; F562-F611 HydrophobicContact CB-CG 4.45Å; F562-F611 HydrophobicContact CB-CZ 3.32Å; F562-F611 HydrophobicContact CD2-CE1 4.14Å; F562-F611 HydrophobicContact CD2-CZ 4.34Å; F562-F611 HydrophobicContact CG-CE1 4.01Å; F562-F611 AromaticContact CG-CZ 3.84Å; F562-F611 HydrophobicContact CG-CZ 3.84Å; F562-Y612 PolarHBondContact N-OH 2.9Å; F562-V641 HydrophobicContact CE2-CG1 4.39Å; F562-F644 HydrophobicContact CE2-CE1 4.38Å; F562-F644 AromaticContact CZ-CE1 3.86Å; F562-F644 HydrophobicContact CZ-CE1 3.86Å; F562-F644 HydrophobicContact CZ-CZ 4.09Å
563	R	87.6	Confident	91.7	Very high	73 Å²	73	52.3 Å²	52.3	28%	0.275	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-28.6	169.1	-56.6	178.8	-68.8	-165.3	-2.2	111.8	D561 D608 F611 Y612 D638	D561-R563 PolarHBondContact O-N 3.11Å; D561-R563 WeakPolarHBondContact OD1-CG 3.4Å; D561-R563 IonicContact OD1-CZ 2.57Å; D561-R563 PolarHBondContact OD1-N 3.2Å; D561-R563 IonicContact OD1-NE 3.18Å; D561-R563 PolarHBondContact OD1-NE 3.22Å; D561-R563 VanDerWaalsContact OD1-NE 3.1Å; D561-R563 IonicContact OD1-NH2 2.77Å; D561-R563 IonicContact OD2-CZ 2.65Å; D561-R563 IonicContact OD2-NE 2.82Å; D561-R563 PolarHBondContact OD2-NE 2.98Å; D561-R563 IonicContact OD2-NH2 2.68Å; D561-R563 PolarHBondContact OD2-NH2 3.13Å; R563-D608 WeakPolarHBondContact CG-O 3.36Å; R563-F611 HydrophobicContact CG-CB 4.17Å; R563-Y612 HydrophobicContact CG-CD2 4.21Å; R563-Y612 HydrophobicContact CG-CE2 3.76Å; R563-D638 IonicContact NH1-OD1 2.84Å; R563-D638 PolarHBondContact NH2-O 2.98Å; R563-D638 IonicContact NH2-OD1 2.97Å
564	N	88.8	Confident	91.9	Very high	65 Å²	65	50.8 Å²	50.8	35%	0.348	24%	0.238	S	C	.	.	S	Bend	trans	-92.8	105.3	179.6	-171.7	-19.8	0	0	0	111	D561 F562 T566 Q567 T568	D561-N564 PolarHBondContact O-N 3.46Å; F562-N564 PolarHBondContact O-N 3.33Å; N564-T566 PolarHBondContact O-N 2.86Å; N564-T566 PolarHBondContact OD1-N 3.38Å; N564-T566 PolarHBondContact OD1-OG1 2.87Å; N564-Q567 HydrophobicContact CB-CB 4.42Å; N564-Q567 HydrophobicContact CB-CG 4.21Å; N564-Q567 PolarHBondContact O-N 2.96Å; N564-T568 PolarHBondContact O-N 3.22Å; N564-T568 VanDerWaalsContact O-N 3.07Å; N564-T568 PolarHBondContact O-OG1 2.87Å
565	R	87.4	Confident	91.9	Very high	190 Å²	190	51 Å²	51	72%	0.717	24%	0.239	S	C	*	.	H	α-helix	trans	-52.1	-33.1	179.4	-171	170.1	179.5	152.3	0.6	114	L569	R565-L569 HydrophobicContact CG-CD1 4.04Å; R565-L569 HydrophobicContact CG-CG 4.3Å; R565-L569 VanDerWaalsContact O-CB 3.32Å; R565-L569 WeakPolarHBondContact O-CB 3.44Å; R565-L569 WeakPolarHBondContact O-CG 3.43Å; R565-L569 PolarHBondContact O-N 3.17Å
566	T	92.1	Very high	92	Very high	97 Å²	97	53.2 Å²	53.2	60%	0.595	26%	0.258	S	S	*	.	H	α-helix	trans	-69.1	-40.2	179.4	62.7	0	0	0	0	112.6	N564 R570	N564-T566 PolarHBondContact O-N 2.86Å; N564-T566 PolarHBondContact OD1-N 3.38Å; N564-T566 PolarHBondContact OD1-OG1 2.87Å; T566-R570 WeakPolarHBondContact O-CB 3.37Å; T566-R570 PolarHBondContact O-N 3.3Å; T566-R570 VanDerWaalsContact O-N 3.07Å
567	Q	90.6	Very high	92	Very high	84 Å²	84	55.8 Å²	55.8	39%	0.393	27%	0.27	S	S	.	.	H	α-helix	trans	-71.5	-41.4	177.3	-61.9	-172.8	19.1	0	0	110.7	P560 N564 R570 F571	P560-Q567 HydrophobicContact CB-CB 3.76Å; N564-Q567 HydrophobicContact CB-CB 4.42Å; N564-Q567 HydrophobicContact CB-CG 4.21Å; N564-Q567 PolarHBondContact O-N 2.96Å; Q567-R570 PolarHBondContact O-N 3.42Å; Q567-F571 PolarHBondContact O-N 2.88Å
568	T	89.9	Confident	92.1	Very high	27 Å²	27	53.9 Å²	53.9	17%	0.166	26%	0.26	C	S	.	.	H	α-helix	trans	-60.1	-46	174.5	-56.1	0	0	0	0	111.7	F562 N564 R570 F571 R572	F562-T568 WeakPolarHBondContact CA-OG1 3.45Å; F562-T568 HydrophobicContact CD1-CG2 4.34Å; F562-T568 PolarHBondContact O-OG1 2.88Å; N564-T568 PolarHBondContact O-N 3.22Å; N564-T568 VanDerWaalsContact O-N 3.07Å; N564-T568 PolarHBondContact O-OG1 2.87Å; T568-R570 VanDerWaalsContact C-N 3.31Å; T568-R570 PolarHBondContact O-N 3.37Å; T568-F571 PolarHBondContact O-N 3.15Å; T568-R572 VanDerWaalsContact O-CG 3.29Å; T568-R572 WeakPolarHBondContact O-CG 3.48Å; T568-R572 PolarHBondContact O-N 3.35Å
569	L	92.9	Very high	92.2	Very high	91 Å²	91	52.2 Å²	52.2	48%	0.476	25%	0.25	S	S	.	.	H	α-helix	trans	-62.1	-38.8	176.1	-76.7	172	0	0	0	112.1	R565 R572 N573	R565-L569 HydrophobicContact CG-CD1 4.04Å; R565-L569 HydrophobicContact CG-CG 4.3Å; R565-L569 VanDerWaalsContact O-CB 3.32Å; R565-L569 WeakPolarHBondContact O-CB 3.44Å; R565-L569 WeakPolarHBondContact O-CG 3.43Å; R565-L569 PolarHBondContact O-N 3.17Å; L569-R572 PolarHBondContact O-N 3.18Å; L569-N573 VanDerWaalsContact O-CG 3.25Å; L569-N573 PolarHBondContact O-N 3.2Å; L569-N573 PolarHBondContact O-OD1 2.92Å
570	R	93.4	Very high	92.2	Very high	128 Å²	128	56.7 Å²	56.7	48%	0.483	28%	0.281	S	S	.	.	H	α-helix	trans	-66.5	-40.2	177.9	-167.1	162.2	175.1	160.2	-7.2	112.1	T566 Q567 T568 N573 F574 Y672 E674	T566-R570 WeakPolarHBondContact O-CB 3.37Å; T566-R570 PolarHBondContact O-N 3.3Å; T566-R570 VanDerWaalsContact O-N 3.07Å; Q567-R570 PolarHBondContact O-N 3.42Å; T568-R570 VanDerWaalsContact C-N 3.31Å; T568-R570 PolarHBondContact O-N 3.37Å; R570-N573 PolarHBondContact O-N 3.03Å; R570-F574 PolarHBondContact O-N 3.08Å; R570-Y672 HydrophobicContact CG-CD1 4.19Å; R570-Y672 HydrophobicContact CG-CE1 4.03Å; R570-E674 IonicContact CZ-OE1 3.73Å; R570-E674 IonicContact NE-OE1 2.98Å; R570-E674 PolarHBondContact NE-OE1 3.23Å; R570-E674 VanDerWaalsContact NH2-CD 3.3Å; R570-E674 IonicContact NH2-OE1 2.85Å; R570-E674 PolarHBondContact NH2-OE1 3.17Å; R570-E674 IonicContact NH2-OE2 3.86Å; R570-E674 PolarHBondContact NH2-OE2 2.87Å
571	F	94.8	Very high	92.2	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-63.3	-40.9	170.8	170.3	-107	0	0	0	112.4	I556 P560 F562 Q567 T568 N573 F574 L575 L592 L594 F644 F646 L675	I556-F571 HydrophobicContact CD1-CE2 4.27Å; I556-F571 HydrophobicContact CG1-CE2 4.05Å; P560-F571 HydrophobicContact CG-CB 3.97Å; P560-F571 HydrophobicContact CG-CG 4.24Å; F562-F571 HydrophobicContact CE1-CD1 4.34Å; Q567-F571 PolarHBondContact O-N 2.88Å; T568-F571 PolarHBondContact O-N 3.15Å; F571-N573 VanDerWaalsContact C-N 3.32Å; F571-N573 PolarHBondContact O-N 2.89Å; F571-F574 HydrophobicContact CD2-CD1 4.28Å; F571-F574 HydrophobicContact CE2-CD1 4.3Å; F571-F574 WeakPolarHBondContact O-CB 3.49Å; F571-F574 PolarHBondContact O-N 3.17Å; F571-L575 PolarHBondContact O-N 3.44Å; F571-L592 HydrophobicContact CE1-CD1 4.4Å; F571-L592 HydrophobicContact CE1-CD2 3.94Å; F571-L592 HydrophobicContact CZ-CD1 4.16Å; F571-L592 HydrophobicContact CZ-CD2 4.27Å; F571-L594 HydrophobicContact CD1-CD2 4.24Å; F571-L594 HydrophobicContact CE1-CD2 4.1Å; F571-F644 HydrophobicContact CD2-CZ 4.21Å; F571-F644 HydrophobicContact CE1-CE2 4.42Å; F571-F644 HydrophobicContact CE1-CZ 4.2Å; F571-F644 AromaticContact CE2-CE2 3.93Å; F571-F644 HydrophobicContact CE2-CE2 3.93Å; F571-F644 AromaticContact CE2-CZ 3.59Å; F571-F644 HydrophobicContact CE2-CZ 3.59Å; F571-F644 AromaticContact CZ-CE2 3.63Å; F571-F644 HydrophobicContact CZ-CE2 3.63Å; F571-F644 AromaticContact CZ-CZ 3.58Å; F571-F644 HydrophobicContact CZ-CZ 3.58Å; F571-F646 HydrophobicContact CE2-CE1 4.07Å; F571-F646 HydrophobicContact CZ-CD1 4.38Å; F571-F646 HydrophobicContact CZ-CE1 4.19Å; F571-L675 HydrophobicContact CB-CD1 4.43Å; F571-L675 HydrophobicContact CD2-CD1 4.05Å
572	R	94.6	Very high	92.1	Very high	71 Å²	71	59.1 Å²	59.1	27%	0.268	30%	0.298	S	S	.	.	H	α-helix	trans	-63	-36.6	174.6	-69.7	-67.8	-169.2	169.4	0.9	112.5	T568 L569 L575 A576 D595	T568-R572 VanDerWaalsContact O-CG 3.29Å; T568-R572 WeakPolarHBondContact O-CG 3.48Å; T568-R572 PolarHBondContact O-N 3.35Å; L569-R572 PolarHBondContact O-N 3.18Å; R572-L575 PolarHBondContact O-N 3.13Å; R572-A576 WeakPolarHBondContact O-CB 3.23Å; R572-A576 PolarHBondContact O-N 3.15Å; R572-D595 IonicContact CZ-OD1 3.45Å; R572-D595 IonicContact NH1-OD1 3.64Å; R572-D595 PolarHBondContact NH1-OD1 3.36Å; R572-D595 IonicContact NH2-OD1 3.67Å; R572-D595 PolarHBondContact NH2-OD1 2.91Å
573	N	94.9	Very high	92.1	Very high	89 Å²	89	62 Å²	62	48%	0.476	31%	0.311	S	S	.	.	H	α-helix	trans	-66.5	-42.7	174.2	-69.2	-15.3	0	0	0	111.9	L569 R570 F571 L575 A576 E577	L569-N573 VanDerWaalsContact O-CG 3.25Å; L569-N573 PolarHBondContact O-N 3.2Å; L569-N573 PolarHBondContact O-OD1 2.92Å; R570-N573 PolarHBondContact O-N 3.03Å; F571-N573 VanDerWaalsContact C-N 3.32Å; F571-N573 PolarHBondContact O-N 2.89Å; N573-L575 VanDerWaalsContact C-N 3.32Å; N573-L575 PolarHBondContact O-N 3.24Å; N573-A576 PolarHBondContact O-N 3.41Å; N573-E577 WeakPolarHBondContact O-CG 3.49Å; N573-E577 PolarHBondContact O-N 2.81Å
574	F	95.5	Very high	92.2	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-56.4	-47.9	171.9	164.3	-105.9	0	0	0	111.3	V554 I556 R570 F571 A576 E577 L578 F646 I668 Y672 L675 P677	V554-F574 HydrophobicContact CG1-CE1 4.28Å; V554-F574 HydrophobicContact CG1-CZ 4.19Å; I556-F574 HydrophobicContact CD1-CE1 3.89Å; R570-F574 PolarHBondContact O-N 3.08Å; F571-F574 HydrophobicContact CD2-CD1 4.28Å; F571-F574 HydrophobicContact CE2-CD1 4.3Å; F571-F574 WeakPolarHBondContact O-CB 3.49Å; F571-F574 PolarHBondContact O-N 3.17Å; F574-A576 PolarHBondContact O-N 3.34Å; F574-E577 PolarHBondContact O-N 3.48Å; F574-L578 HydrophobicContact CZ-CD1 4.05Å; F574-L578 PolarHBondContact O-N 3.09Å; F574-F646 HydrophobicContact CE1-CE1 4.28Å; F574-F646 HydrophobicContact CE1-CZ 4Å; F574-I668 HydrophobicContact CD2-CG2 3.94Å; F574-I668 HydrophobicContact CE2-CG2 3.98Å; F574-Y672 HydrophobicContact CB-CD1 3.88Å; F574-Y672 HydrophobicContact CB-CD2 3.88Å; F574-Y672 HydrophobicContact CB-CE1 3.92Å; F574-Y672 HydrophobicContact CB-CE2 3.94Å; F574-Y672 HydrophobicContact CB-CG 3.85Å; F574-Y672 AromaticContact CD2-CD2 3.53Å; F574-Y672 HydrophobicContact CD2-CD2 3.53Å; F574-Y672 HydrophobicContact CD2-CE2 4.11Å; F574-Y672 AromaticContact CD2-CG 3.9Å; F574-Y672 HydrophobicContact CD2-CG 3.9Å; F574-Y672 HydrophobicContact CG-CD2 4.16Å; F574-Y672 HydrophobicContact CG-CG 4.23Å; F574-L675 HydrophobicContact CB-CD1 4.18Å; F574-L675 HydrophobicContact CD1-CD1 4.23Å; F574-L675 HydrophobicContact CG-CD1 4.22Å; F574-P677 HydrophobicContact CE1-CB 4.18Å; F574-P677 HydrophobicContact CE2-CB 4.02Å; F574-P677 HydrophobicContact CE2-CG 4.05Å; F574-P677 HydrophobicContact CZ-CB 3.57Å; F574-P677 HydrophobicContact CZ-CG 4.13Å
575	L	94.9	Very high	92.1	Very high	4 Å²	4	58.7 Å²	58.7	2%	0.021	30%	0.304	C	S	.	.	H	α-helix	trans	-61.2	-46.1	178.3	-177.5	63.4	0	0	0	111.8	F571 R572 N573 E577 L578 E579 T590 L592 F646	F571-L575 PolarHBondContact O-N 3.44Å; R572-L575 PolarHBondContact O-N 3.13Å; N573-L575 VanDerWaalsContact C-N 3.32Å; N573-L575 PolarHBondContact O-N 3.24Å; L575-E577 VanDerWaalsContact C-N 3.32Å; L575-E577 PolarHBondContact O-N 3.47Å; L575-L578 PolarHBondContact O-N 3.04Å; L575-L578 VanDerWaalsContact O-N 3.16Å; L575-E579 HydrophobicContact CD1-CG 4.24Å; L575-E579 HydrophobicContact CG-CG 4.34Å; L575-E579 WeakPolarHBondContact CG-OE1 3.45Å; L575-E579 WeakPolarHBondContact O-CB 3.41Å; L575-E579 VanDerWaalsContact O-CG 3.28Å; L575-E579 WeakPolarHBondContact O-CG 3.36Å; L575-E579 PolarHBondContact O-N 2.97Å; L575-T590 HydrophobicContact CD1-CG2 3.89Å; L575-T590 HydrophobicContact CD2-CG2 4.4Å; L575-L592 HydrophobicContact CD2-CD2 3.79Å; L575-F646 HydrophobicContact CD1-CD2 4.11Å; L575-F646 HydrophobicContact CD1-CE2 3.43Å; L575-F646 VanDerWaalsContact CD1-CE2 3.43Å; L575-F646 HydrophobicContact CD1-CZ 3.72Å
576	A	94.5	Very high	92.1	Very high	48 Å²	48	50.5 Å²	50.5	40%	0.397	28%	0.278	S	S	.	.	H	α-helix	trans	-62.8	-36.5	178	0	0	0	0	0	112.6	R572 N573 F574 S580	R572-A576 WeakPolarHBondContact O-CB 3.23Å; R572-A576 PolarHBondContact O-N 3.15Å; N573-A576 PolarHBondContact O-N 3.41Å; F574-A576 PolarHBondContact O-N 3.34Å; A576-S580 VanDerWaalsContact O-CB 3.26Å; A576-S580 WeakPolarHBondContact O-CB 3.43Å; A576-S580 PolarHBondContact O-N 2.79Å; A576-S580 PolarHBondContact O-OG 2.86Å
577	E	94.8	Very high	91.9	Very high	56 Å²	56	49.2 Å²	49.2	26%	0.262	27%	0.273	S	S	.	.	H	α-helix	trans	-66.2	-39.3	173.5	-78.3	-177.3	-140.8	0	0	111.9	N573 F574 L575 S580 S581 I668 K671 Y672	N573-E577 WeakPolarHBondContact O-CG 3.49Å; N573-E577 PolarHBondContact O-N 2.81Å; F574-E577 PolarHBondContact O-N 3.48Å; L575-E577 VanDerWaalsContact C-N 3.32Å; L575-E577 PolarHBondContact O-N 3.47Å; E577-S580 PolarHBondContact O-OG 3.37Å; E577-S581 PolarHBondContact O-N 3.32Å; E577-S581 VanDerWaalsContact O-N 3.16Å; E577-I668 HydrophobicContact CB-CG2 4.03Å; E577-K671 IonicContact OE1-NZ 2.87Å; E577-K671 PolarHBondContact OE1-NZ 3.07Å; E577-K671 IonicContact OE2-NZ 3.5Å; E577-K671 PolarHBondContact OE2-NZ 2.83Å; E577-Y672 PolarHBondContact OE1-OH 3.23Å
578	L	93.8	Very high	91.7	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-67.5	-44.4	176.3	-167.6	149.2	0	0	0	111.1	V554 F574 L575 S580 S581 A584 T648 W665	V554-L578 HydrophobicContact CG1-CD1 4.49Å; V554-L578 HydrophobicContact CG2-CD1 4.03Å; F574-L578 HydrophobicContact CZ-CD1 4.05Å; F574-L578 PolarHBondContact O-N 3.09Å; L575-L578 PolarHBondContact O-N 3.04Å; L575-L578 VanDerWaalsContact O-N 3.16Å; L578-S580 VanDerWaalsContact C-N 3.34Å; L578-S580 PolarHBondContact O-N 3.01Å; L578-S581 VanDerWaalsContact O-CB 3.31Å; L578-S581 WeakPolarHBondContact O-CB 3.34Å; L578-S581 PolarHBondContact O-N 3.3Å; L578-S581 PolarHBondContact O-OG 3.46Å; L578-A584 WeakPolarHBondContact O-CB 3.28Å; L578-T648 HydrophobicContact CD2-CG2 3.4Å; L578-T648 VanDerWaalsContact CD2-CG2 3.4Å; L578-W665 HydrophobicContact CD1-CD2 4.35Å; L578-W665 HydrophobicContact CD1-CE3 4.16Å; L578-W665 HydrophobicContact CD2-CD2 4.39Å; L578-W665 HydrophobicContact CD2-CE3 4.33Å; L578-W665 HydrophobicContact CD2-CH2 4.12Å; L578-W665 HydrophobicContact CD2-CZ2 4.07Å; L578-W665 HydrophobicContact CD2-CZ3 4.21Å; L578-W665 HydrophobicContact CG-CD2 4.18Å; L578-W665 HydrophobicContact CG-CE3 4.34Å
579	E	93.2	Very high	91.6	Very high	32 Å²	32	48.7 Å²	48.7	15%	0.15	27%	0.272	C	S	.	.	H	α-helix	trans	-69.2	-29.4	-179.9	-71.3	173	168.1	0	0	113.6	L575 A584 S587 T590	L575-E579 HydrophobicContact CD1-CG 4.24Å; L575-E579 HydrophobicContact CG-CG 4.34Å; L575-E579 WeakPolarHBondContact CG-OE1 3.45Å; L575-E579 WeakPolarHBondContact O-CB 3.41Å; L575-E579 VanDerWaalsContact O-CG 3.28Å; L575-E579 WeakPolarHBondContact O-CG 3.36Å; L575-E579 PolarHBondContact O-N 2.97Å; E579-A584 WeakPolarHBondContact O-CB 3.46Å; E579-S587 VanDerWaalsContact CD-CA 3.46Å; E579-S587 WeakPolarHBondContact OE2-CB 3.46Å; E579-T590 WeakPolarHBondContact CG-OG1 3.2Å; E579-T590 WeakPolarHBondContact OE1-CB 3.33Å; E579-T590 WeakPolarHBondContact OE1-CG2 3.37Å; E579-T590 PolarHBondContact OE1-OG1 3.28Å
580	S	93.1	Very high	91.5	Very high	94 Å²	94	44.6 Å²	44.6	66%	0.657	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-3.5	176.7	60.2	0	0	0	0	113.7	A576 E577 L578	A576-S580 VanDerWaalsContact O-CB 3.26Å; A576-S580 WeakPolarHBondContact O-CB 3.43Å; A576-S580 PolarHBondContact O-N 2.79Å; A576-S580 PolarHBondContact O-OG 2.86Å; E577-S580 PolarHBondContact O-OG 3.37Å; L578-S580 VanDerWaalsContact C-N 3.34Å; L578-S580 PolarHBondContact O-N 3.01Å
581	S	91.7	Very high	91.3	Very high	17 Å²	17	39.7 Å²	39.7	12%	0.119	24%	0.235	C	C	.	.	S	Bend	trans	-64.1	161.5	179	71.3	0	0	0	0	112.4	E577 L578 H583 A584 W665	E577-S581 PolarHBondContact O-N 3.32Å; E577-S581 VanDerWaalsContact O-N 3.16Å; L578-S581 VanDerWaalsContact O-CB 3.31Å; L578-S581 WeakPolarHBondContact O-CB 3.34Å; L578-S581 PolarHBondContact O-N 3.3Å; L578-S581 PolarHBondContact O-OG 3.46Å; S581-H583 PolarHBondContact O-N 2.92Å; S581-A584 WeakPolarHBondContact O-CB 3.29Å; S581-A584 PolarHBondContact O-N 3.35Å; S581-W665 PolarHBondContact OG-NE1 2.77Å
582	T	87.2	Confident	91.2	Very high	68 Å²	68	39.9 Å²	39.9	42%	0.417	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	138	179.1	70.8	0	0	0	0	110.2	A584 Q664	T582-A584 PolarHBondContact O-N 3.3Å; T582-Q664 PolarHBondContact OG1-NE2 3.05Å; T582-Q664 PolarHBondContact OG1-OE1 3.25Å
583	H	88.1	Confident	91	Very high	67 Å²	67	36.6 Å²	36.6	31%	0.31	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	70	-5.3	-177.7	-48.3	-73.6	0	0	0	117.2	S581 F650 R651 V652 M661	S581-H583 PolarHBondContact O-N 2.92Å; H583-F650 CarbonylContact O-C 3.53Å; H583-F650 WeakPolarHBondContact O-CA 3.5Å; H583-R651 PolarHBondContact O-N 3.33Å; H583-V652 HydrophobicContact CB-CG2 3.5Å; H583-M661 HydrophobicContact CB-CG 4.34Å; H583-M661 HydrophobicContact CB-SD 4.37Å
584	A	89.4	Confident	90.8	Very high	21 Å²	21	32.6 Å²	32.6	17%	0.174	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-63.8	144.1	167	0	0	0	0	0	110.2	L578 E579 S581 T582 G586 W665	L578-A584 WeakPolarHBondContact O-CB 3.28Å; E579-A584 WeakPolarHBondContact O-CB 3.46Å; S581-A584 WeakPolarHBondContact O-CB 3.29Å; S581-A584 PolarHBondContact O-N 3.35Å; T582-A584 PolarHBondContact O-N 3.3Å; A584-G586 VanDerWaalsContact C-N 3.26Å; A584-W665 HydrophobicContact CB-CZ2 4.49Å
585	V	87.7	Confident	90.5	Very high	49 Å²	49	34.2 Å²	34.2	30%	0.297	21%	0.211	S	C	.	.			trans	-76.1	-20.8	177.4	175.9	0	0	0	0	111.2	P184 Y194 G649 R651	P184-V585 HydrophobicContact CG-CG1 4.3Å; Y194-V585 HydrophobicContact CE2-CG1 4.22Å; V585-G649 PolarHBondContact N-O 3.4Å; V585-R651 HydrophobicContact CG2-CB 3.99Å
586	G	88.1	Confident	90.2	Very high	17 Å²	17	34.6 Å²	34.6	18%	0.175	21%	0.213	C	C	.	.			trans	107.3	-177.2	179.5	0	0	0	0	0	113	A584 D588 S589	A584-G586 VanDerWaalsContact C-N 3.26Å; G586-D588 PolarHBondContact O-N 3.03Å; G586-D588 VanDerWaalsContact O-N 3.16Å; G586-S589 PolarHBondContact O-N 2.85Å; G586-S589 PolarHBondContact O-OG 3.35Å
587	S	87.2	Confident	90	Very high	70 Å²	70	32.3 Å²	32.3	49%	0.49	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-61.7	-23.9	-174	61.6	0	0	0	0	114.7	E579 S589 T590	E579-S587 VanDerWaalsContact CD-CA 3.46Å; E579-S587 WeakPolarHBondContact OE2-CB 3.46Å; S587-S589 PolarHBondContact O-N 2.84Å; S587-T590 PolarHBondContact O-N 3.47Å
588	D	85.1	Confident	89.6	Confident	101 Å²	101	31.3 Å²	31.3	54%	0.54	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-66.2	-29.3	176.5	-74.4	-31.4	0	0	0	112.1	V185 G586	V185-D588 HydrophobicContact CG2-CB 4.1Å; V185-D588 WeakPolarHBondContact CG2-O 3.38Å; G586-D588 PolarHBondContact O-N 3.03Å; G586-D588 VanDerWaalsContact O-N 3.16Å
589	S	87.9	Confident	89.3	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-82.4	-13.4	-179.6	71.4	0	0	0	0	114.3	G586 S587 G649	G586-S589 PolarHBondContact O-N 2.85Å; G586-S589 PolarHBondContact O-OG 3.35Å; S587-S589 PolarHBondContact O-N 2.84Å; S589-G649 WeakPolarHBondContact OG-CA 3.37Å; S589-G649 PolarHBondContact OG-N 3Å
590	T	91.9	Very high	88.9	Confident	5 Å²	5	37.3 Å²	37.3	3%	0.031	22%	0.219	C	C	.	.			trans	-78.7	126.3	-178.4	-61	0	0	0	0	110.7	L575 E579 S587 L592 F646 T647 T648	L575-T590 HydrophobicContact CD1-CG2 3.89Å; L575-T590 HydrophobicContact CD2-CG2 4.4Å; E579-T590 WeakPolarHBondContact CG-OG1 3.2Å; E579-T590 WeakPolarHBondContact OE1-CB 3.33Å; E579-T590 WeakPolarHBondContact OE1-CG2 3.37Å; E579-T590 PolarHBondContact OE1-OG1 3.28Å; S587-T590 PolarHBondContact O-N 3.47Å; T590-L592 HydrophobicContact CG2-CB 4.19Å; T590-F646 HydrophobicContact CG2-CD2 4Å; T590-T647 CarbonylContact C-O 3.54Å; T590-T647 VanDerWaalsContact CA-O 3.29Å; T590-T647 WeakPolarHBondContact CA-O 3.46Å; T590-T648 PolarHBondContact OG1-OG1 3.48Å
591	T	88.9	Confident	88.6	Confident	25 Å²	25	34.1 Å²	34.1	15%	0.153	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-107.4	102.6	172.2	65.8	0	0	0	0	109.7	F646 T647	T591-F646 WeakPolarHBondContact O-CB 3.45Å; T591-T647 PolarHBondContact N-O 2.89Å; T591-T647 PolarHBondContact O-N 3.09Å; T591-T647 PolarHBondContact OG1-OG1 3.07Å
592	L	91.8	Very high	88.3	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.021	22%	0.224	C	C	.	.			trans	-127.4	128.5	-176.4	176.9	67.3	0	0	0	111	F571 L575 T590 L594 D595 F644 F646	F571-L592 HydrophobicContact CE1-CD1 4.4Å; F571-L592 HydrophobicContact CE1-CD2 3.94Å; F571-L592 HydrophobicContact CZ-CD1 4.16Å; F571-L592 HydrophobicContact CZ-CD2 4.27Å; L575-L592 HydrophobicContact CD2-CD2 3.79Å; T590-L592 HydrophobicContact CG2-CB 4.19Å; L592-L594 HydrophobicContact CD1-CB 4.33Å; L592-L594 HydrophobicContact CD2-CB 3.83Å; L592-L594 HydrophobicContact CD2-CD2 4.45Å; L592-L594 HydrophobicContact CG-CB 3.8Å; L592-L594 PolarHBondContact O-N 2.94Å; L592-D595 PolarHBondContact O-N 2.96Å; L592-D595 VanDerWaalsContact O-N 3.17Å; L592-F644 HydrophobicContact CD1-CD2 4.49Å; L592-F644 HydrophobicContact CD1-CE2 4.08Å; L592-F646 HydrophobicContact CB-CB 4.31Å; L592-F646 HydrophobicContact CD1-CB 3.77Å; L592-F646 HydrophobicContact CD1-CD1 4.32Å; L592-F646 HydrophobicContact CD1-CG 4.23Å
593	W	91	Very high	88.2	Confident	1 Å²	1	45.2 Å²	45.2	0%	0.004	24%	0.24	C	C	.	.	H	α-helix	trans	-57.1	-34	178.8	68	-90.8	0	0	0	112.9	F562 D595 D596 F597 F611 L615 W627 L631 F644	F562-W593 AromaticContact CD2-CH2 3.87Å; F562-W593 HydrophobicContact CD2-CH2 3.87Å; F562-W593 HydrophobicContact CD2-CZ2 4.03Å; F562-W593 HydrophobicContact CE1-CZ2 4.24Å; F562-W593 AromaticContact CE2-CH2 3.75Å; F562-W593 HydrophobicContact CE2-CH2 3.75Å; F562-W593 AromaticContact CE2-CZ2 3.41Å; F562-W593 HydrophobicContact CE2-CZ2 3.41Å; F562-W593 VanDerWaalsContact CE2-CZ2 3.41Å; F562-W593 HydrophobicContact CG-CH2 4.33Å; F562-W593 HydrophobicContact CZ-CH2 4.1Å; F562-W593 AromaticContact CZ-CZ2 3.52Å; F562-W593 HydrophobicContact CZ-CZ2 3.52Å; W593-D595 VanDerWaalsContact C-N 3.27Å; W593-D595 PolarHBondContact O-N 3.31Å; W593-D596 PolarHBondContact O-N 3.47Å; W593-F597 HydrophobicContact CE3-CB 4.05Å; W593-F597 HydrophobicContact CE3-CG 4.48Å; W593-F597 HydrophobicContact CZ3-CB 4.23Å; W593-F597 AromaticContact CZ3-CD1 3.89Å; W593-F597 HydrophobicContact CZ3-CD1 3.89Å; W593-F597 HydrophobicContact CZ3-CG 4.25Å; W593-F597 WeakPolarHBondContact O-CB 3.32Å; W593-F597 PolarHBondContact O-N 2.76Å; W593-F611 HydrophobicContact CH2-CE1 4.19Å; W593-F611 HydrophobicContact CH2-CZ 4.03Å; W593-F611 HydrophobicContact CZ3-CE1 4.47Å; W593-F611 HydrophobicContact CZ3-CZ 4.18Å; W593-L615 HydrophobicContact CE3-CD1 3.96Å; W593-L615 HydrophobicContact CH2-CD2 4.31Å; W593-L615 HydrophobicContact CZ3-CD1 3.65Å; W593-L615 HydrophobicContact CZ3-CD2 4.15Å; W593-W627 HydrophobicContact CB-CB 4.24Å; W593-W627 HydrophobicContact CB-CD2 3.69Å; W593-W627 HydrophobicContact CB-CE3 3.49Å; W593-W627 VanDerWaalsContact CB-CE3 3.49Å; W593-W627 HydrophobicContact CB-CG 4.05Å; W593-W627 HydrophobicContact CB-CZ3 4.06Å; W593-L631 HydrophobicContact CD2-CD1 4.4Å; W593-L631 HydrophobicContact CD2-CD2 3.89Å; W593-L631 HydrophobicContact CG-CD2 3.98Å; W593-L631 HydrophobicContact CZ2-CD2 4.03Å; W593-F644 AromaticContact NE1-CD2 3.52Å; W593-F644 AromaticContact NE1-CG 3.74Å
594	L	91.1	Very high	88.1	Confident	6 Å²	6	46 Å²	46	3%	0.031	25%	0.246	C	C	.	.	H	α-helix	trans	-64	-28.9	-178.2	-171.6	66.4	0	0	0	112.6	F562 F571 L592 S598 F611	F562-L594 HydrophobicContact CD1-CD1 3.89Å; F562-L594 HydrophobicContact CD1-CD2 4.07Å; F562-L594 HydrophobicContact CE1-CD1 4.11Å; F562-L594 HydrophobicContact CE1-CD2 3.75Å; F562-L594 HydrophobicContact CG-CD1 4.49Å; F571-L594 HydrophobicContact CD1-CD2 4.24Å; F571-L594 HydrophobicContact CE1-CD2 4.1Å; L592-L594 HydrophobicContact CD1-CB 4.33Å; L592-L594 HydrophobicContact CD2-CB 3.83Å; L592-L594 HydrophobicContact CD2-CD2 4.45Å; L592-L594 HydrophobicContact CG-CB 3.8Å; L592-L594 PolarHBondContact O-N 2.94Å; L594-S598 VanDerWaalsContact O-CB 3.23Å; L594-S598 WeakPolarHBondContact O-CB 3.46Å; L594-S598 PolarHBondContact O-N 3.49Å; L594-S598 PolarHBondContact O-OG 3.12Å; L594-F611 HydrophobicContact CD1-CE2 4.47Å; L594-F611 HydrophobicContact CD1-CZ 4.07Å
595	D	89.9	Confident	87.6	Confident	34 Å²	34	48.1 Å²	48.1	18%	0.182	27%	0.269	C	S	.	.	H	α-helix	trans	-73.7	-36.1	179	-70.6	-24.2	0	0	0	112.6	R572 L592 W593 S598 K599	R572-D595 IonicContact CZ-OD1 3.45Å; R572-D595 IonicContact NH1-OD1 3.64Å; R572-D595 PolarHBondContact NH1-OD1 3.36Å; R572-D595 IonicContact NH2-OD1 3.67Å; R572-D595 PolarHBondContact NH2-OD1 2.91Å; L592-D595 PolarHBondContact O-N 2.96Å; L592-D595 VanDerWaalsContact O-N 3.17Å; W593-D595 VanDerWaalsContact C-N 3.27Å; W593-D595 PolarHBondContact O-N 3.31Å; D595-S598 WeakPolarHBondContact CA-OG 3.39Å; D595-S598 PolarHBondContact O-OG 3.2Å; D595-K599 WeakPolarHBondContact O-CD 3.48Å; D595-K599 WeakPolarHBondContact O-CG 3.24Å
596	D	87.3	Confident	86.9	Confident	12 Å²	12	46.9 Å²	46.9	6%	0.064	27%	0.265	C	S	.	.	H	α-helix	trans	-76.9	-37.3	174.6	-80.2	1.5	0	0	0	111.2	W593 K599 H600 F618 K624 W627	W593-D596 PolarHBondContact O-N 3.47Å; D596-K599 IonicContact OD1-NZ 2.68Å; D596-H600 PolarHBondContact O-N 3.46Å; D596-F618 HydrophobicContact CB-CZ 4Å; D596-K624 IonicContact OD2-NZ 2.74Å; D596-K624 PolarHBondContact OD2-NZ 3.42Å; D596-W627 HydrophobicContact CB-CZ2 4.47Å; D596-W627 WeakPolarHBondContact OD2-CZ2 3.38Å; D596-W627 PolarHBondContact OD2-NE1 2.89Å
597	F	89.9	Confident	86.4	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-69	-42.3	177.9	-174.4	-118.8	0	0	0	112.3	W593 K599 H600 L601 F611 L615 F618	W593-F597 HydrophobicContact CE3-CB 4.05Å; W593-F597 HydrophobicContact CE3-CG 4.48Å; W593-F597 HydrophobicContact CZ3-CB 4.23Å; W593-F597 AromaticContact CZ3-CD1 3.89Å; W593-F597 HydrophobicContact CZ3-CD1 3.89Å; W593-F597 HydrophobicContact CZ3-CG 4.25Å; W593-F597 WeakPolarHBondContact O-CB 3.32Å; W593-F597 PolarHBondContact O-N 2.76Å; F597-K599 PolarHBondContact O-N 2.96Å; F597-H600 CarbonylContact O-C 3.52Å; F597-H600 WeakPolarHBondContact O-CA 3.3Å; F597-H600 WeakPolarHBondContact O-CB 3.5Å; F597-H600 PolarHBondContact O-N 3.49Å; F597-L601 HydrophobicContact CE1-CD1 4.32Å; F597-L601 HydrophobicContact CZ-CD1 4.05Å; F597-L601 WeakPolarHBondContact O-CB 3.42Å; F597-L601 PolarHBondContact O-N 3.12Å; F597-F611 HydrophobicContact CD1-CE1 4.36Å; F597-F611 AromaticContact CD1-CE2 3.8Å; F597-F611 HydrophobicContact CD1-CE2 3.8Å; F597-F611 AromaticContact CD1-CZ 3.64Å; F597-F611 HydrophobicContact CD1-CZ 3.64Å; F597-F611 HydrophobicContact CE1-CD1 4.22Å; F597-F611 AromaticContact CE1-CD2 3.81Å; F597-F611 HydrophobicContact CE1-CD2 3.81Å; F597-F611 AromaticContact CE1-CE1 3.84Å; F597-F611 HydrophobicContact CE1-CE1 3.84Å; F597-F611 AromaticContact CE1-CE2 3.42Å; F597-F611 HydrophobicContact CE1-CE2 3.42Å; F597-F611 VanDerWaalsContact CE1-CE2 3.42Å; F597-F611 HydrophobicContact CE1-CG 4.2Å; F597-F611 AromaticContact CE1-CZ 3.42Å; F597-F611 HydrophobicContact CE1-CZ 3.42Å; F597-F611 VanDerWaalsContact CE1-CZ 3.42Å; F597-F611 WeakPolarHBondContact CZ-O 3.43Å; F597-L615 HydrophobicContact CD1-CD1 4.25Å; F597-L615 HydrophobicContact CD2-CD1 4.06Å; F597-L615 HydrophobicContact CE1-CB 4.2Å; F597-L615 HydrophobicContact CE1-CD1 4.31Å; F597-L615 HydrophobicContact CE2-CB 4.14Å; F597-L615 HydrophobicContact CE2-CD1 4.16Å; F597-L615 HydrophobicContact CG-CD1 4.11Å; F597-L615 HydrophobicContact CZ-CB 3.77Å; F597-L615 HydrophobicContact CZ-CD1 4.28Å; F597-F618 HydrophobicContact CB-CD1 4.49Å; F597-F618 HydrophobicContact CB-CE1 4.25Å; F597-F618 HydrophobicContact CB-CZ 4.36Å; F597-F618 HydrophobicContact CD2-CB 3.73Å; F597-F618 AromaticContact CD2-CD1 3.8Å; F597-F618 HydrophobicContact CD2-CD1 3.8Å; F597-F618 AromaticContact CD2-CD2 3.94Å; F597-F618 HydrophobicContact CD2-CD2 3.94Å; F597-F618 HydrophobicContact CD2-CE1 4.34Å; F597-F618 HydrophobicContact CD2-CE2 4.45Å; F597-F618 AromaticContact CD2-CG 3.56Å; F597-F618 HydrophobicContact CD2-CG 3.56Å; F597-F618 HydrophobicContact CE2-CB 3.73Å; F597-F618 HydrophobicContact CE2-CG 4.11Å
598	S	87.8	Confident	85.9	Confident	34 Å²	34	54.1 Å²	54.1	24%	0.238	29%	0.289	C	S	.	.	H	α-helix	trans	-60.8	-41.7	177.3	49.4	0	0	0	0	112.7	L594 D595 H600 L601 E602	L594-S598 VanDerWaalsContact O-CB 3.23Å; L594-S598 WeakPolarHBondContact O-CB 3.46Å; L594-S598 PolarHBondContact O-N 3.49Å; L594-S598 PolarHBondContact O-OG 3.12Å; D595-S598 WeakPolarHBondContact CA-OG 3.39Å; D595-S598 PolarHBondContact O-OG 3.2Å; S598-H600 VanDerWaalsContact C-N 3.28Å; S598-H600 PolarHBondContact O-N 3.19Å; S598-L601 PolarHBondContact O-N 3.46Å; S598-E602 WeakPolarHBondContact O-CG 3.44Å; S598-E602 PolarHBondContact O-N 3.08Å
599	K	86.4	Confident	85.6	Confident	103 Å²	103	57.2 Å²	57.2	45%	0.448	30%	0.3	S	S	.	.	H	α-helix	trans	-61.7	-36.4	172.6	-68.5	170.2	-168.7	160.2	0	112.8	D595 D596 F597 H603	D595-K599 WeakPolarHBondContact O-CD 3.48Å; D595-K599 WeakPolarHBondContact O-CG 3.24Å; D596-K599 IonicContact OD1-NZ 2.68Å; F597-K599 PolarHBondContact O-N 2.96Å; K599-H603 PolarHBondContact O-N 2.73Å
600	H	85.7	Confident	85.4	Confident	55 Å²	55	61.2 Å²	61.2	26%	0.255	32%	0.319	S	S	.	.	H	α-helix	trans	-69.4	-41.6	176.2	-172.5	65.9	0	0	0	111.4	D596 F597 S598 H603 L604 F618	D596-H600 PolarHBondContact O-N 3.46Å; F597-H600 CarbonylContact O-C 3.52Å; F597-H600 WeakPolarHBondContact O-CA 3.3Å; F597-H600 WeakPolarHBondContact O-CB 3.5Å; F597-H600 PolarHBondContact O-N 3.49Å; S598-H600 VanDerWaalsContact C-N 3.28Å; S598-H600 PolarHBondContact O-N 3.19Å; H600-H603 WeakPolarHBondContact O-CB 3.47Å; H600-H603 PolarHBondContact O-N 3.37Å; H600-L604 PolarHBondContact O-N 3.41Å; H600-F618 HydrophobicContact CB-CD2 3.99Å; H600-F618 HydrophobicContact CB-CE2 4.04Å; H600-F618 AromaticContact CD2-CD2 3.69Å; H600-F618 AromaticContact CG-CD2 3.81Å
601	L	86.7	Confident	85.1	Confident	28 Å²	28	61.6 Å²	61.6	15%	0.147	32%	0.32	C	S	.	.	H	α-helix	trans	-63.6	-43.3	177.1	-160.4	82.4	0	0	0	111.8	F597 S598 H603 L604 G605 A606 F611 Y614	F597-L601 HydrophobicContact CE1-CD1 4.32Å; F597-L601 HydrophobicContact CZ-CD1 4.05Å; F597-L601 WeakPolarHBondContact O-CB 3.42Å; F597-L601 PolarHBondContact O-N 3.12Å; S598-L601 PolarHBondContact O-N 3.46Å; L601-H603 PolarHBondContact O-N 3.36Å; L601-L604 PolarHBondContact O-N 3.01Å; L601-L604 VanDerWaalsContact O-N 3.12Å; L601-G605 PolarHBondContact O-N 2.91Å; L601-A606 HydrophobicContact CD1-CB 3.71Å; L601-A606 HydrophobicContact CG-CB 4.11Å; L601-F611 HydrophobicContact CD2-CD2 4.37Å; L601-Y614 HydrophobicContact CD1-CD2 4.3Å; L601-Y614 HydrophobicContact CD1-CG 4.5Å
602	E	85.6	Confident	85	Confident	158 Å²	158	61 Å²	61	74%	0.738	32%	0.315	S	S	*	.	H	α-helix	trans	-59.4	-35.1	174.7	-76.3	176.4	-176.4	0	0	112.4	S598	S598-E602 WeakPolarHBondContact O-CG 3.44Å; S598-E602 PolarHBondContact O-N 3.08Å
603	H	85.1	Confident	84.8	Confident	160 Å²	160	65.9 Å²	65.9	74%	0.741	34%	0.342	S	S	*	.	H	α-helix	trans	-70.6	-32.5	176.7	-172.7	71.5	0	0	0	112.8	K599 H600 L601	K599-H603 PolarHBondContact O-N 2.73Å; H600-H603 WeakPolarHBondContact O-CB 3.47Å; H600-H603 PolarHBondContact O-N 3.37Å; L601-H603 PolarHBondContact O-N 3.36Å
604	L	85.8	Confident	84.7	Confident	83 Å²	83	69 Å²	69	44%	0.435	35%	0.354	S	S	.	.	H	α-helix	trans	-84	-25	179.2	-66.8	173.9	0	0	0	113	H600 L601 Y614	H600-L604 PolarHBondContact O-N 3.41Å; L601-L604 PolarHBondContact O-N 3.01Å; L601-L604 VanDerWaalsContact O-N 3.12Å; L604-Y614 HydrophobicContact CD1-CD1 3.7Å; L604-Y614 HydrophobicContact CD1-CE1 4.07Å; L604-Y614 HydrophobicContact CD1-CG 4.41Å
605	G	79.7	Confident	84.7	Confident	65 Å²	65	68.9 Å²	68.9	67%	0.67	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	31.7	-176.9	0	0	0	0	0	113.6	L601	L601-G605 PolarHBondContact O-N 2.91Å
606	A	72.7	Confident	84.6	Confident	24 Å²	24	69.6 Å²	69.6	20%	0.198	35%	0.354	C	S	.	.			trans	-73.3	155.4	-174.7	0	0	0	0	0	114.3	L601 Y614	L601-A606 HydrophobicContact CD1-CB 3.71Å; L601-A606 HydrophobicContact CG-CB 4.11Å; A606-Y614 HydrophobicContact CB-CD2 3.58Å; A606-Y614 HydrophobicContact CB-CE2 3.28Å; A606-Y614 HydrophobicContact CB-CG 4.43Å
607	E	77.6	Confident	84.7	Confident	139 Å²	139	73.1 Å²	73.1	65%	0.65	37%	0.373	S	S	*	.			trans	-85.8	155.6	174	-62.9	-175.1	175.4	0	0	112.3	E609 E610	E607-E609 PolarHBondContact O-N 2.79Å; E607-E610 PolarHBondContact O-N 2.62Å
608	D	76.8	Confident	84.7	Confident	99 Å²	99	73.2 Å²	73.2	53%	0.529	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-61.4	-27.3	-175.5	-72.8	-27.1	0	0	0	113.3	R563 F611	R563-D608 WeakPolarHBondContact CG-O 3.36Å; D608-F611 WeakPolarHBondContact O-CB 3.31Å
609	E	77.7	Confident	84.7	Confident	166 Å²	166	72.1 Å²	72.1	78%	0.776	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-69.9	-34.9	-178.9	-66.8	-170.2	177.4	0	0	112.8	E607 F611	E607-E609 PolarHBondContact O-N 2.79Å; E609-F611 VanDerWaalsContact C-N 3.27Å; E609-F611 PolarHBondContact O-N 3.26Å
610	E	83.3	Confident	84.8	Confident	84 Å²	84	74.4 Å²	74.4	39%	0.393	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-86.1	5.6	-177.6	-62.7	-175.4	166.5	0	0	112.7	E607 Y612 D613 Y614	E607-E610 PolarHBondContact O-N 2.62Å; E610-Y612 VanDerWaalsContact C-N 3.29Å; E610-Y612 PolarHBondContact O-N 3.42Å; E610-Y612 VanDerWaalsContact O-N 3.14Å; E610-D613 PolarHBondContact O-N 3.24Å; E610-Y614 HydrophobicContact CB-CD2 3.81Å; E610-Y614 HydrophobicContact CB-CE2 3.46Å; E610-Y614 VanDerWaalsContact CB-CE2 3.46Å; E610-Y614 HydrophobicContact CG-CE2 4.38Å; E610-Y614 VanDerWaalsContact O-CD2 3.25Å; E610-Y614 WeakPolarHBondContact O-CD2 3.31Å; E610-Y614 PolarHBondContact O-N 2.95Å; E610-Y614 VanDerWaalsContact O-N 3.17Å; E610-Y614 WeakPolarHBondContact OE2-CE2 3.34Å; E610-Y614 PolarHBondContact OE2-OH 3.24Å
611	F	87	Confident	84.8	Confident	13 Å²	13	75.2 Å²	75.2	6%	0.057	38%	0.38	C	S	.	.	H	α-helix	trans	-49	-45.9	-174	179.7	-84.1	0	0	0	113.4	F562 R563 W593 L594 F597 L601 D608 E609 L615	F562-F611 HydrophobicContact CB-CD1 3.99Å; F562-F611 HydrophobicContact CB-CD2 4.37Å; F562-F611 HydrophobicContact CB-CE1 3.42Å; F562-F611 VanDerWaalsContact CB-CE1 3.42Å; F562-F611 HydrophobicContact CB-CE2 3.82Å; F562-F611 HydrophobicContact CB-CG 4.45Å; F562-F611 HydrophobicContact CB-CZ 3.32Å; F562-F611 HydrophobicContact CD2-CE1 4.14Å; F562-F611 HydrophobicContact CD2-CZ 4.34Å; F562-F611 HydrophobicContact CG-CE1 4.01Å; F562-F611 AromaticContact CG-CZ 3.84Å; F562-F611 HydrophobicContact CG-CZ 3.84Å; R563-F611 HydrophobicContact CG-CB 4.17Å; W593-F611 HydrophobicContact CH2-CE1 4.19Å; W593-F611 HydrophobicContact CH2-CZ 4.03Å; W593-F611 HydrophobicContact CZ3-CE1 4.47Å; W593-F611 HydrophobicContact CZ3-CZ 4.18Å; L594-F611 HydrophobicContact CD1-CE2 4.47Å; L594-F611 HydrophobicContact CD1-CZ 4.07Å; F597-F611 HydrophobicContact CD1-CE1 4.36Å; F597-F611 AromaticContact CD1-CE2 3.8Å; F597-F611 HydrophobicContact CD1-CE2 3.8Å; F597-F611 AromaticContact CD1-CZ 3.64Å; F597-F611 HydrophobicContact CD1-CZ 3.64Å; F597-F611 HydrophobicContact CE1-CD1 4.22Å; F597-F611 AromaticContact CE1-CD2 3.81Å; F597-F611 HydrophobicContact CE1-CD2 3.81Å; F597-F611 AromaticContact CE1-CE1 3.84Å; F597-F611 HydrophobicContact CE1-CE1 3.84Å; F597-F611 AromaticContact CE1-CE2 3.42Å; F597-F611 HydrophobicContact CE1-CE2 3.42Å; F597-F611 VanDerWaalsContact CE1-CE2 3.42Å; F597-F611 HydrophobicContact CE1-CG 4.2Å; F597-F611 AromaticContact CE1-CZ 3.42Å; F597-F611 HydrophobicContact CE1-CZ 3.42Å; F597-F611 VanDerWaalsContact CE1-CZ 3.42Å; F597-F611 WeakPolarHBondContact CZ-O 3.43Å; L601-F611 HydrophobicContact CD2-CD2 4.37Å; D608-F611 WeakPolarHBondContact O-CB 3.31Å; E609-F611 VanDerWaalsContact C-N 3.27Å; E609-F611 PolarHBondContact O-N 3.26Å; F611-L615 HydrophobicContact CE1-CD2 4.44Å; F611-L615 WeakPolarHBondContact O-CB 3.39Å; F611-L615 PolarHBondContact O-N 2.84Å
612	Y	87.1	Confident	84.6	Confident	12 Å²	12	79.6 Å²	79.6	5%	0.047	41%	0.413	C	S	.	.	H	α-helix	trans	-76	-29.8	-177	-66.1	-67.6	0	0	0	112.9	D561 F562 R563 E610 L615 Y616 P640 V641	D561-Y612 WeakPolarHBondContact OD1-CE2 3.42Å; D561-Y612 PolarHBondContact OD1-OH 3.34Å; F562-Y612 PolarHBondContact N-OH 2.9Å; R563-Y612 HydrophobicContact CG-CD2 4.21Å; R563-Y612 HydrophobicContact CG-CE2 3.76Å; E610-Y612 VanDerWaalsContact C-N 3.29Å; E610-Y612 PolarHBondContact O-N 3.42Å; E610-Y612 VanDerWaalsContact O-N 3.14Å; Y612-L615 HydrophobicContact CD1-CD2 4.16Å; Y612-L615 WeakPolarHBondContact O-CB 3.33Å; Y612-L615 PolarHBondContact O-N 3.37Å; Y612-Y616 WeakPolarHBondContact O-CD2 3.44Å; Y612-Y616 PolarHBondContact O-N 2.95Å; Y612-P640 HydrophobicContact CD1-CB 4.18Å; Y612-P640 HydrophobicContact CD1-CG 3.95Å; Y612-P640 HydrophobicContact CD2-CG 4.07Å; Y612-P640 HydrophobicContact CE1-CG 4.43Å; Y612-P640 HydrophobicContact CG-CB 4.46Å; Y612-P640 HydrophobicContact CG-CG 3.77Å; Y612-V641 HydrophobicContact CD1-CG2 4.28Å; Y612-V641 HydrophobicContact CE1-CB 4.32Å; Y612-V641 HydrophobicContact CE1-CG2 3.89Å
613	D	86.7	Confident	84.3	Confident	107 Å²	107	75.2 Å²	75.2	57%	0.572	40%	0.4	S	S	*	.	H	α-helix	trans	-66.1	-47.1	176.9	-67.6	-31.4	0	0	0	110.3	E610 L615 Y616 D617	E610-D613 PolarHBondContact O-N 3.24Å; D613-L615 VanDerWaalsContact C-N 3.28Å; D613-L615 PolarHBondContact O-N 3.43Å; D613-Y616 PolarHBondContact O-N 3.23Å; D613-D617 PolarHBondContact O-N 3.21Å
614	Y	88.9	Confident	84.2	Confident	68 Å²	68	68.9 Å²	68.9	27%	0.267	37%	0.37	S	S	.	.	H	α-helix	trans	-64.6	-31.5	172.2	-68	-67.2	0	0	0	112.8	L601 L604 A606 E610 Y616 D617 F618	L601-Y614 HydrophobicContact CD1-CD2 4.3Å; L601-Y614 HydrophobicContact CD1-CG 4.5Å; L604-Y614 HydrophobicContact CD1-CD1 3.7Å; L604-Y614 HydrophobicContact CD1-CE1 4.07Å; L604-Y614 HydrophobicContact CD1-CG 4.41Å; A606-Y614 HydrophobicContact CB-CD2 3.58Å; A606-Y614 HydrophobicContact CB-CE2 3.28Å; A606-Y614 HydrophobicContact CB-CG 4.43Å; E610-Y614 HydrophobicContact CB-CD2 3.81Å; E610-Y614 HydrophobicContact CB-CE2 3.46Å; E610-Y614 VanDerWaalsContact CB-CE2 3.46Å; E610-Y614 HydrophobicContact CG-CE2 4.38Å; E610-Y614 VanDerWaalsContact O-CD2 3.25Å; E610-Y614 WeakPolarHBondContact O-CD2 3.31Å; E610-Y614 PolarHBondContact O-N 2.95Å; E610-Y614 VanDerWaalsContact O-N 3.17Å; E610-Y614 WeakPolarHBondContact OE2-CE2 3.34Å; E610-Y614 PolarHBondContact OE2-OH 3.24Å; Y614-Y616 VanDerWaalsContact C-N 3.34Å; Y614-D617 PolarHBondContact O-N 3.42Å; Y614-F618 VanDerWaalsContact O-CB 3.29Å; Y614-F618 WeakPolarHBondContact O-CB 3.43Å; Y614-F618 PolarHBondContact O-N 3.42Å
615	L	90.1	Very high	84.1	Confident	3 Å²	3	67 Å²	67	2%	0.016	37%	0.367	C	S	.	.	H	α-helix	trans	-63.1	-42.4	174.9	-178.6	61.5	0	0	0	110.9	W593 F597 F611 Y612 D613 D617 F618 L619 L631 V641	W593-L615 HydrophobicContact CE3-CD1 3.96Å; W593-L615 HydrophobicContact CH2-CD2 4.31Å; W593-L615 HydrophobicContact CZ3-CD1 3.65Å; W593-L615 HydrophobicContact CZ3-CD2 4.15Å; F597-L615 HydrophobicContact CD1-CD1 4.25Å; F597-L615 HydrophobicContact CD2-CD1 4.06Å; F597-L615 HydrophobicContact CE1-CB 4.2Å; F597-L615 HydrophobicContact CE1-CD1 4.31Å; F597-L615 HydrophobicContact CE2-CB 4.14Å; F597-L615 HydrophobicContact CE2-CD1 4.16Å; F597-L615 HydrophobicContact CG-CD1 4.11Å; F597-L615 HydrophobicContact CZ-CB 3.77Å; F597-L615 HydrophobicContact CZ-CD1 4.28Å; F611-L615 HydrophobicContact CE1-CD2 4.44Å; F611-L615 WeakPolarHBondContact O-CB 3.39Å; F611-L615 PolarHBondContact O-N 2.84Å; Y612-L615 HydrophobicContact CD1-CD2 4.16Å; Y612-L615 WeakPolarHBondContact O-CB 3.33Å; Y612-L615 PolarHBondContact O-N 3.37Å; D613-L615 VanDerWaalsContact C-N 3.28Å; D613-L615 PolarHBondContact O-N 3.43Å; L615-D617 VanDerWaalsContact C-N 3.32Å; L615-D617 PolarHBondContact O-N 3.45Å; L615-F618 HydrophobicContact CD1-CD1 4.38Å; L615-F618 PolarHBondContact O-N 3.23Å; L615-L619 HydrophobicContact CD1-CD1 4.33Å; L615-L619 HydrophobicContact CD1-CG 4.26Å; L615-L619 HydrophobicContact CG-CD1 4.15Å; L615-L619 HydrophobicContact CG-CG 4.49Å; L615-L619 WeakPolarHBondContact O-CG 3.36Å; L615-L619 PolarHBondContact O-N 2.88Å; L615-L631 HydrophobicContact CD1-CD1 4.48Å; L615-V641 HydrophobicContact CD2-CG2 3.73Å
616	Y	89.2	Confident	84	Confident	48 Å²	48	66.2 Å²	66.2	19%	0.188	35%	0.346	C	S	.	.	H	α-helix	trans	-62.5	-40.1	176.3	-72.3	-65.6	0	0	0	112.3	Y612 D613 Y614 L619 K620 I633 E635 P640	Y612-Y616 WeakPolarHBondContact O-CD2 3.44Å; Y612-Y616 PolarHBondContact O-N 2.95Å; D613-Y616 PolarHBondContact O-N 3.23Å; Y614-Y616 VanDerWaalsContact C-N 3.34Å; Y616-L619 PolarHBondContact O-N 2.84Å; Y616-K620 WeakPolarHBondContact O-CG 3.46Å; Y616-K620 PolarHBondContact O-N 3.35Å; Y616-I633 HydrophobicContact CE1-CG2 3.81Å; Y616-I633 WeakPolarHBondContact OH-CG2 3.08Å; Y616-E635 HydrophobicContact CE1-CG 4.18Å; Y616-P640 WeakPolarHBondContact OH-CB 3.4Å
617	D	88.8	Confident	84.7	Confident	87 Å²	87	65.7 Å²	65.7	47%	0.465	34%	0.339	S	S	.	.	H	α-helix	trans	-71	-38.2	177.6	-72.6	-18.3	0	0	0	112.2	D613 Y614 L615 L619 K620 L621	D613-D617 PolarHBondContact O-N 3.21Å; Y614-D617 PolarHBondContact O-N 3.42Å; L615-D617 VanDerWaalsContact C-N 3.32Å; L615-D617 PolarHBondContact O-N 3.45Å; D617-L619 VanDerWaalsContact C-N 3.32Å; D617-L619 PolarHBondContact O-N 3.18Å; D617-K620 WeakPolarHBondContact O-CB 3.42Å; D617-K620 PolarHBondContact O-N 2.94Å; D617-K620 VanDerWaalsContact O-N 3.11Å; D617-K620 IonicContact OD1-NZ 2.77Å; D617-K620 PolarHBondContact OD1-NZ 3.49Å; D617-L621 PolarHBondContact O-N 3.48Å
618	F	89.1	Confident	85.1	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.009	33%	0.331	C	S	.	.	H	α-helix	trans	-58.6	-42.9	172.2	176.2	-100.4	0	0	0	112.1	D596 F597 H600 Y614 L615 K620 L621 K624 W627	D596-F618 HydrophobicContact CB-CZ 4Å; F597-F618 HydrophobicContact CB-CD1 4.49Å; F597-F618 HydrophobicContact CB-CE1 4.25Å; F597-F618 HydrophobicContact CB-CZ 4.36Å; F597-F618 HydrophobicContact CD2-CB 3.73Å; F597-F618 AromaticContact CD2-CD1 3.8Å; F597-F618 HydrophobicContact CD2-CD1 3.8Å; F597-F618 AromaticContact CD2-CD2 3.94Å; F597-F618 HydrophobicContact CD2-CD2 3.94Å; F597-F618 HydrophobicContact CD2-CE1 4.34Å; F597-F618 HydrophobicContact CD2-CE2 4.45Å; F597-F618 AromaticContact CD2-CG 3.56Å; F597-F618 HydrophobicContact CD2-CG 3.56Å; F597-F618 HydrophobicContact CE2-CB 3.73Å; F597-F618 HydrophobicContact CE2-CG 4.11Å; H600-F618 HydrophobicContact CB-CD2 3.99Å; H600-F618 HydrophobicContact CB-CE2 4.04Å; H600-F618 AromaticContact CD2-CD2 3.69Å; H600-F618 AromaticContact CG-CD2 3.81Å; Y614-F618 VanDerWaalsContact O-CB 3.29Å; Y614-F618 WeakPolarHBondContact O-CB 3.43Å; Y614-F618 PolarHBondContact O-N 3.42Å; L615-F618 HydrophobicContact CD1-CD1 4.38Å; L615-F618 PolarHBondContact O-N 3.23Å; F618-K620 VanDerWaalsContact C-N 3.25Å; F618-K620 PolarHBondContact O-N 3.41Å; F618-L621 HydrophobicContact CD2-CD1 4.23Å; F618-L621 WeakPolarHBondContact O-CB 3.31Å; F618-L621 PolarHBondContact O-N 3.11Å; F618-K624 HydrophobicContact CD1-CB 4.34Å; F618-K624 HydrophobicContact CD2-CB 4.32Å; F618-K624 HydrophobicContact CD2-CG 4.19Å; F618-K624 HydrophobicContact CE1-CB 3.95Å; F618-K624 HydrophobicContact CE1-CG 4.34Å; F618-K624 HydrophobicContact CE2-CB 3.94Å; F618-K624 HydrophobicContact CE2-CD 3.95Å; F618-K624 HydrophobicContact CE2-CG 3.53Å; F618-K624 HydrophobicContact CZ-CB 3.74Å; F618-K624 HydrophobicContact CZ-CD 3.69Å; F618-K624 HydrophobicContact CZ-CG 3.61Å; F618-W627 HydrophobicContact CE1-CB 4.49Å; F618-W627 AromaticContact CE1-CD1 3.64Å; F618-W627 HydrophobicContact CE1-CG 4.29Å; F618-W627 AromaticContact CZ-CD1 3.85Å
619	L	88.5	Confident	85.1	Confident	10 Å²	10	61.5 Å²	61.5	5%	0.052	31%	0.313	C	S	.	.	H	α-helix	trans	-71.1	-16.9	178.3	-66.1	174.5	0	0	0	113.6	L615 Y616 D617 A625 W627 R628 L631 I633	L615-L619 HydrophobicContact CD1-CD1 4.33Å; L615-L619 HydrophobicContact CD1-CG 4.26Å; L615-L619 HydrophobicContact CG-CD1 4.15Å; L615-L619 HydrophobicContact CG-CG 4.49Å; L615-L619 WeakPolarHBondContact O-CG 3.36Å; L615-L619 PolarHBondContact O-N 2.88Å; Y616-L619 PolarHBondContact O-N 2.84Å; D617-L619 VanDerWaalsContact C-N 3.32Å; D617-L619 PolarHBondContact O-N 3.18Å; L619-A625 WeakPolarHBondContact O-CA 3.48Å; L619-W627 HydrophobicContact CD2-CB 3.8Å; L619-R628 HydrophobicContact CD2-CB 4.28Å; L619-L631 HydrophobicContact CD1-CD1 3.88Å; L619-L631 HydrophobicContact CD2-CD1 4.02Å; L619-I633 HydrophobicContact CD1-CD1 3.45Å; L619-I633 VanDerWaalsContact CD1-CD1 3.45Å
620	K	88.6	Confident	85.5	Confident	152 Å²	152	54.6 Å²	54.6	66%	0.661	28%	0.28	S	S	*	.	H	α-helix	trans	-82.8	-19.4	172.7	-69.5	169.1	-161.5	156.8	0	112.7	Y616 D617 F618 S622	Y616-K620 WeakPolarHBondContact O-CG 3.46Å; Y616-K620 PolarHBondContact O-N 3.35Å; D617-K620 WeakPolarHBondContact O-CB 3.42Å; D617-K620 PolarHBondContact O-N 2.94Å; D617-K620 VanDerWaalsContact O-N 3.11Å; D617-K620 IonicContact OD1-NZ 2.77Å; D617-K620 PolarHBondContact OD1-NZ 3.49Å; F618-K620 VanDerWaalsContact C-N 3.25Å; F618-K620 PolarHBondContact O-N 3.41Å; K620-S622 PolarHBondContact O-N 2.74Å
621	L	86.9	Confident	85.8	Confident	71 Å²	71	51.2 Å²	51.2	37%	0.372	27%	0.265	S	S	.	.	S	Bend	trans	-62.6	127.3	177	-65	170	0	0	0	109.6	D617 F618 S623 K624 A625	D617-L621 PolarHBondContact O-N 3.48Å; F618-L621 HydrophobicContact CD2-CD1 4.23Å; F618-L621 WeakPolarHBondContact O-CB 3.31Å; F618-L621 PolarHBondContact O-N 3.11Å; L621-S623 PolarHBondContact O-N 3.24Å; L621-S623 VanDerWaalsContact O-N 3.14Å; L621-K624 HydrophobicContact CB-CB 4.28Å; L621-K624 CarbonylContact O-C 3.58Å; L621-K624 PolarHBondContact O-N 3.24Å; L621-A625 PolarHBondContact O-N 3.29Å
622	S	80.4	Confident	85.7	Confident	121 Å²	121	54.6 Å²	54.6	85%	0.846	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-35.1	-178.1	57.3	0	0	0	0	113	K620 K624	K620-S622 PolarHBondContact O-N 2.74Å; S622-K624 VanDerWaalsContact C-N 3.3Å; S622-K624 PolarHBondContact O-N 3.12Å
623	S	79.5	Confident	85.7	Confident	66 Å²	66	55.5 Å²	55.5	46%	0.462	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-21.8	178	56.3	0	0	0	0	114	L621 H626	L621-S623 PolarHBondContact O-N 3.24Å; L621-S623 VanDerWaalsContact O-N 3.14Å; S623-H626 PolarHBondContact O-CE1 3.5Å; S623-H626 VanDerWaalsContact O-CE1 3.26Å; S623-H626 PolarHBondContact O-ND1 2.87Å
624	K	84.7	Confident	85.6	Confident	26 Å²	26	53.3 Å²	53.3	11%	0.113	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.3	0.4	-173.5	-61.1	-61.4	-171.2	-176	0	113.5	N191 D596 F618 L621 S622 H626 W627	N191-K624 PolarHBondContact OD1-NZ 3.16Å; D596-K624 IonicContact OD2-NZ 2.74Å; D596-K624 PolarHBondContact OD2-NZ 3.42Å; F618-K624 HydrophobicContact CD1-CB 4.34Å; F618-K624 HydrophobicContact CD2-CB 4.32Å; F618-K624 HydrophobicContact CD2-CG 4.19Å; F618-K624 HydrophobicContact CE1-CB 3.95Å; F618-K624 HydrophobicContact CE1-CG 4.34Å; F618-K624 HydrophobicContact CE2-CB 3.94Å; F618-K624 HydrophobicContact CE2-CD 3.95Å; F618-K624 HydrophobicContact CE2-CG 3.53Å; F618-K624 HydrophobicContact CZ-CB 3.74Å; F618-K624 HydrophobicContact CZ-CD 3.69Å; F618-K624 HydrophobicContact CZ-CG 3.61Å; L621-K624 HydrophobicContact CB-CB 4.28Å; L621-K624 CarbonylContact O-C 3.58Å; L621-K624 PolarHBondContact O-N 3.24Å; S622-K624 VanDerWaalsContact C-N 3.3Å; S622-K624 PolarHBondContact O-N 3.12Å; K624-H626 PolarHBondContact O-N 2.93Å; K624-H626 VanDerWaalsContact O-N 3.13Å; K624-W627 WeakPolarHBondContact O-CB 3.28Å; K624-W627 PolarHBondContact O-N 2.94Å
625	A	82	Confident	85.3	Confident	45 Å²	45	56.3 Å²	56.3	37%	0.372	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-57.8	-28.1	179.6	0	0	0	0	0	113.8	L619 L621 W627 R628	L619-A625 WeakPolarHBondContact O-CA 3.48Å; L621-A625 PolarHBondContact O-N 3.29Å; A625-W627 PolarHBondContact O-N 3.25Å; A625-R628 VanDerWaalsContact O-CB 3.26Å; A625-R628 WeakPolarHBondContact O-CB 3.42Å; A625-R628 PolarHBondContact O-N 3.4Å; A625-R628 VanDerWaalsContact O-N 3.08Å
626	H	79	Confident	84.9	Confident	47 Å²	47	65.7 Å²	65.7	22%	0.218	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-59.1	-31.4	176.6	63.9	-87.8	0	0	0	112.7	S623 K624 R628 S629	S623-H626 PolarHBondContact O-CE1 3.5Å; S623-H626 VanDerWaalsContact O-CE1 3.26Å; S623-H626 PolarHBondContact O-ND1 2.87Å; K624-H626 PolarHBondContact O-N 2.93Å; K624-H626 VanDerWaalsContact O-N 3.13Å; H626-R628 PolarHBondContact O-N 2.92Å; H626-R628 VanDerWaalsContact O-N 3.17Å; H626-S629 WeakPolarHBondContact O-CB 3.26Å; H626-S629 PolarHBondContact O-N 3.38Å; H626-S629 VanDerWaalsContact O-N 3.07Å; H626-S629 PolarHBondContact O-OG 2.72Å
627	W	87.2	Confident	84.7	Confident	14 Å²	14	64.7 Å²	64.7	5%	0.053	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-63.2	-21.4	177.3	-70	123.5	0	0	0	113.4	W593 D596 F618 L619 K624 A625 S629 H630	W593-W627 HydrophobicContact CB-CB 4.24Å; W593-W627 HydrophobicContact CB-CD2 3.69Å; W593-W627 HydrophobicContact CB-CE3 3.49Å; W593-W627 VanDerWaalsContact CB-CE3 3.49Å; W593-W627 HydrophobicContact CB-CG 4.05Å; W593-W627 HydrophobicContact CB-CZ3 4.06Å; D596-W627 HydrophobicContact CB-CZ2 4.47Å; D596-W627 WeakPolarHBondContact OD2-CZ2 3.38Å; D596-W627 PolarHBondContact OD2-NE1 2.89Å; F618-W627 HydrophobicContact CE1-CB 4.49Å; F618-W627 AromaticContact CE1-CD1 3.64Å; F618-W627 HydrophobicContact CE1-CG 4.29Å; F618-W627 AromaticContact CZ-CD1 3.85Å; L619-W627 HydrophobicContact CD2-CB 3.8Å; K624-W627 WeakPolarHBondContact O-CB 3.28Å; K624-W627 PolarHBondContact O-N 2.94Å; A625-W627 PolarHBondContact O-N 3.25Å; W627-S629 PolarHBondContact O-N 3.11Å; W627-H630 HydrophobicContact CE3-CB 4.33Å; W627-H630 AromaticContact CE3-CD2 3.97Å; W627-H630 AromaticContact CE3-CG 3.83Å; W627-H630 AromaticContact CE3-ND1 3.85Å; W627-H630 AromaticContact CZ3-CE1 3.66Å; W627-H630 AromaticContact CZ3-ND1 3.67Å; W627-H630 WeakPolarHBondContact O-CB 3.48Å; W627-H630 PolarHBondContact O-N 2.74Å
628	R	84.6	Confident	84.4	Confident	129 Å²	129	67 Å²	67	49%	0.487	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-59.4	-30.2	174.8	-174.3	172.6	178.9	81.1	-1	111.5	L619 A625 H626 H630 L631	L619-R628 HydrophobicContact CD2-CB 4.28Å; A625-R628 VanDerWaalsContact O-CB 3.26Å; A625-R628 WeakPolarHBondContact O-CB 3.42Å; A625-R628 PolarHBondContact O-N 3.4Å; A625-R628 VanDerWaalsContact O-N 3.08Å; H626-R628 PolarHBondContact O-N 2.92Å; H626-R628 VanDerWaalsContact O-N 3.17Å; R628-H630 VanDerWaalsContact C-N 3.25Å; R628-H630 PolarHBondContact O-N 3.08Å; R628-L631 PolarHBondContact O-N 2.83Å
629	S	78.5	Confident	84.1	Confident	20 Å²	20	69.3 Å²	69.3	14%	0.14	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-70.9	-21.2	178.1	75.8	0	0	0	0	113.7	H626 W627 L631 Y645	H626-S629 WeakPolarHBondContact O-CB 3.26Å; H626-S629 PolarHBondContact O-N 3.38Å; H626-S629 VanDerWaalsContact O-N 3.07Å; H626-S629 PolarHBondContact O-OG 2.72Å; W627-S629 PolarHBondContact O-N 3.11Å; S629-L631 VanDerWaalsContact C-N 3.33Å; S629-Y645 WeakPolarHBondContact O-CE1 3.34Å
630	H	86	Confident	84	Confident	22 Å²	22	69.4 Å²	69.4	10%	0.102	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-83.3	-13.2	179.4	-70.1	-125.8	0	0	0	112.9	W627 R628 F644 Y645	W627-H630 HydrophobicContact CE3-CB 4.33Å; W627-H630 AromaticContact CE3-CD2 3.97Å; W627-H630 AromaticContact CE3-CG 3.83Å; W627-H630 AromaticContact CE3-ND1 3.85Å; W627-H630 AromaticContact CZ3-CE1 3.66Å; W627-H630 AromaticContact CZ3-ND1 3.67Å; W627-H630 WeakPolarHBondContact O-CB 3.48Å; W627-H630 PolarHBondContact O-N 2.74Å; R628-H630 VanDerWaalsContact C-N 3.25Å; R628-H630 PolarHBondContact O-N 3.08Å; H630-F644 CarbonylContact O-C 3.54Å; H630-F644 WeakPolarHBondContact O-CA 3.48Å; H630-F644 VanDerWaalsContact O-CB 3.32Å; H630-F644 WeakPolarHBondContact O-CB 3.45Å; H630-Y645 VanDerWaalsContact CA-CE1 3.48Å; H630-Y645 HydrophobicContact CB-CE1 4.22Å; H630-Y645 AromaticContact CD2-CZ 3.95Å; H630-Y645 AromaticContact CE1-CE2 3.75Å; H630-Y645 AromaticContact CG-CZ 3.76Å; H630-Y645 AromaticContact ND1-CE2 3.59Å; H630-Y645 AromaticContact ND1-CZ 3.8Å; H630-Y645 PolarHBondContact O-N 3.03Å
631	L	88.7	Confident	84.1	Confident	13 Å²	13	62.2 Å²	62.2	7%	0.068	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	132.1	-168.6	-61.6	173.6	0	0	0	110.9	W593 L615 L619 R628 S629 I633 V641 F644	W593-L631 HydrophobicContact CD2-CD1 4.4Å; W593-L631 HydrophobicContact CD2-CD2 3.89Å; W593-L631 HydrophobicContact CG-CD2 3.98Å; W593-L631 HydrophobicContact CZ2-CD2 4.03Å; L615-L631 HydrophobicContact CD1-CD1 4.48Å; L619-L631 HydrophobicContact CD1-CD1 3.88Å; L619-L631 HydrophobicContact CD2-CD1 4.02Å; R628-L631 PolarHBondContact O-N 2.83Å; S629-L631 VanDerWaalsContact C-N 3.33Å; L631-I633 HydrophobicContact CB-CD1 4.16Å; L631-I633 HydrophobicContact CB-CG1 3.91Å; L631-I633 HydrophobicContact CD1-CD1 4.28Å; L631-V641 HydrophobicContact CD2-CG1 4.12Å; L631-F644 HydrophobicContact CD2-CB 3.62Å; L631-F644 HydrophobicContact CD2-CG 4.44Å
632	H	85.9	Confident	84.2	Confident	84 Å²	84	62 Å²	62	39%	0.389	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	104.5	164	-166.5	77.2	0	0	0	109.1	F88 Q642 Q643	F88-H632 HydrophobicContact CE2-CB 4.42Å; H632-Q642 PolarHBondContact O-N 3.37Å; H632-Q642 VanDerWaalsContact O-N 3.1Å; H632-Q643 HydrophobicContact CB-CB 3.98Å; H632-Q643 PolarHBondContact N-O 3.22Å
633	I	85.5	Confident	84.7	Confident	31 Å²	31	59 Å²	59	16%	0.159	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	123.2	-175	-53.5	174.6	0	0	0	109.7	Y616 L619 L631 E635 P640	Y616-I633 HydrophobicContact CE1-CG2 3.81Å; Y616-I633 WeakPolarHBondContact OH-CG2 3.08Å; L619-I633 HydrophobicContact CD1-CD1 3.45Å; L619-I633 VanDerWaalsContact CD1-CD1 3.45Å; L631-I633 HydrophobicContact CB-CD1 4.16Å; L631-I633 HydrophobicContact CB-CG1 3.91Å; L631-I633 HydrophobicContact CD1-CD1 4.28Å; I633-E635 HydrophobicContact CG2-CG 4.4Å; I633-P640 CarbonylContact C-O 3.52Å; I633-P640 WeakPolarHBondContact CA-O 2.95Å; I633-P640 HydrophobicContact CG2-CB 4.03Å
634	N	85.5	Confident	85.3	Confident	60 Å²	60	55.9 Å²	55.9	32%	0.321	27%	0.273	S	S	.	.			trans	-107.5	97.1	169.6	-174.6	-2.3	0	0	0	109.5	K636 A637 P640 Q642	N634-K636 PolarHBondContact O-N 2.84Å; N634-K636 PolarHBondContact OD1-N 2.93Å; N634-A637 HydrophobicContact CB-CB 4.2Å; N634-A637 PolarHBondContact O-N 2.95Å; N634-P640 PolarHBondContact N-O 3.23Å; N634-P640 WeakPolarHBondContact O-CA 3.31Å; N634-Q642 HydrophobicContact CB-CG 4.1Å; N634-Q642 PolarHBondContact ND2-NE2 3.16Å; N634-Q642 VanDerWaalsContact ND2-NE2 3.16Å
635	E	82.5	Confident	85.6	Confident	131 Å²	131	55 Å²	55	61%	0.612	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-22.2	-174.9	-63	176.2	-178.4	0	0	113.8	Y616 I633	Y616-E635 HydrophobicContact CE1-CG 4.18Å; I633-E635 HydrophobicContact CG2-CG 4.4Å
636	K	82.8	Confident	86.2	Confident	200 Å²	200	52.9 Å²	52.9	87%	0.87	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-9.3	-179	-64.1	-177.7	-179.6	178.2	0	113.8	N634	N634-K636 PolarHBondContact O-N 2.84Å; N634-K636 PolarHBondContact OD1-N 2.93Å
637	A	83.1	Confident	86.7	Confident	28 Å²	28	51.4 Å²	51.4	23%	0.231	25%	0.246	C	C	.	.	S	Bend	trans	-90.2	145.2	-178.1	0	0	0	0	0	111	N634 K639	N634-A637 HydrophobicContact CB-CB 4.2Å; N634-A637 PolarHBondContact O-N 2.95Å; A637-K639 WeakPolarHBondContact CB-O 2.94Å; A637-K639 PolarHBondContact O-N 3.28Å
638	D	82.8	Confident	87	Confident	134 Å²	134	50.8 Å²	50.8	72%	0.717	24%	0.244	S	C	*	.	S	Bend	trans	-59.3	-28.1	174	177.2	41.1	0	0	0	112.9	R563 P640	R563-D638 IonicContact NH1-OD1 2.84Å; R563-D638 PolarHBondContact NH2-O 2.98Å; R563-D638 IonicContact NH2-OD1 2.97Å; D638-P640 WeakPolarHBondContact O-CD 3.49Å
639	K	84	Confident	87.3	Confident	51 Å²	51	44.6 Å²	44.6	22%	0.222	22%	0.221	C	C	.	.	S	Bend	trans	-108	98.5	165.2	-174.8	-177	68.9	-177.9	0	108.5	N558 A559 D561 A637 V641	N558-K639 PolarHBondContact OD1-NZ 3.2Å; A559-K639 WeakPolarHBondContact O-CD 3.4Å; A559-K639 WeakPolarHBondContact O-CE 3.46Å; A559-K639 PolarHBondContact O-NZ 3.27Å; D561-K639 HydrophobicContact CB-CD 4.42Å; A637-K639 WeakPolarHBondContact CB-O 2.94Å; A637-K639 PolarHBondContact O-N 3.28Å; K639-V641 WeakPolarHBondContact CG-O 3.17Å; K639-V641 PolarHBondContact O-N 3.16Å
640	P	86.7	Confident	87.9	Confident	12 Å²	12	43.8 Å²	43.8	8%	0.078	22%	0.215	C	C	.	.	S	Bend	trans	-64	-41.8	-174.5	-26.1	35.3	0	0	0	113.5	Y612 Y616 I633 N634 D638 Q642	Y612-P640 HydrophobicContact CD1-CB 4.18Å; Y612-P640 HydrophobicContact CD1-CG 3.95Å; Y612-P640 HydrophobicContact CD2-CG 4.07Å; Y612-P640 HydrophobicContact CE1-CG 4.43Å; Y612-P640 HydrophobicContact CG-CB 4.46Å; Y612-P640 HydrophobicContact CG-CG 3.77Å; Y616-P640 WeakPolarHBondContact OH-CB 3.4Å; I633-P640 CarbonylContact C-O 3.52Å; I633-P640 WeakPolarHBondContact CA-O 2.95Å; I633-P640 HydrophobicContact CG2-CB 4.03Å; N634-P640 PolarHBondContact N-O 3.23Å; N634-P640 WeakPolarHBondContact O-CA 3.31Å; D638-P640 WeakPolarHBondContact O-CD 3.49Å; P640-Q642 PolarHBondContact O-N 2.7Å
641	V	89.6	Confident	88.1	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.006	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	107.4	177	-178.2	0	0	0	0	108.5	A559 F562 Y612 L615 L631 K639 F644	A559-V641 HydrophobicContact CB-CG1 3.96Å; A559-V641 WeakPolarHBondContact CB-O 3.4Å; F562-V641 HydrophobicContact CE2-CG1 4.39Å; Y612-V641 HydrophobicContact CD1-CG2 4.28Å; Y612-V641 HydrophobicContact CE1-CB 4.32Å; Y612-V641 HydrophobicContact CE1-CG2 3.89Å; L615-V641 HydrophobicContact CD2-CG2 3.73Å; L631-V641 HydrophobicContact CD2-CG1 4.12Å; K639-V641 WeakPolarHBondContact CG-O 3.17Å; K639-V641 PolarHBondContact O-N 3.16Å; V641-F644 HydrophobicContact CG1-CD1 4.21Å
642	Q	89.1	Confident	88.1	Confident	66 Å²	66	49.4 Å²	49.4	31%	0.308	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-43.4	178.7	-65.3	-167.1	-19	0	0	111.6	A559 H632 N634 P640	A559-Q642 WeakPolarHBondContact CB-O 3.15Å; A559-Q642 PolarHBondContact N-O 3.09Å; H632-Q642 PolarHBondContact O-N 3.37Å; H632-Q642 VanDerWaalsContact O-N 3.1Å; N634-Q642 HydrophobicContact CB-CG 4.1Å; N634-Q642 PolarHBondContact ND2-NE2 3.16Å; N634-Q642 VanDerWaalsContact ND2-NE2 3.16Å; P640-Q642 PolarHBondContact O-N 2.7Å
643	Q	90	Very high	88	Confident	59 Å²	59	49.9 Å²	49.9	28%	0.276	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	149.7	-176.2	-50.5	-175.6	-22.1	0	0	109.4	F88 I556 L557 H632	F88-Q643 HydrophobicContact CE2-CB 4.04Å; I556-Q643 VanDerWaalsContact O-CA 3.27Å; I556-Q643 WeakPolarHBondContact O-CA 3.25Å; L557-Q643 WeakPolarHBondContact O-CG 3.26Å; H632-Q643 HydrophobicContact CB-CB 3.98Å; H632-Q643 PolarHBondContact N-O 3.22Å
644	F	92.9	Very high	88	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	165.8	170.3	65	-84.5	0	0	0	110.4	I556 A559 F562 F571 L592 W593 H630 L631 V641 F646	I556-F644 HydrophobicContact CB-CD1 4.1Å; I556-F644 HydrophobicContact CB-CE1 3.73Å; I556-F644 HydrophobicContact CB-CE2 4.2Å; I556-F644 HydrophobicContact CB-CG 4.48Å; I556-F644 HydrophobicContact CB-CZ 3.8Å; I556-F644 HydrophobicContact CG1-CD2 4.42Å; I556-F644 HydrophobicContact CG1-CE1 4.11Å; I556-F644 HydrophobicContact CG1-CE2 3.79Å; I556-F644 HydrophobicContact CG1-CZ 3.62Å; I556-F644 HydrophobicContact CG2-CD1 4.36Å; I556-F644 HydrophobicContact CG2-CE1 3.7Å; I556-F644 HydrophobicContact CG2-CZ 3.99Å; I556-F644 PolarHBondContact N-O 3.06Å; I556-F644 PolarHBondContact O-N 3.37Å; I556-F644 VanDerWaalsContact O-N 3.16Å; A559-F644 HydrophobicContact CB-CD1 3.72Å; A559-F644 HydrophobicContact CB-CE1 3.7Å; F562-F644 HydrophobicContact CE2-CE1 4.38Å; F562-F644 AromaticContact CZ-CE1 3.86Å; F562-F644 HydrophobicContact CZ-CE1 3.86Å; F562-F644 HydrophobicContact CZ-CZ 4.09Å; F571-F644 HydrophobicContact CD2-CZ 4.21Å; F571-F644 HydrophobicContact CE1-CE2 4.42Å; F571-F644 HydrophobicContact CE1-CZ 4.2Å; F571-F644 AromaticContact CE2-CE2 3.93Å; F571-F644 HydrophobicContact CE2-CE2 3.93Å; F571-F644 AromaticContact CE2-CZ 3.59Å; F571-F644 HydrophobicContact CE2-CZ 3.59Å; F571-F644 AromaticContact CZ-CE2 3.63Å; F571-F644 HydrophobicContact CZ-CE2 3.63Å; F571-F644 AromaticContact CZ-CZ 3.58Å; F571-F644 HydrophobicContact CZ-CZ 3.58Å; L592-F644 HydrophobicContact CD1-CD2 4.49Å; L592-F644 HydrophobicContact CD1-CE2 4.08Å; W593-F644 AromaticContact NE1-CD2 3.52Å; W593-F644 AromaticContact NE1-CG 3.74Å; H630-F644 CarbonylContact O-C 3.54Å; H630-F644 WeakPolarHBondContact O-CA 3.48Å; H630-F644 VanDerWaalsContact O-CB 3.32Å; H630-F644 WeakPolarHBondContact O-CB 3.45Å; L631-F644 HydrophobicContact CD2-CB 3.62Å; L631-F644 HydrophobicContact CD2-CG 4.44Å; V641-F644 HydrophobicContact CG1-CD1 4.21Å; F644-F646 HydrophobicContact CE2-CD1 4.1Å
645	Y	91.9	Very high	88	Confident	8 Å²	8	51.7 Å²	51.7	3%	0.031	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	155.5	167.1	75	-88.4	0	0	0	111.6	F88 L153 Y553 V554 Y555 S629 H630 T647	F88-Y645 AromaticContact CD1-CD1 3.73Å; F88-Y645 HydrophobicContact CD1-CD1 3.73Å; F88-Y645 AromaticContact CD1-CE1 3.95Å; F88-Y645 HydrophobicContact CD1-CE1 3.95Å; F88-Y645 AromaticContact CE1-CD1 3.24Å; F88-Y645 HydrophobicContact CE1-CD1 3.24Å; F88-Y645 AromaticContact CE1-CE1 3.48Å; F88-Y645 HydrophobicContact CE1-CE1 3.48Å; F88-Y645 VanDerWaalsContact CE1-CE1 3.48Å; F88-Y645 HydrophobicContact CE1-CG 4.5Å; F88-Y645 AromaticContact CZ-CD1 3.72Å; F88-Y645 HydrophobicContact CZ-CD1 3.72Å; F88-Y645 HydrophobicContact CZ-CE1 4.32Å; L153-Y645 WeakPolarHBondContact CD1-OH 3.38Å; Y553-Y645 AromaticContact CD1-CD2 3.95Å; Y553-Y645 HydrophobicContact CD1-CD2 3.95Å; Y553-Y645 HydrophobicContact CD1-CE2 4.02Å; Y553-Y645 HydrophobicContact CE1-CE2 4.2Å; V554-Y645 WeakPolarHBondContact O-CA 3.43Å; V554-Y645 WeakPolarHBondContact O-CB 3.46Å; Y555-Y645 VanDerWaalsContact CD1-CB 3.49Å; Y555-Y645 HydrophobicContact CD1-CD1 4.48Å; Y555-Y645 HydrophobicContact CD1-CG 4.27Å; Y555-Y645 AromaticContact CE1-CD1 3.92Å; Y555-Y645 HydrophobicContact CE1-CD1 3.92Å; Y555-Y645 AromaticContact CE1-CG 3.83Å; Y555-Y645 HydrophobicContact CE1-CG 3.83Å; S629-Y645 WeakPolarHBondContact O-CE1 3.34Å; H630-Y645 VanDerWaalsContact CA-CE1 3.48Å; H630-Y645 HydrophobicContact CB-CE1 4.22Å; H630-Y645 AromaticContact CD2-CZ 3.95Å; H630-Y645 AromaticContact CE1-CE2 3.75Å; H630-Y645 AromaticContact CG-CZ 3.76Å; H630-Y645 AromaticContact ND1-CE2 3.59Å; H630-Y645 AromaticContact ND1-CZ 3.8Å; H630-Y645 PolarHBondContact O-N 3.03Å; Y645-T647 HydrophobicContact CD2-CG2 4.29Å; Y645-T647 HydrophobicContact CE2-CG2 4.2Å
646	F	92.9	Very high	88.3	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	164.6	166.9	63.4	-87.5	0	0	0	108.6	V554 I556 F571 F574 L575 T590 T591 L592 F644	V554-F646 HydrophobicContact CB-CD1 4.19Å; V554-F646 HydrophobicContact CB-CD2 4.19Å; V554-F646 HydrophobicContact CB-CE1 3.73Å; V554-F646 HydrophobicContact CB-CE2 3.73Å; V554-F646 HydrophobicContact CB-CG 4.42Å; V554-F646 HydrophobicContact CB-CZ 3.5Å; V554-F646 VanDerWaalsContact CB-CZ 3.5Å; V554-F646 HydrophobicContact CG1-CD1 4.5Å; V554-F646 HydrophobicContact CG1-CE1 3.64Å; V554-F646 HydrophobicContact CG1-CE2 4.22Å; V554-F646 HydrophobicContact CG1-CZ 3.48Å; V554-F646 VanDerWaalsContact CG1-CZ 3.48Å; V554-F646 HydrophobicContact CG2-CD2 4.49Å; V554-F646 HydrophobicContact CG2-CE2 3.87Å; V554-F646 HydrophobicContact CG2-CZ 4Å; V554-F646 PolarHBondContact N-O 3.48Å; V554-F646 PolarHBondContact O-N 3.26Å; I556-F646 HydrophobicContact CD1-CE1 4.23Å; I556-F646 HydrophobicContact CG1-CE1 4.12Å; F571-F646 HydrophobicContact CE2-CE1 4.07Å; F571-F646 HydrophobicContact CZ-CD1 4.38Å; F571-F646 HydrophobicContact CZ-CE1 4.19Å; F574-F646 HydrophobicContact CE1-CE1 4.28Å; F574-F646 HydrophobicContact CE1-CZ 4Å; L575-F646 HydrophobicContact CD1-CD2 4.11Å; L575-F646 HydrophobicContact CD1-CE2 3.43Å; L575-F646 VanDerWaalsContact CD1-CE2 3.43Å; L575-F646 HydrophobicContact CD1-CZ 3.72Å; T590-F646 HydrophobicContact CG2-CD2 4Å; T591-F646 WeakPolarHBondContact O-CB 3.45Å; L592-F646 HydrophobicContact CB-CB 4.31Å; L592-F646 HydrophobicContact CD1-CB 3.77Å; L592-F646 HydrophobicContact CD1-CD1 4.32Å; L592-F646 HydrophobicContact CD1-CG 4.23Å; F644-F646 HydrophobicContact CE2-CD1 4.1Å
647	T	90.8	Very high	88.6	Confident	17 Å²	17	41.3 Å²	41.3	10%	0.104	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	148	176.1	85.5	0	0	0	0	109.8	V551 A552 Y553 T590 T591 Y645	V551-T647 VanDerWaalsContact CG1-CB 3.41Å; V551-T647 HydrophobicContact CG1-CG2 4.11Å; A552-T647 VanDerWaalsContact O-CA 3.3Å; A552-T647 WeakPolarHBondContact O-CA 3.34Å; Y553-T647 HydrophobicContact CD1-CG2 3.69Å; Y553-T647 HydrophobicContact CE1-CG2 3.73Å; Y553-T647 HydrophobicContact CG-CG2 4.49Å; T590-T647 CarbonylContact C-O 3.54Å; T590-T647 VanDerWaalsContact CA-O 3.29Å; T590-T647 WeakPolarHBondContact CA-O 3.46Å; T591-T647 PolarHBondContact N-O 2.89Å; T591-T647 PolarHBondContact O-N 3.09Å; T591-T647 PolarHBondContact OG1-OG1 3.07Å; Y645-T647 HydrophobicContact CD2-CG2 4.29Å; Y645-T647 HydrophobicContact CE2-CG2 4.2Å
648	T	92.3	Very high	89	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	144.5	-179	-169.9	0	0	0	0	109.9	A552 V554 L578 T590 W665	A552-T648 PolarHBondContact N-O 2.93Å; A552-T648 PolarHBondContact O-N 3.46Å; V554-T648 HydrophobicContact CG2-CG2 4Å; L578-T648 HydrophobicContact CD2-CG2 3.4Å; L578-T648 VanDerWaalsContact CD2-CG2 3.4Å; T590-T648 PolarHBondContact OG1-OG1 3.48Å; T648-W665 HydrophobicContact CG2-CH2 3.52Å; T648-W665 HydrophobicContact CG2-CZ2 4.43Å; T648-W665 HydrophobicContact CG2-CZ3 3.71Å
649	G	91	Very high	89.3	Confident	0 Å²	0	34 Å²	34	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	138.9	-173.7	0	0	0	0	0	112.2	F550 V585 S589	F550-G649 VanDerWaalsContact O-CA 3.3Å; F550-G649 WeakPolarHBondContact O-CA 3.4Å; V585-G649 PolarHBondContact N-O 3.4Å; S589-G649 WeakPolarHBondContact OG-CA 3.37Å; S589-G649 PolarHBondContact OG-N 3Å
650	F	92.1	Very high	89.7	Confident	3 Å²	3	35 Å²	35	1%	0.013	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	154.2	169.6	66.4	-87.3	0	0	0	110.9	G549 F550 A552 H583 V652 M661 W665	G549-F650 CarbonylContact C-O 3.51Å; G549-F650 WeakPolarHBondContact CA-O 3.39Å; F550-F650 HydrophobicContact CB-CE1 4.09Å; F550-F650 HydrophobicContact CB-CE2 4.15Å; F550-F650 HydrophobicContact CB-CZ 3.78Å; F550-F650 HydrophobicContact CD1-CE1 4.26Å; F550-F650 HydrophobicContact CD1-CZ 4.01Å; F550-F650 HydrophobicContact CG-CZ 4.38Å; F550-F650 PolarHBondContact N-O 2.9Å; F550-F650 PolarHBondContact O-N 3.39Å; A552-F650 HydrophobicContact CB-CD1 3.79Å; A552-F650 HydrophobicContact CB-CE1 3.73Å; H583-F650 CarbonylContact O-C 3.53Å; H583-F650 WeakPolarHBondContact O-CA 3.5Å; F650-V652 HydrophobicContact CD2-CG2 4.28Å; F650-M661 HydrophobicContact CB-CE 4.23Å; F650-M661 HydrophobicContact CB-SD 3.39Å; F650-M661 WeakPolarHBondContact CB-SD 3.32Å; F650-M661 HydrophobicContact CD1-CE 4.16Å; F650-M661 HydrophobicContact CD1-SD 4.42Å; F650-M661 HydrophobicContact CD2-CE 3.7Å; F650-M661 HydrophobicContact CD2-SD 3.51Å; F650-M661 VanDerWaalsContact CD2-SD 3.51Å; F650-M661 HydrophobicContact CE1-CE 4.47Å; F650-M661 HydrophobicContact CE2-CE 4.03Å; F650-M661 HydrophobicContact CE2-SD 4.38Å; F650-M661 HydrophobicContact CG-CE 3.77Å; F650-M661 HydrophobicContact CG-SD 3.52Å; F650-M661 VanDerWaalsContact CG-SD 3.52Å; F650-M661 HydrophobicContact CZ-CE 4.4Å; F650-W665 HydrophobicContact CB-CH2 4.13Å; F650-W665 HydrophobicContact CB-CZ2 4.04Å; F650-W665 HydrophobicContact CD1-CH2 4.2Å
651	R	89.3	Confident	89.9	Confident	144 Å²	144	34.5 Å²	34.5	54%	0.543	17%	0.166	S	C	.	.			trans	-130.4	103.9	-177.1	-174.4	-175.6	-178.7	-179.4	5.7	111	P547 H583 V585	P547-R651 PolarHBondContact O-NE 3Å; P547-R651 PolarHBondContact O-NH2 3.44Å; H583-R651 PolarHBondContact O-N 3.33Å; V585-R651 HydrophobicContact CG2-CB 3.99Å
652	V	88.6	Confident	90.1	Very high	9 Å²	9	34.5 Å²	34.5	6%	0.055	17%	0.166	C	C	.	.			trans	-144.9	136	-179.5	-176	0	0	0	0	110.5	Y546 H583 F650 E654 L657 R658 M661	Y546-V652 WeakPolarHBondContact CB-O 3.27Å; H583-V652 HydrophobicContact CB-CG2 3.5Å; F650-V652 HydrophobicContact CD2-CG2 4.28Å; V652-E654 WeakPolarHBondContact CG1-O 3.29Å; V652-L657 HydrophobicContact CG1-CB 3.53Å; V652-R658 HydrophobicContact CB-CB 4.49Å; V652-R658 HydrophobicContact CG1-CB 4.02Å; V652-M661 HydrophobicContact CG2-SD 4.06Å
653	N	84.9	Confident	90.2	Very high	94 Å²	94	34 Å²	34	50%	0.503	17%	0.17	S	C	.	.	S	Bend	trans	-100.4	-30.8	179.8	-56.4	7.8	0	0	0	112.5	P547	P547-N653 WeakPolarHBondContact CA-OD1 3.44Å
654	E	85.2	Confident	90.4	Very high	119 Å²	119	34.2 Å²	34.2	56%	0.556	17%	0.171	S	C	*	.	S	Bend	trans	-106.6	139.3	-173.5	-64	-177.7	179.1	0	0	111.3	V652 V656 L657 R658	V652-E654 WeakPolarHBondContact CG1-O 3.29Å; E654-V656 VanDerWaalsContact C-N 3.3Å; E654-V656 PolarHBondContact O-N 3.44Å; E654-L657 HydrophobicContact CB-CB 4.47Å; E654-L657 HydrophobicContact CB-CD1 4.2Å; E654-L657 HydrophobicContact CB-CG 4.24Å; E654-L657 PolarHBondContact O-N 3.11Å; E654-R658 PolarHBondContact O-N 3.4Å
655	W	86	Confident	90.5	Very high	10 Å²	10	34.2 Å²	34.2	4%	0.038	17%	0.171	C	C	.	.	H	α-helix	trans	-64	-31.9	-178.1	-69.6	106.1	0	0	0	113.8	P524 Y546 R658 A659 Y683 I686	P524-W655 HydrophobicContact CG-CZ2 4.34Å; Y546-W655 HydrophobicContact CE2-CZ2 4.28Å; W655-R658 PolarHBondContact O-N 3.45Å; W655-A659 WeakPolarHBondContact O-CB 3.27Å; W655-A659 PolarHBondContact O-N 3.29Å; W655-Y683 HydrophobicContact CH2-CD1 4.09Å; W655-Y683 HydrophobicContact CH2-CG 4.01Å; W655-Y683 HydrophobicContact CZ3-CG 4.37Å; W655-I686 HydrophobicContact CD2-CG2 4.02Å; W655-I686 HydrophobicContact CE3-CB 4.17Å; W655-I686 HydrophobicContact CE3-CD1 4.45Å; W655-I686 HydrophobicContact CE3-CG2 3.61Å; W655-I686 HydrophobicContact CH2-CD1 3.78Å; W655-I686 HydrophobicContact CZ2-CD1 4.29Å; W655-I686 HydrophobicContact CZ3-CB 4.11Å; W655-I686 HydrophobicContact CZ3-CD1 3.88Å; W655-I686 HydrophobicContact CZ3-CG2 4Å
656	V	88	Confident	90.6	Very high	51 Å²	51	35.8 Å²	35.8	31%	0.309	18%	0.177	S	C	.	.	H	α-helix	trans	-65.3	-47.1	176.1	-179.5	0	0	0	0	110.9	I520 E654 R658 A659 D660 V690	I520-V656 HydrophobicContact CB-CG2 4.28Å; I520-V656 HydrophobicContact CG2-CG2 4.48Å; I520-V656 WeakPolarHBondContact O-CG2 3.44Å; E654-V656 VanDerWaalsContact C-N 3.3Å; E654-V656 PolarHBondContact O-N 3.44Å; V656-R658 PolarHBondContact O-N 3.35Å; V656-A659 WeakPolarHBondContact O-CB 3.1Å; V656-A659 PolarHBondContact O-N 2.83Å; V656-A659 VanDerWaalsContact O-N 3.15Å; V656-D660 PolarHBondContact O-N 3.06Å; V656-V690 HydrophobicContact CG2-CG1 4.26Å
657	L	89.8	Confident	90.7	Very high	61 Å²	61	39.3 Å²	39.3	32%	0.319	20%	0.202	S	C	.	.	H	α-helix	trans	-63.9	-32.8	175.6	-63.6	178.1	0	0	0	111.7	V652 E654 A659 D660 M661	V652-L657 HydrophobicContact CG1-CB 3.53Å; E654-L657 HydrophobicContact CB-CB 4.47Å; E654-L657 HydrophobicContact CB-CD1 4.2Å; E654-L657 HydrophobicContact CB-CG 4.24Å; E654-L657 PolarHBondContact O-N 3.11Å; L657-A659 VanDerWaalsContact C-N 3.34Å; L657-D660 PolarHBondContact O-N 3.3Å; L657-M661 WeakPolarHBondContact O-CB 3.34Å; L657-M661 PolarHBondContact O-N 3.35Å
658	R	90.5	Very high	90.8	Very high	8 Å²	8	39.4 Å²	39.4	3%	0.03	20%	0.201	C	C	.	.	H	α-helix	trans	-68.3	-39.2	176.2	-167.5	-178.2	-171.1	147.9	4.1	110.4	V652 E654 W655 V656 M661 V662 D681	V652-R658 HydrophobicContact CB-CB 4.49Å; V652-R658 HydrophobicContact CG1-CB 4.02Å; E654-R658 PolarHBondContact O-N 3.4Å; W655-R658 PolarHBondContact O-N 3.45Å; V656-R658 PolarHBondContact O-N 3.35Å; R658-M661 HydrophobicContact CG-CE 4.47Å; R658-M661 PolarHBondContact O-N 3.23Å; R658-V662 WeakPolarHBondContact O-CG2 3.22Å; R658-V662 PolarHBondContact O-N 3.49Å; R658-D681 IonicContact CZ-OD2 3.8Å; R658-D681 IonicContact NE-OD2 2.8Å; R658-D681 PolarHBondContact NE-OD2 2.66Å; R658-D681 IonicContact NH2-OD1 3.35Å; R658-D681 PolarHBondContact NH2-OD1 3.1Å; R658-D681 VanDerWaalsContact NH2-OD1 3.14Å; R658-D681 IonicContact NH2-OD2 3.1Å; R658-D681 PolarHBondContact NH2-OD2 3.11Å
659	A	90.3	Very high	90.9	Very high	1 Å²	1	40 Å²	40	1%	0.008	21%	0.205	C	C	.	.	H	α-helix	trans	-63.4	-42.4	174.5	0	0	0	0	0	112.1	W655 V656 L657 V662 S663 A687 V690 L691	W655-A659 WeakPolarHBondContact O-CB 3.27Å; W655-A659 PolarHBondContact O-N 3.29Å; V656-A659 WeakPolarHBondContact O-CB 3.1Å; V656-A659 PolarHBondContact O-N 2.83Å; V656-A659 VanDerWaalsContact O-N 3.15Å; L657-A659 VanDerWaalsContact C-N 3.34Å; A659-V662 PolarHBondContact O-N 3.48Å; A659-S663 WeakPolarHBondContact O-CB 3.26Å; A659-S663 PolarHBondContact O-N 3.47Å; A659-A687 HydrophobicContact CB-CB 4.08Å; A659-V690 HydrophobicContact CB-CB 3.98Å; A659-V690 HydrophobicContact CB-CG1 3.84Å; A659-L691 HydrophobicContact CB-CD2 4.13Å; A659-L691 HydrophobicContact CB-CG 4.09Å
660	D	91	Very high	91	Very high	71 Å²	71	43.4 Å²	43.4	38%	0.38	23%	0.234	S	C	.	.	H	α-helix	trans	-63	-41.2	174.6	-70.3	-22.4	0	0	0	111.8	V656 L657 S663 Q664	V656-D660 PolarHBondContact O-N 3.06Å; L657-D660 PolarHBondContact O-N 3.3Å; D660-S663 WeakPolarHBondContact O-CB 3.47Å; D660-S663 PolarHBondContact O-N 3.17Å; D660-Q664 WeakPolarHBondContact O-CG 3.37Å; D660-Q664 PolarHBondContact O-N 3.5Å
661	M	92.7	Very high	91.1	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-62.1	-49.1	175.1	-178.1	-158.5	79.6	0	0	112	H583 F650 V652 L657 R658 S663 Q664 W665	H583-M661 HydrophobicContact CB-CG 4.34Å; H583-M661 HydrophobicContact CB-SD 4.37Å; F650-M661 HydrophobicContact CB-CE 4.23Å; F650-M661 HydrophobicContact CB-SD 3.39Å; F650-M661 WeakPolarHBondContact CB-SD 3.32Å; F650-M661 HydrophobicContact CD1-CE 4.16Å; F650-M661 HydrophobicContact CD1-SD 4.42Å; F650-M661 HydrophobicContact CD2-CE 3.7Å; F650-M661 HydrophobicContact CD2-SD 3.51Å; F650-M661 VanDerWaalsContact CD2-SD 3.51Å; F650-M661 HydrophobicContact CE1-CE 4.47Å; F650-M661 HydrophobicContact CE2-CE 4.03Å; F650-M661 HydrophobicContact CE2-SD 4.38Å; F650-M661 HydrophobicContact CG-CE 3.77Å; F650-M661 HydrophobicContact CG-SD 3.52Å; F650-M661 VanDerWaalsContact CG-SD 3.52Å; F650-M661 HydrophobicContact CZ-CE 4.4Å; V652-M661 HydrophobicContact CG2-SD 4.06Å; L657-M661 WeakPolarHBondContact O-CB 3.34Å; L657-M661 PolarHBondContact O-N 3.35Å; R658-M661 HydrophobicContact CG-CE 4.47Å; R658-M661 PolarHBondContact O-N 3.23Å; M661-S663 VanDerWaalsContact C-N 3.27Å; M661-S663 PolarHBondContact O-N 3.17Å; M661-Q664 PolarHBondContact O-N 2.95Å; M661-W665 HydrophobicContact CG-CZ2 4.46Å; M661-W665 PolarHBondContact O-N 3.02Å; M661-W665 HydrophobicContact SD-CZ2 4.2Å
662	V	92.6	Very high	91.4	Very high	1 Å²	1	43 Å²	43	1%	0.006	24%	0.235	C	C	.	.	H	α-helix	trans	-60	-40.9	177.3	171.4	0	0	0	0	110.5	R658 A659 W665 R666 N684 A687	R658-V662 WeakPolarHBondContact O-CG2 3.22Å; R658-V662 PolarHBondContact O-N 3.49Å; A659-V662 PolarHBondContact O-N 3.48Å; V662-W665 PolarHBondContact O-N 3.07Å; V662-R666 WeakPolarHBondContact O-CB 3.38Å; V662-R666 WeakPolarHBondContact O-CG 3.37Å; V662-R666 PolarHBondContact O-N 3.12Å; V662-N684 VanDerWaalsContact CG2-OD1 3.31Å; V662-N684 WeakPolarHBondContact CG2-OD1 3.26Å; V662-A687 HydrophobicContact CB-CB 4.11Å; V662-A687 HydrophobicContact CG1-CB 4.35Å; V662-A687 HydrophobicContact CG2-CB 4Å
663	S	92.3	Very high	91.5	Very high	56 Å²	56	49.7 Å²	49.7	39%	0.392	27%	0.266	S	S	.	.	H	α-helix	trans	-60.9	-45.4	175.2	-168.8	0	0	0	0	112	A659 D660 M661 R666 S667	A659-S663 WeakPolarHBondContact O-CB 3.26Å; A659-S663 PolarHBondContact O-N 3.47Å; D660-S663 WeakPolarHBondContact O-CB 3.47Å; D660-S663 PolarHBondContact O-N 3.17Å; M661-S663 VanDerWaalsContact C-N 3.27Å; M661-S663 PolarHBondContact O-N 3.17Å; S663-R666 PolarHBondContact O-N 3.16Å; S663-S667 PolarHBondContact O-N 3.25Å
664	Q	94.1	Very high	91.9	Very high	64 Å²	64	48.7 Å²	48.7	30%	0.299	26%	0.259	S	S	.	.	H	α-helix	trans	-62.5	-47.3	176	-74.1	175.8	37	0	0	112	T582 D660 M661 R666 S667 I668	T582-Q664 PolarHBondContact OG1-NE2 3.05Å; T582-Q664 PolarHBondContact OG1-OE1 3.25Å; D660-Q664 WeakPolarHBondContact O-CG 3.37Å; D660-Q664 PolarHBondContact O-N 3.5Å; M661-Q664 PolarHBondContact O-N 2.95Å; Q664-R666 VanDerWaalsContact C-N 3.3Å; Q664-R666 PolarHBondContact O-N 2.85Å; Q664-S667 WeakPolarHBondContact O-CA 3.31Å; Q664-S667 WeakPolarHBondContact O-CB 3.17Å; Q664-S667 PolarHBondContact O-N 3.47Å; Q664-S667 PolarHBondContact O-OG 2.92Å; Q664-I668 WeakPolarHBondContact O-CG1 3.5Å; Q664-I668 PolarHBondContact O-N 3.41Å
665	W	94.6	Very high	92.2	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64.6	-35.1	-179.5	-75	22.1	0	0	0	112.5	A552 L578 S581 A584 T648 F650 M661 V662 I668 S669 V679	A552-W665 HydrophobicContact CB-CH2 3.87Å; A552-W665 HydrophobicContact CB-CZ3 3.46Å; A552-W665 VanDerWaalsContact CB-CZ3 3.46Å; L578-W665 HydrophobicContact CD1-CD2 4.35Å; L578-W665 HydrophobicContact CD1-CE3 4.16Å; L578-W665 HydrophobicContact CD2-CD2 4.39Å; L578-W665 HydrophobicContact CD2-CE3 4.33Å; L578-W665 HydrophobicContact CD2-CH2 4.12Å; L578-W665 HydrophobicContact CD2-CZ2 4.07Å; L578-W665 HydrophobicContact CD2-CZ3 4.21Å; L578-W665 HydrophobicContact CG-CD2 4.18Å; L578-W665 HydrophobicContact CG-CE3 4.34Å; S581-W665 PolarHBondContact OG-NE1 2.77Å; A584-W665 HydrophobicContact CB-CZ2 4.49Å; T648-W665 HydrophobicContact CG2-CH2 3.52Å; T648-W665 HydrophobicContact CG2-CZ2 4.43Å; T648-W665 HydrophobicContact CG2-CZ3 3.71Å; F650-W665 HydrophobicContact CB-CH2 4.13Å; F650-W665 HydrophobicContact CB-CZ2 4.04Å; F650-W665 HydrophobicContact CD1-CH2 4.2Å; M661-W665 HydrophobicContact CG-CZ2 4.46Å; M661-W665 PolarHBondContact O-N 3.02Å; M661-W665 HydrophobicContact SD-CZ2 4.2Å; V662-W665 PolarHBondContact O-N 3.07Å; W665-I668 PolarHBondContact O-N 3.29Å; W665-S669 VanDerWaalsContact O-CB 3.31Å; W665-S669 WeakPolarHBondContact O-CB 3.46Å; W665-S669 PolarHBondContact O-N 2.57Å; W665-S669 PolarHBondContact O-OG 3.42Å; W665-V679 HydrophobicContact CB-CG2 4.18Å; W665-V679 HydrophobicContact CD2-CG1 4.47Å; W665-V679 HydrophobicContact CE3-CB 4.37Å; W665-V679 HydrophobicContact CE3-CG1 3.43Å; W665-V679 VanDerWaalsContact CE3-CG1 3.43Å; W665-V679 HydrophobicContact CE3-CG2 4.02Å; W665-V679 HydrophobicContact CZ3-CG1 3.99Å
666	R	93.5	Very high	92.5	Very high	41 Å²	41	48.3 Å²	48.3	16%	0.155	26%	0.258	C	S	.	.	H	α-helix	trans	-67.6	-36.4	170.9	-73.7	176.3	177.5	158.6	1.2	112.4	E81 V662 S663 Q664 S669 A670 D688	E81-R666 IonicContact OE1-CZ 3.8Å; E81-R666 IonicContact OE1-NE 3.24Å; E81-R666 PolarHBondContact OE1-NE 3.38Å; E81-R666 IonicContact OE1-NH2 2.73Å; E81-R666 PolarHBondContact OE1-NH2 3.42Å; E81-R666 VanDerWaalsContact OE1-NH2 3.08Å; E81-R666 IonicContact OE2-CZ 2.72Å; E81-R666 IonicContact OE2-NH2 2.9Å; E81-R666 PolarHBondContact OE2-NH2 3.09Å; V662-R666 WeakPolarHBondContact O-CB 3.38Å; V662-R666 WeakPolarHBondContact O-CG 3.37Å; V662-R666 PolarHBondContact O-N 3.12Å; S663-R666 PolarHBondContact O-N 3.16Å; Q664-R666 VanDerWaalsContact C-N 3.3Å; Q664-R666 PolarHBondContact O-N 2.85Å; R666-S669 WeakPolarHBondContact O-CB 3.38Å; R666-S669 PolarHBondContact O-N 2.96Å; R666-A670 WeakPolarHBondContact O-CB 3.28Å; R666-A670 PolarHBondContact O-N 3.02Å; R666-D688 IonicContact CZ-OD1 3.68Å; R666-D688 IonicContact NH1-OD1 2.88Å; R666-D688 PolarHBondContact NH1-OD1 3.15Å; R666-D688 IonicContact NH1-OD2 3.05Å; R666-D688 IonicContact NH2-OD1 3.64Å; R666-D688 PolarHBondContact NH2-OD1 3.1Å; R666-D688 IonicContact NH2-OD2 3.72Å; R666-D688 PolarHBondContact NH2-OD2 3.15Å
667	S	94.3	Very high	92.8	Very high	74 Å²	74	46.6 Å²	46.6	52%	0.517	25%	0.248	S	C	.	.	H	α-helix	trans	-64.8	-38.8	174.1	80.8	0	0	0	0	112.5	S663 Q664 A670 K671	S663-S667 PolarHBondContact O-N 3.25Å; Q664-S667 WeakPolarHBondContact O-CA 3.31Å; Q664-S667 WeakPolarHBondContact O-CB 3.17Å; Q664-S667 PolarHBondContact O-N 3.47Å; Q664-S667 PolarHBondContact O-OG 2.92Å; S667-A670 PolarHBondContact O-N 3.49Å; S667-K671 PolarHBondContact O-N 3.08Å
668	I	94.6	Very high	92.9	Very high	19 Å²	19	45.1 Å²	45.1	10%	0.097	24%	0.241	C	C	.	.	H	α-helix	trans	-66.6	-45.1	173.2	-64.7	165.7	0	0	0	109.4	F574 E577 Q664 W665 A670 K671 Y672	F574-I668 HydrophobicContact CD2-CG2 3.94Å; F574-I668 HydrophobicContact CE2-CG2 3.98Å; E577-I668 HydrophobicContact CB-CG2 4.03Å; Q664-I668 WeakPolarHBondContact O-CG1 3.5Å; Q664-I668 PolarHBondContact O-N 3.41Å; W665-I668 PolarHBondContact O-N 3.29Å; I668-A670 VanDerWaalsContact C-N 3.28Å; I668-A670 PolarHBondContact O-N 2.93Å; I668-K671 WeakPolarHBondContact O-CB 3.28Å; I668-K671 PolarHBondContact O-N 2.89Å; I668-K671 VanDerWaalsContact O-N 3.08Å; I668-Y672 WeakPolarHBondContact O-CD2 3.45Å
669	S	93.1	Very high	93	Very high	11 Å²	11	45 Å²	45	8%	0.077	24%	0.241	C	C	.	.	H	α-helix	trans	-57.2	-40.5	176.8	-63.6	0	0	0	0	112.2	W665 R666 K671 Y672 P677	W665-S669 VanDerWaalsContact O-CB 3.31Å; W665-S669 WeakPolarHBondContact O-CB 3.46Å; W665-S669 PolarHBondContact O-N 2.57Å; W665-S669 PolarHBondContact O-OG 3.42Å; R666-S669 WeakPolarHBondContact O-CB 3.38Å; R666-S669 PolarHBondContact O-N 2.96Å; S669-K671 VanDerWaalsContact C-N 3.3Å; S669-K671 PolarHBondContact O-N 3.36Å; S669-Y672 CarbonylContact O-C 3.54Å; S669-Y672 PolarHBondContact O-N 2.89Å; S669-P677 WeakPolarHBondContact O-CG 3.33Å
670	A	93.2	Very high	93.1	Very high	73 Å²	73	45.2 Å²	45.2	60%	0.603	24%	0.242	S	C	*	.	H	α-helix	trans	-66.7	-26.6	177.6	0	0	0	0	0	113.8	R666 S667 I668 Y672	R666-A670 WeakPolarHBondContact O-CB 3.28Å; R666-A670 PolarHBondContact O-N 3.02Å; S667-A670 PolarHBondContact O-N 3.49Å; I668-A670 VanDerWaalsContact C-N 3.28Å; I668-A670 PolarHBondContact O-N 2.93Å; A670-Y672 VanDerWaalsContact C-N 3.27Å; A670-Y672 PolarHBondContact O-N 3.37Å
671	K	94.8	Very high	93	Very high	122 Å²	122	42.2 Å²	42.2	53%	0.53	23%	0.225	S	C	.	.	H	α-helix	trans	-70.1	-25.2	175.7	-177.8	-179.2	169.6	-168.7	0	112.6	E577 S667 I668 S669	E577-K671 IonicContact OE1-NZ 2.87Å; E577-K671 PolarHBondContact OE1-NZ 3.07Å; E577-K671 IonicContact OE2-NZ 3.5Å; E577-K671 PolarHBondContact OE2-NZ 2.83Å; S667-K671 PolarHBondContact O-N 3.08Å; I668-K671 WeakPolarHBondContact O-CB 3.28Å; I668-K671 PolarHBondContact O-N 2.89Å; I668-K671 VanDerWaalsContact O-N 3.08Å; S669-K671 VanDerWaalsContact C-N 3.3Å; S669-K671 PolarHBondContact O-N 3.36Å
672	Y	94.8	Very high	92.6	Very high	15 Å²	15	43.1 Å²	43.1	6%	0.059	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.5	48.7	-177.1	-65.7	-88.9	0	0	0	111.1	R570 F574 E577 I668 S669 A670 E674 L675 P677	R570-Y672 HydrophobicContact CG-CD1 4.19Å; R570-Y672 HydrophobicContact CG-CE1 4.03Å; F574-Y672 HydrophobicContact CB-CD1 3.88Å; F574-Y672 HydrophobicContact CB-CD2 3.88Å; F574-Y672 HydrophobicContact CB-CE1 3.92Å; F574-Y672 HydrophobicContact CB-CE2 3.94Å; F574-Y672 HydrophobicContact CB-CG 3.85Å; F574-Y672 AromaticContact CD2-CD2 3.53Å; F574-Y672 HydrophobicContact CD2-CD2 3.53Å; F574-Y672 HydrophobicContact CD2-CE2 4.11Å; F574-Y672 AromaticContact CD2-CG 3.9Å; F574-Y672 HydrophobicContact CD2-CG 3.9Å; F574-Y672 HydrophobicContact CG-CD2 4.16Å; F574-Y672 HydrophobicContact CG-CG 4.23Å; E577-Y672 PolarHBondContact OE1-OH 3.23Å; I668-Y672 WeakPolarHBondContact O-CD2 3.45Å; S669-Y672 CarbonylContact O-C 3.54Å; S669-Y672 PolarHBondContact O-N 2.89Å; A670-Y672 VanDerWaalsContact C-N 3.27Å; A670-Y672 PolarHBondContact O-N 3.37Å; Y672-E674 PolarHBondContact O-N 3.43Å; Y672-E674 VanDerWaalsContact O-N 3.12Å; Y672-L675 PolarHBondContact O-N 3.5Å; Y672-P677 VanDerWaalsContact O-CD 3.25Å; Y672-P677 WeakPolarHBondContact O-CD 3.26Å
673	E	91.5	Very high	92.2	Very high	151 Å²	151	43.5 Å²	43.5	71%	0.706	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-55.4	-30.7	-176.5	-171	177.7	-178.1	0	0	112.8	L675 Q676	E673-L675 PolarHBondContact O-N 2.83Å; E673-Q676 WeakPolarHBondContact O-CG 3.3Å; E673-Q676 PolarHBondContact O-N 3.44Å
674	E	92.2	Very high	92.1	Very high	73 Å²	73	41 Å²	41	34%	0.341	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-58.5	-30	177.4	62.1	-82.2	-175.6	0	0	114.4	N558 R570 Y672 Q676	N558-E674 PolarHBondContact ND2-O 3.42Å; R570-E674 IonicContact CZ-OE1 3.73Å; R570-E674 IonicContact NE-OE1 2.98Å; R570-E674 PolarHBondContact NE-OE1 3.23Å; R570-E674 VanDerWaalsContact NH2-CD 3.3Å; R570-E674 IonicContact NH2-OE1 2.85Å; R570-E674 PolarHBondContact NH2-OE1 3.17Å; R570-E674 IonicContact NH2-OE2 3.86Å; R570-E674 PolarHBondContact NH2-OE2 2.87Å; Y672-E674 PolarHBondContact O-N 3.43Å; Y672-E674 VanDerWaalsContact O-N 3.12Å; E674-Q676 VanDerWaalsContact C-N 3.35Å
675	L	91.9	Very high	91.7	Very high	10 Å²	10	38.9 Å²	38.9	5%	0.052	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-84.1	-16	178.3	-64.3	175.7	0	0	0	112.1	I556 L557 N558 P560 F571 F574 Y672 E673	I556-L675 HydrophobicContact CG2-CB 4.28Å; L557-L675 PolarHBondContact N-O 3.25Å; N558-L675 PolarHBondContact N-O 3.19Å; P560-L675 HydrophobicContact CB-CD2 4.34Å; P560-L675 HydrophobicContact CG-CD2 4.4Å; F571-L675 HydrophobicContact CB-CD1 4.43Å; F571-L675 HydrophobicContact CD2-CD1 4.05Å; F574-L675 HydrophobicContact CB-CD1 4.18Å; F574-L675 HydrophobicContact CD1-CD1 4.23Å; F574-L675 HydrophobicContact CG-CD1 4.22Å; Y672-L675 PolarHBondContact O-N 3.5Å; E673-L675 PolarHBondContact O-N 2.83Å
676	Q	92.3	Very high	91.4	Very high	111 Å²	111	39.1 Å²	39.1	52%	0.519	20%	0.204	S	C	.	.			trans	44.8	57.7	-168	-63.4	-175.6	-40	0	0	112.2	L557 E673 E674	L557-Q676 HydrophobicContact CB-CB 3.91Å; L557-Q676 HydrophobicContact CD1-CB 4.47Å; L557-Q676 PolarHBondContact N-O 2.93Å; E673-Q676 WeakPolarHBondContact O-CG 3.3Å; E673-Q676 PolarHBondContact O-N 3.44Å; E674-Q676 VanDerWaalsContact C-N 3.35Å
677	P	94.1	Very high	91.1	Very high	15 Å²	15	37.2 Å²	37.2	10%	0.097	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	136.1	-178	29.1	-30.5	0	0	0	110.9	Y555 I556 F574 S669 Y672	Y555-P677 CarbonylContact O-C 3.59Å; Y555-P677 WeakPolarHBondContact O-CA 3.26Å; I556-P677 HydrophobicContact CD1-CB 3.79Å; F574-P677 HydrophobicContact CE1-CB 4.18Å; F574-P677 HydrophobicContact CE2-CB 4.02Å; F574-P677 HydrophobicContact CE2-CG 4.05Å; F574-P677 HydrophobicContact CZ-CB 3.57Å; F574-P677 HydrophobicContact CZ-CG 4.13Å; S669-P677 WeakPolarHBondContact O-CG 3.33Å; Y672-P677 VanDerWaalsContact O-CD 3.25Å; Y672-P677 WeakPolarHBondContact O-CD 3.26Å
678	V	93.1	Very high	90.9	Very high	30 Å²	30	34.3 Å²	34.3	18%	0.182	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	117.9	179.3	-176.6	0	0	0	0	109.3	E81 L84 V554 Y555 L557	E81-V678 HydrophobicContact CB-CG1 4.13Å; E81-V678 HydrophobicContact CG-CG1 3.58Å; L84-V678 HydrophobicContact CD2-CB 3.63Å; L84-V678 HydrophobicContact CD2-CG1 3.66Å; L84-V678 HydrophobicContact CD2-CG2 3.71Å; V554-V678 WeakPolarHBondContact CA-O 3.39Å; Y555-V678 PolarHBondContact N-O 3.49Å; Y555-V678 PolarHBondContact O-N 3.18Å; L557-V678 HydrophobicContact CD1-CG2 3.89Å; L557-V678 HydrophobicContact CG-CG2 4.42Å
679	V	92.9	Very high	90.6	Very high	5 Å²	5	33.4 Å²	33.4	3%	0.03	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	124.2	178	173.2	0	0	0	0	108.8	E81 V554 W665 N684	E81-V679 WeakPolarHBondContact CG-O 3.4Å; V554-V679 HydrophobicContact CG1-CG2 4.41Å; V554-V679 HydrophobicContact CG2-CG2 4.31Å; W665-V679 HydrophobicContact CB-CG2 4.18Å; W665-V679 HydrophobicContact CD2-CG1 4.47Å; W665-V679 HydrophobicContact CE3-CB 4.37Å; W665-V679 HydrophobicContact CE3-CG1 3.43Å; W665-V679 VanDerWaalsContact CE3-CG1 3.43Å; W665-V679 HydrophobicContact CE3-CG2 4.02Å; W665-V679 HydrophobicContact CZ3-CG1 3.99Å; V679-N684 PolarHBondContact O-ND2 3.43Å
680	Y	91.9	Very high	90.3	Very high	6 Å²	6	33.4 Å²	33.4	2%	0.024	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	131.7	179.8	177.7	-101.4	0	0	0	111.6	E81 H82 H85 Y553 Y555 E682	E81-Y680 HydrophobicContact CB-CD2 4.08Å; H82-Y680 VanDerWaalsContact CA-CE2 3.48Å; H82-Y680 HydrophobicContact CB-CE2 3.86Å; H82-Y680 AromaticContact ND1-CE2 3.79Å; H82-Y680 AromaticContact ND1-CZ 3.77Å; H82-Y680 PolarHBondContact ND1-OH 3.07Å; H85-Y680 HydrophobicContact CB-CD1 3.73Å; H85-Y680 HydrophobicContact CB-CD2 3.83Å; H85-Y680 HydrophobicContact CB-CE1 3.79Å; H85-Y680 HydrophobicContact CB-CE2 3.88Å; H85-Y680 HydrophobicContact CB-CG 3.74Å; H85-Y680 AromaticContact CD2-CE1 3.31Å; H85-Y680 WeakPolarHBondContact CD2-CE1 3.07Å; H85-Y680 AromaticContact CD2-CZ 3.47Å; H85-Y680 VanDerWaalsContact CD2-CZ 3.47Å; H85-Y680 AromaticContact CE1-CE1 3.66Å; H85-Y680 AromaticContact CG-CD1 3.44Å; H85-Y680 VanDerWaalsContact CG-CD1 3.44Å; H85-Y680 AromaticContact CG-CE1 3.2Å; H85-Y680 AromaticContact CG-CG 4Å; H85-Y680 AromaticContact CG-CZ 3.58Å; H85-Y680 AromaticContact ND1-CD1 3.42Å; H85-Y680 WeakPolarHBondContact ND1-CD1 3.46Å; H85-Y680 AromaticContact ND1-CE1 3.43Å; H85-Y680 WeakPolarHBondContact ND1-CE1 3.44Å; H85-Y680 AromaticContact NE2-CE1 3.62Å; Y553-Y680 HydrophobicContact CD2-CD1 4.17Å; Y553-Y680 PolarHBondContact N-O 3.03Å; Y553-Y680 PolarHBondContact O-N 3.49Å; Y555-Y680 HydrophobicContact CE2-CG 4.43Å; Y680-E682 PolarHBondContact OH-OE2 3.25Å
681	D	89.6	Confident	90	Very high	7 Å²	7	33 Å²	33	4%	0.037	16%	0.159	C	C	.	.			trans	-142.2	146.4	163.6	162.1	64.4	0	0	0	108	R658 Y683 N684	R658-D681 IonicContact CZ-OD2 3.8Å; R658-D681 IonicContact NE-OD2 2.8Å; R658-D681 PolarHBondContact NE-OD2 2.66Å; R658-D681 IonicContact NH2-OD1 3.35Å; R658-D681 PolarHBondContact NH2-OD1 3.1Å; R658-D681 VanDerWaalsContact NH2-OD1 3.14Å; R658-D681 IonicContact NH2-OD2 3.1Å; R658-D681 PolarHBondContact NH2-OD2 3.11Å; D681-Y683 PolarHBondContact O-N 2.99Å; D681-Y683 PolarHBondContact OD2-N 2.89Å; D681-N684 PolarHBondContact N-ND2 3.35Å; D681-N684 WeakPolarHBondContact O-CB 3.35Å; D681-N684 PolarHBondContact O-N 2.81Å; D681-N684 VanDerWaalsContact O-N 3.08Å
682	E	82.5	Confident	89.5	Confident	21 Å²	21	28.2 Å²	28.2	10%	0.098	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-26.9	-173.8	-172.5	61.7	-154.3	0	0	112.3	R68 S256 Y680 F685	R68-E682 IonicContact CZ-OE1 3.78Å; R68-E682 PolarHBondContact NH2-O 3.19Å; R68-E682 IonicContact NH2-OE1 2.9Å; R68-E682 PolarHBondContact NH2-OE1 2.9Å; R68-E682 IonicContact NH2-OE2 3.85Å; S256-E682 PolarHBondContact OG-OE1 3.3Å; Y680-E682 PolarHBondContact OH-OE2 3.25Å; E682-F685 WeakPolarHBondContact O-CD1 3.4Å; E682-F685 WeakPolarHBondContact O-CE1 3.36Å
683	Y	84.9	Confident	89	Confident	9 Å²	9	27.6 Å²	27.6	4%	0.035	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	9.7	-175.6	-52.4	-81.7	0	0	0	114.5	F254 W655 D681 F685 I686	F254-Y683 HydrophobicContact CE1-CE1 4.2Å; F254-Y683 VanDerWaalsContact CE1-OH 3.3Å; F254-Y683 WeakPolarHBondContact CE1-OH 3.46Å; F254-Y683 AromaticContact CZ-CE1 3.85Å; F254-Y683 HydrophobicContact CZ-CE1 3.85Å; W655-Y683 HydrophobicContact CH2-CD1 4.09Å; W655-Y683 HydrophobicContact CH2-CG 4.01Å; W655-Y683 HydrophobicContact CZ3-CG 4.37Å; D681-Y683 PolarHBondContact O-N 2.99Å; D681-Y683 PolarHBondContact OD2-N 2.89Å; Y683-F685 PolarHBondContact O-N 3Å; Y683-F685 VanDerWaalsContact O-N 3.08Å; Y683-I686 HydrophobicContact CD1-CD1 4.08Å; Y683-I686 WeakPolarHBondContact O-CB 3.29Å; Y683-I686 PolarHBondContact O-N 3.25Å
684	N	89.5	Confident	88.4	Confident	4 Å²	4	27.4 Å²	27.4	2%	0.021	14%	0.135	C	C	.	.	H	α-helix	trans	-57.2	-25.7	177.3	-85.2	-1.2	0	0	0	113.3	E81 V662 V679 D681 I686 A687 D688	E81-N684 PolarHBondContact OE2-ND2 3.07Å; V662-N684 VanDerWaalsContact CG2-OD1 3.31Å; V662-N684 WeakPolarHBondContact CG2-OD1 3.26Å; V679-N684 PolarHBondContact O-ND2 3.43Å; D681-N684 PolarHBondContact N-ND2 3.35Å; D681-N684 WeakPolarHBondContact O-CB 3.35Å; D681-N684 PolarHBondContact O-N 2.81Å; D681-N684 VanDerWaalsContact O-N 3.08Å; N684-I686 VanDerWaalsContact C-N 3.27Å; N684-I686 PolarHBondContact O-N 3.01Å; N684-A687 WeakPolarHBondContact O-CB 3.29Å; N684-A687 PolarHBondContact O-N 2.85Å; N684-D688 PolarHBondContact O-N 2.97Å
685	F	86.8	Confident	88.1	Confident	19 Å²	19	27.8 Å²	27.8	8%	0.083	14%	0.142	C	C	.	.	H	α-helix	trans	-64.2	-32.2	176.2	78.2	-90.2	0	0	0	112.8	M67 R68 T72 E682 Y683 D688 Q689	M67-F685 HydrophobicContact CB-CE2 4.31Å; M67-F685 HydrophobicContact CE-CZ 4.44Å; R68-F685 HydrophobicContact CG-CB 4.38Å; R68-F685 HydrophobicContact CG-CG 4.48Å; T72-F685 HydrophobicContact CG2-CB 4.11Å; T72-F685 WeakPolarHBondContact OG1-CB 3.25Å; E682-F685 WeakPolarHBondContact O-CD1 3.4Å; E682-F685 WeakPolarHBondContact O-CE1 3.36Å; Y683-F685 PolarHBondContact O-N 3Å; Y683-F685 VanDerWaalsContact O-N 3.08Å; F685-D688 PolarHBondContact O-N 3.24Å; F685-Q689 PolarHBondContact O-N 3.35Å; F685-Q689 VanDerWaalsContact O-N 3.13Å
686	I	87.5	Confident	87.7	Confident	5 Å²	5	28.3 Å²	28.3	3%	0.026	15%	0.146	C	C	.	.	H	α-helix	trans	-69.2	-41.2	174.2	-58.6	-178.5	0	0	0	109.7	L522 P524 W655 Y683 N684 Q689 V690	L522-I686 HydrophobicContact CB-CG2 4.09Å; L522-I686 HydrophobicContact CD2-CG2 3.71Å; L522-I686 HydrophobicContact CG-CG2 3.89Å; P524-I686 HydrophobicContact CG-CD1 3.82Å; W655-I686 HydrophobicContact CD2-CG2 4.02Å; W655-I686 HydrophobicContact CE3-CB 4.17Å; W655-I686 HydrophobicContact CE3-CD1 4.45Å; W655-I686 HydrophobicContact CE3-CG2 3.61Å; W655-I686 HydrophobicContact CH2-CD1 3.78Å; W655-I686 HydrophobicContact CZ2-CD1 4.29Å; W655-I686 HydrophobicContact CZ3-CB 4.11Å; W655-I686 HydrophobicContact CZ3-CD1 3.88Å; W655-I686 HydrophobicContact CZ3-CG2 4Å; Y683-I686 HydrophobicContact CD1-CD1 4.08Å; Y683-I686 WeakPolarHBondContact O-CB 3.29Å; Y683-I686 PolarHBondContact O-N 3.25Å; N684-I686 VanDerWaalsContact C-N 3.27Å; N684-I686 PolarHBondContact O-N 3.01Å; I686-Q689 PolarHBondContact O-N 3.19Å; I686-V690 WeakPolarHBondContact O-CG2 3.09Å; I686-V690 PolarHBondContact O-N 3.3Å
687	A	88.4	Confident	87.4	Confident	1 Å²	1	23.6 Å²	23.6	1%	0.008	12%	0.124	C	C	.	.	H	α-helix	trans	-59.7	-46.5	175.1	0	0	0	0	0	111.4	A659 V662 N684 Q689 V690 L691	A659-A687 HydrophobicContact CB-CB 4.08Å; V662-A687 HydrophobicContact CB-CB 4.11Å; V662-A687 HydrophobicContact CG1-CB 4.35Å; V662-A687 HydrophobicContact CG2-CB 4Å; N684-A687 WeakPolarHBondContact O-CB 3.29Å; N684-A687 PolarHBondContact O-N 2.85Å; A687-Q689 VanDerWaalsContact C-N 3.27Å; A687-Q689 PolarHBondContact O-N 3.23Å; A687-V690 PolarHBondContact O-N 2.99Å; A687-L691 VanDerWaalsContact O-CG 3.31Å; A687-L691 WeakPolarHBondContact O-CG 3.37Å; A687-L691 PolarHBondContact O-N 3.47Å
688	D	89.2	Confident	87	Confident	13 Å²	13	29.4 Å²	29.4	7%	0.07	15%	0.154	C	C	.	.	H	α-helix	trans	-58.7	-41	177.1	-71.8	-1.4	0	0	0	112.1	T72 S76 S78 R666 N684 F685 L691 S692	T72-D688 HydrophobicContact CG2-CB 4.45Å; S76-D688 WeakPolarHBondContact CB-OD2 3.21Å; S78-D688 WeakPolarHBondContact CB-OD2 3.2Å; S78-D688 PolarHBondContact N-OD2 2.95Å; S78-D688 VanDerWaalsContact N-OD2 3.13Å; S78-D688 PolarHBondContact OG-OD2 3.14Å; R666-D688 IonicContact CZ-OD1 3.68Å; R666-D688 IonicContact NH1-OD1 2.88Å; R666-D688 PolarHBondContact NH1-OD1 3.15Å; R666-D688 IonicContact NH1-OD2 3.05Å; R666-D688 IonicContact NH2-OD1 3.64Å; R666-D688 PolarHBondContact NH2-OD1 3.1Å; R666-D688 IonicContact NH2-OD2 3.72Å; R666-D688 PolarHBondContact NH2-OD2 3.15Å; N684-D688 PolarHBondContact O-N 2.97Å; F685-D688 PolarHBondContact O-N 3.24Å; D688-L691 PolarHBondContact O-N 3.07Å; D688-S692 PolarHBondContact O-N 3Å; D688-S692 VanDerWaalsContact O-N 3.1Å; D688-S692 PolarHBondContact O-OG 3.37Å
689	Q	87.9	Confident	86.9	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-66.9	-42.1	176.6	-176.5	59.2	12.1	0	0	112.3	Y71 T396 L522 F685 I686 A687 L691 S692 L693 P749	Y71-Q689 WeakPolarHBondContact O-CB 3.46Å; Y71-Q689 VanDerWaalsContact O-CG 3.31Å; Y71-Q689 WeakPolarHBondContact O-CG 3.07Å; Y71-Q689 PolarHBondContact O-OE1 2.97Å; T396-Q689 PolarHBondContact OG1-NE2 3.44Å; T396-Q689 PolarHBondContact OG1-OE1 3.47Å; L522-Q689 HydrophobicContact CD2-CB 3.89Å; L522-Q689 HydrophobicContact CD2-CG 3.62Å; F685-Q689 PolarHBondContact O-N 3.35Å; F685-Q689 VanDerWaalsContact O-N 3.13Å; I686-Q689 PolarHBondContact O-N 3.19Å; A687-Q689 VanDerWaalsContact C-N 3.27Å; A687-Q689 PolarHBondContact O-N 3.23Å; Q689-L691 VanDerWaalsContact C-N 3.3Å; Q689-L691 PolarHBondContact O-N 3.34Å; Q689-S692 PolarHBondContact O-N 2.64Å; Q689-S692 PolarHBondContact O-OG 3.34Å; Q689-S692 PolarHBondContact OE1-OG 3.43Å; Q689-L693 WeakPolarHBondContact O-CB 3.25Å; Q689-L693 PolarHBondContact O-N 2.96Å; Q689-P749 HydrophobicContact CG-CG 4.4Å
690	V	87.6	Confident	86.7	Confident	11 Å²	11	34.5 Å²	34.5	7%	0.067	18%	0.176	C	C	.	.	H	α-helix	trans	-62.8	-39.7	177	170.4	0	0	0	0	111.1	I520 L522 V656 A659 I686 A687	I520-V690 HydrophobicContact CG2-CG1 4.23Å; L522-V690 HydrophobicContact CB-CG2 3.85Å; L522-V690 HydrophobicContact CD2-CG2 4.19Å; V656-V690 HydrophobicContact CG2-CG1 4.26Å; A659-V690 HydrophobicContact CB-CB 3.98Å; A659-V690 HydrophobicContact CB-CG1 3.84Å; I686-V690 WeakPolarHBondContact O-CG2 3.09Å; I686-V690 PolarHBondContact O-N 3.3Å; A687-V690 PolarHBondContact O-N 2.99Å
691	L	85.9	Confident	86.6	Confident	66 Å²	66	36 Å²	36	35%	0.346	19%	0.185	S	C	.	.	H	α-helix	trans	-65.1	-37.7	177.4	-67.4	171.7	0	0	0	112.3	A659 A687 D688 Q689	A659-L691 HydrophobicContact CB-CD2 4.13Å; A659-L691 HydrophobicContact CB-CG 4.09Å; A687-L691 VanDerWaalsContact O-CG 3.31Å; A687-L691 WeakPolarHBondContact O-CG 3.37Å; A687-L691 PolarHBondContact O-N 3.47Å; D688-L691 PolarHBondContact O-N 3.07Å; Q689-L691 VanDerWaalsContact C-N 3.3Å; Q689-L691 PolarHBondContact O-N 3.34Å
692	S	85.6	Confident	86.7	Confident	21 Å²	21	37.3 Å²	37.3	15%	0.147	20%	0.2	C	C	.	.	H	α-helix	trans	-81	-32.3	179.4	66.2	0	0	0	0	113.3	D688 Q689 K694 T695 T696	D688-S692 PolarHBondContact O-N 3Å; D688-S692 VanDerWaalsContact O-N 3.1Å; D688-S692 PolarHBondContact O-OG 3.37Å; Q689-S692 PolarHBondContact O-N 2.64Å; Q689-S692 PolarHBondContact O-OG 3.34Å; Q689-S692 PolarHBondContact OE1-OG 3.43Å; S692-K694 PolarHBondContact O-N 3.11Å; S692-T695 PolarHBondContact O-OG1 3.17Å; S692-T696 VanDerWaalsContact O-CB 3.22Å; S692-T696 WeakPolarHBondContact O-CB 3.29Å; S692-T696 PolarHBondContact O-N 3.27Å; S692-T696 VanDerWaalsContact O-N 3.08Å; S692-T696 PolarHBondContact O-OG1 3.08Å
693	L	84.7	Confident	87.1	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-62.4	-44.9	-169.7	-169.9	68	0	0	0	112.5	I520 Q689 T695 T696 T697 M747 P749 V752	I520-L693 HydrophobicContact CG2-CD2 4.32Å; Q689-L693 WeakPolarHBondContact O-CB 3.25Å; Q689-L693 PolarHBondContact O-N 2.96Å; L693-T695 PolarHBondContact O-N 3.15Å; L693-T696 PolarHBondContact O-N 3.22Å; L693-T697 WeakPolarHBondContact O-CB 3.16Å; L693-T697 PolarHBondContact O-N 3.16Å; L693-T697 PolarHBondContact O-OG1 2.93Å; L693-M747 HydrophobicContact CG-CE 4.17Å; L693-P749 HydrophobicContact CD1-CG 4.28Å; L693-V752 HydrophobicContact CD1-CG2 3.97Å
694	K	78.4	Confident	87.4	Confident	147 Å²	147	39.2 Å²	39.2	64%	0.639	21%	0.214	S	C	*	.	H	α-helix	trans	-59	-48.3	-174.8	-175.5	178	179	180	0	112.7	I520 S692	I520-K694 HydrophobicContact CD1-CB 3.78Å; I520-K694 HydrophobicContact CD1-CD 4.21Å; I520-K694 HydrophobicContact CD1-CG 4Å; S692-K694 PolarHBondContact O-N 3.11Å
695	T	84.5	Confident	87.4	Confident	81 Å²	81	41.7 Å²	41.7	50%	0.497	23%	0.225	S	C	.	.	H	α-helix	trans	-74.8	-42.7	-178.2	49.8	0	0	0	0	110.8	S692 L693 L698 Q699	S692-T695 PolarHBondContact O-OG1 3.17Å; L693-T695 PolarHBondContact O-N 3.15Å; T695-L698 PolarHBondContact O-N 3.28Å; T695-Q699 VanDerWaalsContact O-CG 3.29Å; T695-Q699 WeakPolarHBondContact O-CG 3.21Å; T695-Q699 PolarHBondContact O-N 3.34Å; T695-Q699 VanDerWaalsContact O-N 3.14Å
696	T	85.2	Confident	87.6	Confident	21 Å²	21	44.2 Å²	44.2	13%	0.129	24%	0.244	C	C	.	.	H	α-helix	trans	-60.3	-49.9	179.6	-55.4	0	0	0	0	111.5	S395 S692 L693 L698 Q699 E700	S395-T696 PolarHBondContact OG-OG1 2.81Å; S692-T696 VanDerWaalsContact O-CB 3.22Å; S692-T696 WeakPolarHBondContact O-CB 3.29Å; S692-T696 PolarHBondContact O-N 3.27Å; S692-T696 VanDerWaalsContact O-N 3.08Å; S692-T696 PolarHBondContact O-OG1 3.08Å; L693-T696 PolarHBondContact O-N 3.22Å; T696-L698 PolarHBondContact O-N 3.31Å; T696-Q699 WeakPolarHBondContact O-CB 3.39Å; T696-Q699 PolarHBondContact O-N 2.75Å; T696-E700 HydrophobicContact CG2-CG 4.23Å; T696-E700 WeakPolarHBondContact CG2-OE1 3.05Å; T696-E700 WeakPolarHBondContact O-CG 3.49Å; T696-E700 PolarHBondContact O-N 2.96Å
697	T	85.3	Confident	87.7	Confident	11 Å²	11	45.5 Å²	45.5	7%	0.067	25%	0.253	C	S	.	.	H	α-helix	trans	-64	-41.8	-178	-58.4	0	0	0	0	112.7	L693 Q699 E700 V701 M747 V752	L693-T697 WeakPolarHBondContact O-CB 3.16Å; L693-T697 PolarHBondContact O-N 3.16Å; L693-T697 PolarHBondContact O-OG1 2.93Å; T697-Q699 VanDerWaalsContact C-N 3.27Å; T697-Q699 PolarHBondContact O-N 3.14Å; T697-E700 PolarHBondContact O-N 3.39Å; T697-V701 HydrophobicContact CG2-CG2 4.19Å; T697-V701 WeakPolarHBondContact O-CB 3.14Å; T697-V701 WeakPolarHBondContact O-CG2 3.44Å; T697-V701 PolarHBondContact O-N 3.36Å; T697-M747 HydrophobicContact CG2-CE 3.45Å; T697-M747 VanDerWaalsContact CG2-CE 3.45Å; T697-M747 WeakPolarHBondContact OG1-CE 3.39Å; T697-V752 HydrophobicContact CG2-CG1 4.06Å; T697-V752 HydrophobicContact CG2-CG2 3.83Å; T697-V752 WeakPolarHBondContact OG1-CG2 3.3Å
698	L	86.6	Confident	87.7	Confident	137 Å²	137	45.5 Å²	45.5	72%	0.717	25%	0.253	S	S	*	.	H	α-helix	trans	-63.1	-38.7	178.5	-176.2	65.1	0	0	0	111.1	T695 T696 G702	T695-L698 PolarHBondContact O-N 3.28Å; T696-L698 PolarHBondContact O-N 3.31Å; L698-G702 PolarHBondContact O-N 2.89Å
699	Q	90	Very high	87.7	Confident	131 Å²	131	49.4 Å²	49.4	61%	0.612	27%	0.27	S	S	*	.	H	α-helix	trans	-66.2	-47.5	174.5	-71.8	172.4	-7.2	0	0	111.4	T695 T696 T697 G702 V703	T695-Q699 VanDerWaalsContact O-CG 3.29Å; T695-Q699 WeakPolarHBondContact O-CG 3.21Å; T695-Q699 PolarHBondContact O-N 3.34Å; T695-Q699 VanDerWaalsContact O-N 3.14Å; T696-Q699 WeakPolarHBondContact O-CB 3.39Å; T696-Q699 PolarHBondContact O-N 2.75Å; T697-Q699 VanDerWaalsContact C-N 3.27Å; T697-Q699 PolarHBondContact O-N 3.14Å; Q699-G702 PolarHBondContact O-N 3.23Å; Q699-V703 WeakPolarHBondContact O-CB 3.37Å; Q699-V703 WeakPolarHBondContact O-CG2 3.31Å; Q699-V703 PolarHBondContact O-N 3.4Å
700	E	89.1	Confident	87.8	Confident	12 Å²	12	54.4 Å²	54.4	6%	0.056	30%	0.296	C	S	.	.	H	α-helix	trans	-59.7	-50	179.7	-74.3	172.1	177.5	0	0	111.9	I390 S394 T696 T697 V703 A704 V752	I390-E700 HydrophobicContact CG2-CB 4.4Å; I390-E700 HydrophobicContact CG2-CG 4.35Å; S394-E700 WeakPolarHBondContact CA-OE1 3.48Å; S394-E700 WeakPolarHBondContact CB-OE1 3.35Å; S394-E700 PolarHBondContact OG-OE1 2.8Å; T696-E700 HydrophobicContact CG2-CG 4.23Å; T696-E700 WeakPolarHBondContact CG2-OE1 3.05Å; T696-E700 WeakPolarHBondContact O-CG 3.49Å; T696-E700 PolarHBondContact O-N 2.96Å; T697-E700 PolarHBondContact O-N 3.39Å; E700-V703 PolarHBondContact O-N 2.93Å; E700-A704 VanDerWaalsContact O-CB 3.24Å; E700-A704 WeakPolarHBondContact O-CB 3.34Å; E700-A704 PolarHBondContact O-N 3.15Å; E700-V752 WeakPolarHBondContact OE2-CG1 3.43Å
701	V	89.7	Confident	87.9	Confident	37 Å²	37	54.2 Å²	54.2	22%	0.224	30%	0.295	C	S	.	.	H	α-helix	trans	-63.6	-43.9	178.1	172.9	0	0	0	0	111	T697 A704 F705 I755 I759	T697-V701 HydrophobicContact CG2-CG2 4.19Å; T697-V701 WeakPolarHBondContact O-CB 3.14Å; T697-V701 WeakPolarHBondContact O-CG2 3.44Å; T697-V701 PolarHBondContact O-N 3.36Å; V701-A704 PolarHBondContact O-N 2.95Å; V701-F705 PolarHBondContact O-N 3.01Å; V701-I755 HydrophobicContact CG2-CG2 4.03Å; V701-I759 HydrophobicContact CG1-CD1 4.14Å; V701-I759 HydrophobicContact CG2-CD1 4.35Å
702	G	91.1	Very high	88	Confident	34 Å²	34	51.1 Å²	51.1	35%	0.351	28%	0.278	S	S	.	.	H	α-helix	trans	-64.5	-40.8	179.2	0	0	0	0	0	113.1	L698 Q699 C706	L698-G702 PolarHBondContact O-N 2.89Å; Q699-G702 PolarHBondContact O-N 3.23Å; G702-C706 PolarHBondContact O-N 2.85Å; G702-C706 VanDerWaalsContact O-N 3.08Å; G702-C706 PolarHBondContact O-SG 3.48Å
703	V	91.9	Very high	88	Confident	70 Å²	70	52 Å²	52	42%	0.424	29%	0.287	S	S	.	.	H	α-helix	trans	-71.8	-39.4	176.7	178.1	0	0	0	0	110.6	I390 Q699 E700 F705 C706 C707	I390-V703 HydrophobicContact CD1-CB 4.3Å; I390-V703 HydrophobicContact CD1-CG1 3.68Å; I390-V703 HydrophobicContact CG1-CG1 3.9Å; I390-V703 HydrophobicContact CG2-CB 4.28Å; I390-V703 HydrophobicContact CG2-CG1 4.24Å; Q699-V703 WeakPolarHBondContact O-CB 3.37Å; Q699-V703 WeakPolarHBondContact O-CG2 3.31Å; Q699-V703 PolarHBondContact O-N 3.4Å; E700-V703 PolarHBondContact O-N 2.93Å; V703-F705 VanDerWaalsContact C-N 3.32Å; V703-F705 PolarHBondContact O-N 2.98Å; V703-C706 WeakPolarHBondContact O-CB 3.4Å; V703-C706 PolarHBondContact O-N 3.32Å; V703-C706 VanDerWaalsContact O-N 3.15Å; V703-C707 PolarHBondContact O-N 3.14Å
704	A	90.6	Very high	88.1	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-59.1	-45.4	175.7	0	0	0	0	0	110.9	I390 E700 V701 C706 C707 M708 L756 I759	I390-A704 VanDerWaalsContact CD1-CA 3.5Å; I390-A704 HydrophobicContact CD1-CB 4.1Å; E700-A704 VanDerWaalsContact O-CB 3.24Å; E700-A704 WeakPolarHBondContact O-CB 3.34Å; E700-A704 PolarHBondContact O-N 3.15Å; V701-A704 PolarHBondContact O-N 2.95Å; A704-C706 PolarHBondContact O-N 3.5Å; A704-C707 PolarHBondContact O-N 2.83Å; A704-M708 WeakPolarHBondContact O-CG 3.46Å; A704-M708 PolarHBondContact O-N 2.88Å; A704-L756 HydrophobicContact CB-CD1 4.02Å; A704-I759 HydrophobicContact CB-CD1 4.14Å; A704-I759 HydrophobicContact CB-CG2 4.3Å
705	F	89	Confident	88.2	Confident	56 Å²	56	50 Å²	50	25%	0.246	29%	0.285	C	S	.	.	H	α-helix	trans	-62.2	-40.9	174.6	-167.7	-94.3	0	0	0	113	V701 V703 C707 M708 F709 L729 F730	V701-F705 PolarHBondContact O-N 3.01Å; V703-F705 VanDerWaalsContact C-N 3.32Å; V703-F705 PolarHBondContact O-N 2.98Å; F705-C707 PolarHBondContact O-N 3Å; F705-M708 HydrophobicContact CB-CE 4.23Å; F705-M708 HydrophobicContact CD2-CE 3.57Å; F705-M708 HydrophobicContact CE2-CE 4.31Å; F705-M708 HydrophobicContact CG-CE 4.25Å; F705-M708 PolarHBondContact O-N 3.16Å; F705-F709 WeakPolarHBondContact O-CB 3.44Å; F705-F709 PolarHBondContact O-N 2.83Å; F705-L729 HydrophobicContact CE2-CB 4.49Å; F705-F730 HydrophobicContact CE2-CB 3.76Å; F705-F730 HydrophobicContact CE2-CD2 4.3Å; F705-F730 HydrophobicContact CZ-CB 3.89Å; F705-F730 HydrophobicContact CZ-CD2 4.38Å
706	C	91.1	Very high	88.1	Confident	73 Å²	73	47.2 Å²	47.2	49%	0.493	27%	0.267	S	S	.	.	H	α-helix	trans	-61.9	-42	173.9	-68.2	0	0	0	0	112.4	G702 V703 A704 F709 L710	G702-C706 PolarHBondContact O-N 2.85Å; G702-C706 VanDerWaalsContact O-N 3.08Å; G702-C706 PolarHBondContact O-SG 3.48Å; V703-C706 WeakPolarHBondContact O-CB 3.4Å; V703-C706 PolarHBondContact O-N 3.32Å; V703-C706 VanDerWaalsContact O-N 3.15Å; A704-C706 PolarHBondContact O-N 3.5Å; C706-F709 WeakPolarHBondContact O-CB 3.25Å; C706-F709 PolarHBondContact O-N 2.7Å; C706-L710 WeakPolarHBondContact O-CG 3.33Å; C706-L710 PolarHBondContact O-N 3.35Å
707	C	90.1	Very high	87.8	Confident	31 Å²	31	55.6 Å²	55.6	21%	0.209	30%	0.296	C	S	.	.	H	α-helix	trans	-65.1	-44.4	177.3	-76.9	0	0	0	0	111.6	F386 I390 V703 A704 F705 F709 L710 V711	F386-C707 HydrophobicContact CB-CB 4.12Å; I390-C707 HydrophobicContact CD1-CB 4.19Å; V703-C707 PolarHBondContact O-N 3.14Å; A704-C707 PolarHBondContact O-N 2.83Å; F705-C707 PolarHBondContact O-N 3Å; C707-F709 VanDerWaalsContact C-N 3.3Å; C707-F709 PolarHBondContact O-N 3.42Å; C707-L710 PolarHBondContact O-N 3.06Å; C707-V711 WeakPolarHBondContact O-CG2 2.94Å; C707-V711 PolarHBondContact O-N 2.91Å
708	M	88.7	Confident	87.7	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.01	31%	0.306	C	S	.	.	H	α-helix	trans	-59	-42.4	173.3	-70.6	-167.1	-61.8	0	0	112.1	T383 A704 F705 L710 V711 C712 I759 V763	T383-M708 HydrophobicContact CG2-CG 4.39Å; A704-M708 WeakPolarHBondContact O-CG 3.46Å; A704-M708 PolarHBondContact O-N 2.88Å; F705-M708 HydrophobicContact CB-CE 4.23Å; F705-M708 HydrophobicContact CD2-CE 3.57Å; F705-M708 HydrophobicContact CE2-CE 4.31Å; F705-M708 HydrophobicContact CG-CE 4.25Å; F705-M708 PolarHBondContact O-N 3.16Å; M708-L710 VanDerWaalsContact C-N 3.34Å; M708-L710 PolarHBondContact O-N 3.05Å; M708-V711 PolarHBondContact O-N 3.33Å; M708-C712 VanDerWaalsContact O-CB 3.32Å; M708-C712 WeakPolarHBondContact O-CB 3.5Å; M708-C712 PolarHBondContact O-N 2.76Å; M708-C712 PolarHBondContact O-SG 3.16Å; M708-I759 HydrophobicContact CE-CG2 3.28Å; M708-I759 HydrophobicContact CG-CG2 4.25Å; M708-I759 HydrophobicContact SD-CG2 3.27Å; M708-I759 WeakPolarHBondContact SD-CG2 3.29Å; M708-V763 HydrophobicContact CG-CG2 4.39Å; M708-V763 HydrophobicContact SD-CG2 3.55Å; M708-V763 VanDerWaalsContact SD-CG2 3.55Å
709	F	89.3	Confident	87.6	Confident	95 Å²	95	55.4 Å²	55.4	42%	0.417	30%	0.299	S	S	.	.	H	α-helix	trans	-56.3	-48.9	175.1	171.5	-91	0	0	0	111.5	F705 C706 C707 C712 A713 L726	F705-F709 WeakPolarHBondContact O-CB 3.44Å; F705-F709 PolarHBondContact O-N 2.83Å; C706-F709 WeakPolarHBondContact O-CB 3.25Å; C706-F709 PolarHBondContact O-N 2.7Å; C707-F709 VanDerWaalsContact C-N 3.3Å; C707-F709 PolarHBondContact O-N 3.42Å; F709-C712 PolarHBondContact O-N 2.88Å; F709-A713 WeakPolarHBondContact O-CB 3.37Å; F709-A713 PolarHBondContact O-N 3.49Å; F709-L726 HydrophobicContact CB-CD2 4.16Å; F709-L726 HydrophobicContact CD2-CD1 3.34Å; F709-L726 HydrophobicContact CD2-CD2 3.92Å; F709-L726 HydrophobicContact CD2-CG 4.25Å; F709-L726 HydrophobicContact CE2-CD1 3.56Å
710	L	90.3	Very high	87.5	Confident	105 Å²	105	52.6 Å²	52.6	55%	0.55	29%	0.288	S	S	.	.	H	α-helix	trans	-63.1	-45.4	-179.8	-69.8	172.5	0	0	0	111.7	C706 C707 M708 A713 V714	C706-L710 WeakPolarHBondContact O-CG 3.33Å; C706-L710 PolarHBondContact O-N 3.35Å; C707-L710 PolarHBondContact O-N 3.06Å; M708-L710 VanDerWaalsContact C-N 3.34Å; M708-L710 PolarHBondContact O-N 3.05Å; L710-A713 PolarHBondContact O-N 3.04Å; L710-V714 VanDerWaalsContact O-CG2 3.31Å; L710-V714 WeakPolarHBondContact O-CG2 3.36Å; L710-V714 PolarHBondContact O-N 2.92Å; L710-V714 VanDerWaalsContact O-N 3.11Å
711	V	89.1	Confident	87.5	Confident	7 Å²	7	52.2 Å²	52.2	4%	0.042	29%	0.286	C	S	.	.	H	α-helix	trans	-62	-53.6	177.4	174.7	0	0	0	0	109.9	I379 M382 T383 F386 C707 M708 A713 V714 F715	I379-V711 HydrophobicContact CG2-CG1 3.71Å; M382-V711 HydrophobicContact CB-CG1 4.46Å; M382-V711 HydrophobicContact CE-CG2 4.37Å; M382-V711 HydrophobicContact CG-CG1 4.28Å; M382-V711 HydrophobicContact CG-CG2 4.03Å; M382-V711 HydrophobicContact SD-CG1 4.29Å; M382-V711 HydrophobicContact SD-CG2 4.34Å; T383-V711 HydrophobicContact CG2-CB 3.87Å; T383-V711 HydrophobicContact CG2-CG1 3.62Å; T383-V711 HydrophobicContact CG2-CG2 4.37Å; F386-V711 HydrophobicContact CD2-CG2 3.68Å; F386-V711 HydrophobicContact CE2-CG2 3.81Å; C707-V711 WeakPolarHBondContact O-CG2 2.94Å; C707-V711 PolarHBondContact O-N 2.91Å; M708-V711 PolarHBondContact O-N 3.33Å; V711-A713 VanDerWaalsContact C-N 3.27Å; V711-A713 PolarHBondContact O-N 3.45Å; V711-V714 PolarHBondContact O-N 2.9Å; V711-V714 VanDerWaalsContact O-N 3.1Å; V711-F715 HydrophobicContact CG1-CD2 4.22Å; V711-F715 HydrophobicContact CG1-CE2 4.2Å; V711-F715 VanDerWaalsContact O-CD2 3.31Å; V711-F715 WeakPolarHBondContact O-CD2 3.28Å; V711-F715 PolarHBondContact O-N 3.11Å
712	C	87	Confident	87.5	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-57.8	-38.8	179.1	-68.2	0	0	0	0	112.5	M708 F709 V714 F715 I716 L722 L726	M708-C712 VanDerWaalsContact O-CB 3.32Å; M708-C712 WeakPolarHBondContact O-CB 3.5Å; M708-C712 PolarHBondContact O-N 2.76Å; M708-C712 PolarHBondContact O-SG 3.16Å; F709-C712 PolarHBondContact O-N 2.88Å; C712-V714 PolarHBondContact O-N 3.36Å; C712-F715 PolarHBondContact O-N 2.88Å; C712-I716 WeakPolarHBondContact O-CB 3.34Å; C712-I716 PolarHBondContact O-N 3.34Å; C712-L722 HydrophobicContact CB-CD1 3.72Å; C712-L726 HydrophobicContact CB-CD2 4.32Å
713	A	87.4	Confident	87.6	Confident	39 Å²	39	55.5 Å²	55.5	32%	0.322	29%	0.289	S	S	.	.	H	α-helix	trans	-67.7	-31.7	179.1	0	0	0	0	0	113.5	F709 L710 V711 F715 L722	F709-A713 WeakPolarHBondContact O-CB 3.37Å; F709-A713 PolarHBondContact O-N 3.49Å; L710-A713 PolarHBondContact O-N 3.04Å; V711-A713 VanDerWaalsContact C-N 3.27Å; V711-A713 PolarHBondContact O-N 3.45Å; A713-F715 VanDerWaalsContact C-N 3.35Å; A713-L722 HydrophobicContact CB-CD2 3.95Å
714	V	86	Confident	87.6	Confident	85 Å²	85	54.8 Å²	54.8	52%	0.515	28%	0.278	S	S	.	.	H	α-helix	trans	-68.6	-35.2	176.1	168.4	0	0	0	0	111.5	F21 L710 V711 C712	F21-V714 HydrophobicContact CD1-CG1 3.79Å; F21-V714 HydrophobicContact CE1-CG1 4.31Å; F21-V714 HydrophobicContact CG-CG1 4.27Å; L710-V714 VanDerWaalsContact O-CG2 3.31Å; L710-V714 WeakPolarHBondContact O-CG2 3.36Å; L710-V714 PolarHBondContact O-N 2.92Å; L710-V714 VanDerWaalsContact O-N 3.11Å; V711-V714 PolarHBondContact O-N 2.9Å; V711-V714 VanDerWaalsContact O-N 3.1Å; C712-V714 PolarHBondContact O-N 3.36Å
715	F	81.1	Confident	87.6	Confident	24 Å²	24	54.8 Å²	54.8	11%	0.105	28%	0.278	C	S	.	.	H	α-helix	trans	-95.6	-34.7	-175.5	-72.4	-91.6	0	0	0	114.1	F21 L25 I379 M382 V711 C712 A713	F21-F715 HydrophobicContact CD1-CD1 4.37Å; F21-F715 AromaticContact CD1-CE1 3.99Å; F21-F715 HydrophobicContact CD1-CE1 3.99Å; F21-F715 HydrophobicContact CD1-CZ 4.15Å; F21-F715 AromaticContact CE1-CE1 3.79Å; F21-F715 HydrophobicContact CE1-CE1 3.79Å; F21-F715 HydrophobicContact CE1-CE2 4.24Å; F21-F715 AromaticContact CE1-CZ 3.6Å; F21-F715 HydrophobicContact CE1-CZ 3.6Å; L25-F715 HydrophobicContact CD2-CE1 3.7Å; L25-F715 HydrophobicContact CD2-CZ 4.27Å; I379-F715 HydrophobicContact CD1-CB 3.56Å; I379-F715 HydrophobicContact CD1-CD1 3.48Å; I379-F715 VanDerWaalsContact CD1-CD1 3.48Å; I379-F715 HydrophobicContact CD1-CD2 4.17Å; I379-F715 HydrophobicContact CD1-CE1 4.1Å; I379-F715 HydrophobicContact CD1-CG 3.5Å; I379-F715 VanDerWaalsContact CD1-CG 3.5Å; I379-F715 HydrophobicContact CG1-CB 4.05Å; I379-F715 HydrophobicContact CG1-CD1 3.42Å; I379-F715 VanDerWaalsContact CG1-CD1 3.42Å; I379-F715 HydrophobicContact CG1-CD2 3.65Å; I379-F715 HydrophobicContact CG1-CE1 3.55Å; I379-F715 HydrophobicContact CG1-CE2 3.8Å; I379-F715 HydrophobicContact CG1-CG 3.45Å; I379-F715 VanDerWaalsContact CG1-CG 3.45Å; I379-F715 HydrophobicContact CG1-CZ 3.73Å; I379-F715 HydrophobicContact CG2-CD2 4.2Å; M382-F715 HydrophobicContact SD-CE2 4.14Å; V711-F715 HydrophobicContact CG1-CD2 4.22Å; V711-F715 HydrophobicContact CG1-CE2 4.2Å; V711-F715 VanDerWaalsContact O-CD2 3.31Å; V711-F715 WeakPolarHBondContact O-CD2 3.28Å; V711-F715 PolarHBondContact O-N 3.11Å; C712-F715 PolarHBondContact O-N 2.88Å; A713-F715 VanDerWaalsContact C-N 3.35Å
716	I	82.5	Confident	87.8	Confident	21 Å²	21	53 Å²	53	11%	0.108	27%	0.272	C	S	.	.			trans	-99.8	102.6	-177.2	-54.7	176.7	0	0	0	110.3	C712 L721 L722 V725 A770	C712-I716 WeakPolarHBondContact O-CB 3.34Å; C712-I716 PolarHBondContact O-N 3.34Å; I716-L721 HydrophobicContact CG2-CB 4.21Å; I716-L721 HydrophobicContact CG2-CD2 4.01Å; I716-L721 HydrophobicContact CG2-CG 4.14Å; I716-L722 HydrophobicContact CB-CB 4.36Å; I716-L722 HydrophobicContact CB-CD1 4.28Å; I716-L722 HydrophobicContact CG2-CB 3.97Å; I716-V725 HydrophobicContact CD1-CB 4.41Å; I716-V725 HydrophobicContact CD1-CG1 4.24Å; I716-V725 HydrophobicContact CD1-CG2 4.14Å; I716-A770 HydrophobicContact CD1-CB 4.42Å
717	R	77.3	Confident	88	Confident	198 Å²	198	54 Å²	54	75%	0.747	27%	0.265	S	S	*	.			trans	-75.7	-32.3	-177.3	-165.5	-175	66.4	78.3	0.3	114.6	S719	R717-S719 PolarHBondContact O-N 3.18Å
718	K	84	Confident	88.1	Confident	63 Å²	63	52.6 Å²	52.6	27%	0.274	26%	0.255	S	S	.	.			trans	-75.3	111.8	-178.4	-173.3	178.1	-176.8	-179.5	0	109	D720 L721 L722 Y774 K848	K718-D720 VanDerWaalsContact C-N 3.27Å; K718-D720 PolarHBondContact O-N 3.29Å; K718-L721 HydrophobicContact CB-CB 4.04Å; K718-L721 HydrophobicContact CD-CB 4.37Å; K718-L721 HydrophobicContact CG-CB 4.3Å; K718-L721 PolarHBondContact O-N 2.94Å; K718-L721 VanDerWaalsContact O-N 3.12Å; K718-L722 PolarHBondContact O-N 3.19Å; K718-Y774 HydrophobicContact CB-CE2 4.45Å; K718-K848 PolarHBondContact NZ-O 2.92Å
719	S	85.1	Confident	88.3	Confident	81 Å²	81	52.5 Å²	52.5	57%	0.566	26%	0.255	S	S	*	.	H	α-helix	trans	-52.7	-42.8	-179	52.5	0	0	0	0	113	R717 L721 L722 F723	R717-S719 PolarHBondContact O-N 3.18Å; S719-L721 PolarHBondContact O-N 3.5Å; S719-L722 PolarHBondContact O-N 3.28Å; S719-F723 WeakPolarHBondContact O-CB 3.3Å; S719-F723 PolarHBondContact O-N 3.38Å
720	D	87.3	Confident	88.6	Confident	71 Å²	71	52.5 Å²	52.5	38%	0.38	26%	0.255	S	S	.	.	H	α-helix	trans	-68.4	-39	-177.2	-50.1	-20	0	0	0	111.3	K718 F723 W724 T847	K718-D720 VanDerWaalsContact C-N 3.27Å; K718-D720 PolarHBondContact O-N 3.29Å; D720-F723 PolarHBondContact O-N 3.19Å; D720-W724 PolarHBondContact O-N 3.24Å; D720-T847 HydrophobicContact CB-CG2 4.06Å
721	L	88.4	Confident	88.8	Confident	5 Å²	5	47.5 Å²	47.5	3%	0.026	23%	0.229	C	C	.	.	H	α-helix	trans	-68.6	-45.2	177.7	-176.3	66.4	0	0	0	110.3	I716 K718 S719 F723 W724 V725 A770 Y773 Y774 F844	I716-L721 HydrophobicContact CG2-CB 4.21Å; I716-L721 HydrophobicContact CG2-CD2 4.01Å; I716-L721 HydrophobicContact CG2-CG 4.14Å; K718-L721 HydrophobicContact CB-CB 4.04Å; K718-L721 HydrophobicContact CD-CB 4.37Å; K718-L721 HydrophobicContact CG-CB 4.3Å; K718-L721 PolarHBondContact O-N 2.94Å; K718-L721 VanDerWaalsContact O-N 3.12Å; S719-L721 PolarHBondContact O-N 3.5Å; L721-F723 VanDerWaalsContact C-N 3.31Å; L721-F723 PolarHBondContact O-N 2.96Å; L721-W724 PolarHBondContact O-N 2.65Å; L721-V725 WeakPolarHBondContact O-CG2 3.46Å; L721-V725 PolarHBondContact O-N 2.72Å; L721-A770 HydrophobicContact CD1-CB 4.21Å; L721-A770 HydrophobicContact CD2-CB 4.21Å; L721-A770 HydrophobicContact CG-CB 4.23Å; L721-Y773 HydrophobicContact CD1-CD1 4.14Å; L721-Y774 HydrophobicContact CD2-CD2 4.49Å; L721-F844 HydrophobicContact CD1-CD1 3.62Å; L721-F844 HydrophobicContact CD1-CD2 4.48Å; L721-F844 HydrophobicContact CD1-CE1 3.25Å; L721-F844 HydrophobicContact CD1-CE2 4.16Å; L721-F844 HydrophobicContact CD1-CG 4.24Å; L721-F844 HydrophobicContact CD1-CZ 3.55Å
722	L	90.5	Very high	89.1	Confident	23 Å²	23	47.2 Å²	47.2	12%	0.12	23%	0.227	C	C	.	.	H	α-helix	trans	-56.3	-45.5	175.2	176.3	62.8	0	0	0	111.1	C712 A713 I716 K718 S719 W724 V725 L726	C712-L722 HydrophobicContact CB-CD1 3.72Å; A713-L722 HydrophobicContact CB-CD2 3.95Å; I716-L722 HydrophobicContact CB-CB 4.36Å; I716-L722 HydrophobicContact CB-CD1 4.28Å; I716-L722 HydrophobicContact CG2-CB 3.97Å; K718-L722 PolarHBondContact O-N 3.19Å; S719-L722 PolarHBondContact O-N 3.28Å; L722-W724 PolarHBondContact O-N 3.15Å; L722-V725 PolarHBondContact O-N 2.85Å; L722-L726 HydrophobicContact CD1-CD1 3.78Å; L722-L726 HydrophobicContact CD1-CG 4.01Å; L722-L726 HydrophobicContact CG-CD1 3.75Å; L722-L726 HydrophobicContact CG-CG 4.4Å; L722-L726 WeakPolarHBondContact O-CB 3.23Å; L722-L726 WeakPolarHBondContact O-CD1 3.35Å; L722-L726 VanDerWaalsContact O-CG 3.23Å; L722-L726 WeakPolarHBondContact O-CG 3.38Å; L722-L726 PolarHBondContact O-N 3.22Å
723	F	92.2	Very high	89.4	Confident	116 Å²	116	47.7 Å²	47.7	51%	0.509	23%	0.23	S	C	.	.	H	α-helix	trans	-57.4	-48.7	177.5	175.5	-97.8	0	0	0	112.4	S719 D720 L721 V725 L726 W727	S719-F723 WeakPolarHBondContact O-CB 3.3Å; S719-F723 PolarHBondContact O-N 3.38Å; D720-F723 PolarHBondContact O-N 3.19Å; L721-F723 VanDerWaalsContact C-N 3.31Å; L721-F723 PolarHBondContact O-N 2.96Å; F723-V725 PolarHBondContact O-N 3.35Å; F723-L726 PolarHBondContact O-N 3.34Å; F723-W727 VanDerWaalsContact O-CB 3.28Å; F723-W727 WeakPolarHBondContact O-CB 3.21Å; F723-W727 PolarHBondContact O-N 3.16Å
724	W	92.4	Very high	89.7	Confident	55 Å²	55	47.1 Å²	47.1	21%	0.208	22%	0.22	C	C	.	.	H	α-helix	trans	-68.6	-33.3	-179.9	-67.7	119.8	0	0	0	113.3	D720 L721 L722 S728 L843 F844 L846	D720-W724 PolarHBondContact O-N 3.24Å; L721-W724 PolarHBondContact O-N 2.65Å; L722-W724 PolarHBondContact O-N 3.15Å; W724-S728 VanDerWaalsContact O-CB 3.3Å; W724-S728 WeakPolarHBondContact O-CB 3.34Å; W724-S728 PolarHBondContact O-N 2.89Å; W724-L843 HydrophobicContact CD2-CB 4.1Å; W724-L843 HydrophobicContact CE3-CB 4.15Å; W724-L843 HydrophobicContact CE3-CD1 3.83Å; W724-L843 HydrophobicContact CE3-CD2 4.01Å; W724-L843 HydrophobicContact CE3-CG 4.22Å; W724-L843 HydrophobicContact CG-CB 4.31Å; W724-L843 HydrophobicContact CH2-CD2 4.25Å; W724-L843 HydrophobicContact CZ3-CD1 4.32Å; W724-L843 HydrophobicContact CZ3-CD2 3.8Å; W724-F844 HydrophobicContact CB-CD1 4.36Å; W724-F844 HydrophobicContact CB-CE1 4.18Å; W724-L846 HydrophobicContact CZ2-CD1 4.48Å
725	V	92	Very high	90.1	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.5	-52.2	172.6	168.8	0	0	0	0	110.1	I716 L721 L722 F723 W727 S728 L729 A770 F844	I716-V725 HydrophobicContact CD1-CB 4.41Å; I716-V725 HydrophobicContact CD1-CG1 4.24Å; I716-V725 HydrophobicContact CD1-CG2 4.14Å; L721-V725 WeakPolarHBondContact O-CG2 3.46Å; L721-V725 PolarHBondContact O-N 2.72Å; L722-V725 PolarHBondContact O-N 2.85Å; F723-V725 PolarHBondContact O-N 3.35Å; V725-W727 VanDerWaalsContact C-N 3.34Å; V725-W727 PolarHBondContact O-N 3.29Å; V725-S728 WeakPolarHBondContact O-CB 3.36Å; V725-S728 PolarHBondContact O-N 2.92Å; V725-S728 VanDerWaalsContact O-N 3.12Å; V725-L729 HydrophobicContact CG1-CD1 4.17Å; V725-L729 WeakPolarHBondContact O-CG 3.36Å; V725-L729 PolarHBondContact O-N 3.27Å; V725-A770 HydrophobicContact CG2-CB 3.51Å; V725-F844 HydrophobicContact CG2-CZ 4.47Å
726	L	92.7	Very high	90.8	Very high	19 Å²	19	41.9 Å²	41.9	10%	0.099	19%	0.191	C	C	.	.	H	α-helix	trans	-62.7	-39.9	179.5	-66.2	165.9	0	0	0	112.7	F709 C712 L722 F723 S728 L729 F730	F709-L726 HydrophobicContact CB-CD2 4.16Å; F709-L726 HydrophobicContact CD2-CD1 3.34Å; F709-L726 HydrophobicContact CD2-CD2 3.92Å; F709-L726 HydrophobicContact CD2-CG 4.25Å; F709-L726 HydrophobicContact CE2-CD1 3.56Å; C712-L726 HydrophobicContact CB-CD2 4.32Å; L722-L726 HydrophobicContact CD1-CD1 3.78Å; L722-L726 HydrophobicContact CD1-CG 4.01Å; L722-L726 HydrophobicContact CG-CD1 3.75Å; L722-L726 HydrophobicContact CG-CG 4.4Å; L722-L726 WeakPolarHBondContact O-CB 3.23Å; L722-L726 WeakPolarHBondContact O-CD1 3.35Å; L722-L726 VanDerWaalsContact O-CG 3.23Å; L722-L726 WeakPolarHBondContact O-CG 3.38Å; L722-L726 PolarHBondContact O-N 3.22Å; F723-L726 PolarHBondContact O-N 3.34Å; L726-S728 VanDerWaalsContact C-N 3.33Å; L726-L729 PolarHBondContact O-N 3.19Å; L726-F730 WeakPolarHBondContact O-CB 3.28Å; L726-F730 PolarHBondContact O-N 3.47Å
727	W	93.8	Very high	91.4	Very high	95 Å²	95	42.2 Å²	42.2	36%	0.36	19%	0.192	S	C	.	.	H	α-helix	trans	-62.9	-41.3	174.6	-180	-98.3	0	0	0	111.5	Y504 L508 F723 V725 S731	Y504-W727 AromaticContact CZ-NE1 3.98Å; Y504-W727 PolarHBondContact OH-NE1 3.07Å; L508-W727 HydrophobicContact CD1-CZ2 4.37Å; F723-W727 VanDerWaalsContact O-CB 3.28Å; F723-W727 WeakPolarHBondContact O-CB 3.21Å; F723-W727 PolarHBondContact O-N 3.16Å; V725-W727 VanDerWaalsContact C-N 3.34Å; V725-W727 PolarHBondContact O-N 3.29Å; W727-S731 WeakPolarHBondContact O-CB 3.32Å; W727-S731 PolarHBondContact O-N 3.24Å
728	S	93.9	Very high	92.2	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-66	-39.2	176.1	-171	0	0	0	0	112.2	W724 V725 L726 S731 M732 H835	W724-S728 VanDerWaalsContact O-CB 3.3Å; W724-S728 WeakPolarHBondContact O-CB 3.34Å; W724-S728 PolarHBondContact O-N 2.89Å; V725-S728 WeakPolarHBondContact O-CB 3.36Å; V725-S728 PolarHBondContact O-N 2.92Å; V725-S728 VanDerWaalsContact O-N 3.12Å; L726-S728 VanDerWaalsContact C-N 3.33Å; S728-S731 WeakPolarHBondContact O-CB 3.03Å; S728-S731 PolarHBondContact O-N 3.39Å; S728-M732 WeakPolarHBondContact O-CG 3.48Å; S728-M732 PolarHBondContact O-N 3.36Å; S728-H835 PolarHBondContact OG-CD2 3.39Å
729	L	93.2	Very high	92.8	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.1	-53.6	175.2	-69.4	172	0	0	0	111	F705 V725 L726 S731 M732 D733 V763 T766	F705-L729 HydrophobicContact CE2-CB 4.49Å; V725-L729 HydrophobicContact CG1-CD1 4.17Å; V725-L729 WeakPolarHBondContact O-CG 3.36Å; V725-L729 PolarHBondContact O-N 3.27Å; L726-L729 PolarHBondContact O-N 3.19Å; L729-S731 VanDerWaalsContact C-N 3.25Å; L729-S731 PolarHBondContact O-N 2.96Å; L729-M732 HydrophobicContact CD2-CE 3.94Å; L729-M732 PolarHBondContact O-N 2.93Å; L729-D733 PolarHBondContact O-N 3.37Å; L729-V763 HydrophobicContact CD2-CB 4.47Å; L729-V763 HydrophobicContact CD2-CG2 4.03Å; L729-T766 HydrophobicContact CD2-CG2 3.67Å; L729-T766 HydrophobicContact CG-CG2 4.09Å
730	F	93.5	Very high	93.2	Very high	96 Å²	96	28.2 Å²	28.2	42%	0.421	13%	0.129	S	C	.	.	H	α-helix	trans	-55.6	-42.7	176.4	179.4	-100.9	0	0	0	112.2	F705 L726 M734	F705-F730 HydrophobicContact CE2-CB 3.76Å; F705-F730 HydrophobicContact CE2-CD2 4.3Å; F705-F730 HydrophobicContact CZ-CB 3.89Å; F705-F730 HydrophobicContact CZ-CD2 4.38Å; L726-F730 WeakPolarHBondContact O-CB 3.28Å; L726-F730 PolarHBondContact O-N 3.47Å; F730-M734 HydrophobicContact CE1-SD 4.33Å; F730-M734 VanDerWaalsContact O-CB 3.23Å; F730-M734 WeakPolarHBondContact O-CB 3.32Å; F730-M734 PolarHBondContact O-N 3.36Å
731	S	95.7	Very high	93.5	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62	-40.9	176.8	170.4	0	0	0	0	112.7	Y504 Y507 L508 W727 S728 L729 G735 H835	Y504-S731 VanDerWaalsContact CE2-OG 3.22Å; Y504-S731 WeakPolarHBondContact CE2-OG 3.29Å; Y504-S731 VanDerWaalsContact OH-CB 3.28Å; Y504-S731 WeakPolarHBondContact OH-CB 3.45Å; Y504-S731 PolarHBondContact OH-OG 3.44Å; Y507-S731 WeakPolarHBondContact CE1-OG 3.38Å; Y507-S731 PolarHBondContact OH-O 3.47Å; L508-S731 WeakPolarHBondContact CD2-OG 3.15Å; W727-S731 WeakPolarHBondContact O-CB 3.32Å; W727-S731 PolarHBondContact O-N 3.24Å; S728-S731 WeakPolarHBondContact O-CB 3.03Å; S728-S731 PolarHBondContact O-N 3.39Å; L729-S731 VanDerWaalsContact C-N 3.25Å; L729-S731 PolarHBondContact O-N 2.96Å; S731-G735 PolarHBondContact O-N 2.94Å; S731-G735 VanDerWaalsContact O-N 3.16Å; S731-H835 PolarHBondContact OG-NE2 3.16Å
732	M	94.9	Very high	93.8	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-70	-48.4	176.5	-74.7	-174.2	-65	0	0	111.7	S728 L729 M734 G735 V736 T762 T766 H835	S728-M732 WeakPolarHBondContact O-CG 3.48Å; S728-M732 PolarHBondContact O-N 3.36Å; L729-M732 HydrophobicContact CD2-CE 3.94Å; L729-M732 PolarHBondContact O-N 2.93Å; M732-M734 VanDerWaalsContact C-N 3.33Å; M732-M734 PolarHBondContact O-N 3.4Å; M732-G735 CarbonylContact O-C 3.55Å; M732-G735 WeakPolarHBondContact O-CA 3.46Å; M732-G735 PolarHBondContact O-N 3.19Å; M732-V736 WeakPolarHBondContact O-CG2 3.31Å; M732-V736 PolarHBondContact O-N 3.29Å; M732-T762 HydrophobicContact CB-CG2 3.93Å; M732-T762 HydrophobicContact CE-CG2 4.4Å; M732-T762 WeakPolarHBondContact CE-O 3.32Å; M732-T762 HydrophobicContact SD-CG2 4.31Å; M732-T766 HydrophobicContact CE-CG2 3.22Å; M732-H835 HydrophobicContact CG-CB 4.13Å; M732-H835 VanDerWaalsContact CG-CE1 3.47Å; M732-H835 WeakPolarHBondContact CG-CE1 3.48Å; M732-H835 VanDerWaalsContact CG-CG 3.49Å; M732-H835 WeakPolarHBondContact CG-ND1 3.47Å; M732-H835 HydrophobicContact SD-CB 3.68Å
733	D	92.8	Very high	93.9	Very high	11 Å²	11	33.7 Å²	33.7	6%	0.059	15%	0.15	C	C	.	.	H	α-helix	trans	-59	-45.1	179	-68.3	-29.7	0	0	0	111.4	L729 G735 V736 I737	L729-D733 PolarHBondContact O-N 3.37Å; D733-G735 VanDerWaalsContact C-N 3.27Å; D733-G735 PolarHBondContact O-N 3.38Å; D733-V736 PolarHBondContact O-N 3.23Å; D733-I737 VanDerWaalsContact O-CG1 3.3Å; D733-I737 WeakPolarHBondContact O-CG1 3.25Å; D733-I737 PolarHBondContact O-N 2.85Å
734	M	94.4	Very high	93.8	Very high	26 Å²	26	31.1 Å²	31.1	13%	0.128	16%	0.156	C	C	.	.	H	α-helix	trans	-60.3	-37.6	174.5	-175.2	179.7	68.1	0	0	111.8	L508 F512 T515 F730 M732 G738	L508-M734 HydrophobicContact CD2-CE 3.62Å; F512-M734 HydrophobicContact CB-CE 4.46Å; F512-M734 HydrophobicContact CB-SD 4.15Å; F512-M734 HydrophobicContact CD2-SD 4.16Å; T515-M734 PolarHBondContact OG1-O 3.3Å; F730-M734 HydrophobicContact CE1-SD 4.33Å; F730-M734 VanDerWaalsContact O-CB 3.23Å; F730-M734 WeakPolarHBondContact O-CB 3.32Å; F730-M734 PolarHBondContact O-N 3.36Å; M732-M734 VanDerWaalsContact C-N 3.33Å; M732-M734 PolarHBondContact O-N 3.4Å; M734-G738 PolarHBondContact O-N 3.16Å
735	G	95.6	Very high	93.7	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-73.5	-36.8	177.3	0	0	0	0	0	114.1	Y507 S511 S731 M732 D733 L739	Y507-G735 VanDerWaalsContact OH-CA 3.29Å; Y507-G735 WeakPolarHBondContact OH-CA 3.28Å; S511-G735 VanDerWaalsContact OG-CA 3.26Å; S511-G735 WeakPolarHBondContact OG-CA 3.21Å; S731-G735 PolarHBondContact O-N 2.94Å; S731-G735 VanDerWaalsContact O-N 3.16Å; M732-G735 CarbonylContact O-C 3.55Å; M732-G735 WeakPolarHBondContact O-CA 3.46Å; M732-G735 PolarHBondContact O-N 3.19Å; D733-G735 VanDerWaalsContact C-N 3.27Å; D733-G735 PolarHBondContact O-N 3.38Å; G735-L739 WeakPolarHBondContact O-CB 3.37Å; G735-L739 WeakPolarHBondContact O-CG 3.19Å; G735-L739 PolarHBondContact O-N 3.18Å
736	V	95.2	Very high	93.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61	-52.5	172.9	174.9	0	0	0	0	109.2	M732 D733 G738 L740 T824 V828 L831	M732-V736 WeakPolarHBondContact O-CG2 3.31Å; M732-V736 PolarHBondContact O-N 3.29Å; D733-V736 PolarHBondContact O-N 3.23Å; V736-G738 PolarHBondContact O-N 3.17Å; V736-L740 HydrophobicContact CG1-CD1 3.7Å; V736-L740 HydrophobicContact CG1-CG 4.3Å; V736-L740 VanDerWaalsContact O-CB 3.29Å; V736-L740 WeakPolarHBondContact O-CB 3.23Å; V736-L740 WeakPolarHBondContact O-CD1 3.37Å; V736-L740 WeakPolarHBondContact O-CG 3.49Å; V736-L740 PolarHBondContact O-N 3.31Å; V736-T824 HydrophobicContact CG1-CG2 3.97Å; V736-V828 HydrophobicContact CG1-CG2 4.38Å; V736-V828 HydrophobicContact CG2-CG2 3.83Å; V736-L831 HydrophobicContact CG2-CD1 3.9Å
737	I	93.8	Very high	93.2	Very high	27 Å²	27	31.5 Å²	31.5	14%	0.138	16%	0.162	C	C	.	.	H	α-helix	trans	-60	-47.3	179.3	-63.7	167.6	0	0	0	111.2	T515 I518 D733 T741 I755	T515-I737 HydrophobicContact CG2-CG2 4.14Å; I518-I737 HydrophobicContact CD1-CG2 4.06Å; D733-I737 VanDerWaalsContact O-CG1 3.3Å; D733-I737 WeakPolarHBondContact O-CG1 3.25Å; D733-I737 PolarHBondContact O-N 2.85Å; I737-T741 PolarHBondContact O-N 3.46Å; I737-T741 VanDerWaalsContact O-N 3.11Å; I737-T741 PolarHBondContact O-OG1 2.7Å; I737-I755 HydrophobicContact CD1-CG2 3.97Å; I737-I755 HydrophobicContact CG1-CD1 4.03Å; I737-I755 HydrophobicContact CG1-CG1 4.05Å; I737-I755 HydrophobicContact CG1-CG2 3.95Å
738	G	95	Very high	92.8	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-66.9	-44.8	-177.6	0	0	0	0	0	113.3	S511 G514 T515 M734 V736 T741 L742	S511-G738 WeakPolarHBondContact O-CA 3.4Å; G514-G738 WeakPolarHBondContact CA-O 3.27Å; T515-G738 PolarHBondContact OG1-N 2.84Å; M734-G738 PolarHBondContact O-N 3.16Å; V736-G738 PolarHBondContact O-N 3.17Å; G738-T741 WeakPolarHBondContact O-CB 3.33Å; G738-T741 PolarHBondContact O-N 3.07Å; G738-L742 VanDerWaalsContact O-CG 3.32Å; G738-L742 WeakPolarHBondContact O-CG 3.34Å; G738-L742 PolarHBondContact O-N 3.07Å
739	L	96.3	Very high	92.5	Very high	44 Å²	44	27.5 Å²	27.5	23%	0.23	15%	0.148	C	C	.	.	H	α-helix	trans	-71.9	-35.2	179.1	-67.1	175.8	0	0	0	112.2	Y507 I510 G735 T741 L742 W743 L827 L831	Y507-L739 HydrophobicContact CE2-CD1 4.45Å; I510-L739 HydrophobicContact CG2-CD2 4.07Å; G735-L739 WeakPolarHBondContact O-CB 3.37Å; G735-L739 WeakPolarHBondContact O-CG 3.19Å; G735-L739 PolarHBondContact O-N 3.18Å; L739-T741 VanDerWaalsContact C-N 3.3Å; L739-T741 PolarHBondContact O-N 3.08Å; L739-L742 HydrophobicContact CD2-CD1 4.38Å; L739-L742 CarbonylContact O-C 3.43Å; L739-L742 PolarHBondContact O-N 3.15Å; L739-W743 WeakPolarHBondContact O-CB 3.34Å; L739-W743 PolarHBondContact O-N 3.37Å; L739-L827 HydrophobicContact CB-CD1 3.9Å; L739-L827 HydrophobicContact CB-CD2 4.01Å; L739-L827 HydrophobicContact CD1-CD2 3.91Å; L739-L831 HydrophobicContact CD1-CD1 4.13Å; L739-L831 HydrophobicContact CD1-CD2 4.16Å
740	L	94.2	Very high	92.2	Very high	5 Å²	5	27.5 Å²	27.5	3%	0.026	15%	0.148	C	C	.	.	H	α-helix	trans	-60	-43.7	172.1	-73.6	171.1	0	0	0	110.9	V736 W743 G744 L745 I755 R823 T824 L827	V736-L740 HydrophobicContact CG1-CD1 3.7Å; V736-L740 HydrophobicContact CG1-CG 4.3Å; V736-L740 VanDerWaalsContact O-CB 3.29Å; V736-L740 WeakPolarHBondContact O-CB 3.23Å; V736-L740 WeakPolarHBondContact O-CD1 3.37Å; V736-L740 WeakPolarHBondContact O-CG 3.49Å; V736-L740 PolarHBondContact O-N 3.31Å; L740-W743 CarbonylContact O-C 3.56Å; L740-W743 WeakPolarHBondContact O-CA 3.34Å; L740-W743 WeakPolarHBondContact O-CB 3.45Å; L740-W743 PolarHBondContact O-N 2.95Å; L740-W743 VanDerWaalsContact O-N 3.11Å; L740-G744 PolarHBondContact O-N 3.26Å; L740-L745 HydrophobicContact CB-CD1 4.25Å; L740-L745 HydrophobicContact CD2-CD1 3.48Å; L740-L745 VanDerWaalsContact CD2-CD1 3.48Å; L740-L745 HydrophobicContact CG-CD1 4.42Å; L740-L745 WeakPolarHBondContact O-CB 3.38Å; L740-L745 PolarHBondContact O-N 3.08Å; L740-L745 VanDerWaalsContact O-N 3.17Å; L740-I755 HydrophobicContact CD1-CG1 4.48Å; L740-R823 HydrophobicContact CD2-CB 4.42Å; L740-T824 HydrophobicContact CD1-CG2 4.2Å; L740-L827 HydrophobicContact CD2-CD1 3.6Å; L740-L827 HydrophobicContact CG-CD1 3.68Å
741	T	93.6	Very high	92.1	Very high	21 Å²	21	23.3 Å²	23.3	13%	0.129	13%	0.13	C	C	.	.	H	α-helix	trans	-62.3	-44.1	175.9	-56.5	0	0	0	0	111.4	G514 K517 I518 I737 G738 L739 W743 G744	G514-T741 WeakPolarHBondContact O-CG2 3.15Å; K517-T741 HydrophobicContact CB-CG2 4.18Å; I518-T741 HydrophobicContact CB-CG2 4.35Å; I737-T741 PolarHBondContact O-N 3.46Å; I737-T741 VanDerWaalsContact O-N 3.11Å; I737-T741 PolarHBondContact O-OG1 2.7Å; G738-T741 WeakPolarHBondContact O-CB 3.33Å; G738-T741 PolarHBondContact O-N 3.07Å; L739-T741 VanDerWaalsContact C-N 3.3Å; L739-T741 PolarHBondContact O-N 3.08Å; T741-W743 PolarHBondContact O-N 2.91Å; T741-G744 PolarHBondContact O-N 2.88Å
742	L	94.5	Very high	91.8	Very high	78 Å²	78	23.5 Å²	23.5	41%	0.408	13%	0.131	S	C	.	.	H	α-helix	trans	-68.5	-21.9	175.8	-66.9	173.9	0	0	0	112.9	I510 Y513 G738 L739 G744	I510-L742 HydrophobicContact CG2-CD1 3.54Å; Y513-L742 HydrophobicContact CD1-CD2 3.96Å; Y513-L742 HydrophobicContact CE1-CD2 3.97Å; G738-L742 VanDerWaalsContact O-CG 3.32Å; G738-L742 WeakPolarHBondContact O-CG 3.34Å; G738-L742 PolarHBondContact O-N 3.07Å; L739-L742 HydrophobicContact CD2-CD1 4.38Å; L739-L742 CarbonylContact O-C 3.43Å; L739-L742 PolarHBondContact O-N 3.15Å; L742-G744 PolarHBondContact O-N 3.17Å
743	W	93.5	Very high	91.6	Very high	115 Å²	115	23.5 Å²	23.5	44%	0.436	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	6.9	171.3	-148.3	-13.1	0	0	0	113.1	L739 L740 T741 R823 L827	L739-W743 WeakPolarHBondContact O-CB 3.34Å; L739-W743 PolarHBondContact O-N 3.37Å; L740-W743 CarbonylContact O-C 3.56Å; L740-W743 WeakPolarHBondContact O-CA 3.34Å; L740-W743 WeakPolarHBondContact O-CB 3.45Å; L740-W743 PolarHBondContact O-N 2.95Å; L740-W743 VanDerWaalsContact O-N 3.11Å; T741-W743 PolarHBondContact O-N 2.91Å; W743-R823 HydrophobicContact CD2-CG 4.33Å; W743-R823 HydrophobicContact CE3-CB 3.9Å; W743-R823 HydrophobicContact CE3-CG 4.05Å; W743-R823 HydrophobicContact CH2-CB 4.05Å; W743-R823 HydrophobicContact CH2-CG 3.7Å; W743-R823 HydrophobicContact CZ2-CG 3.98Å; W743-R823 HydrophobicContact CZ3-CB 3.58Å; W743-R823 HydrophobicContact CZ3-CG 3.72Å; W743-L827 HydrophobicContact CE3-CD1 3.97Å; W743-L827 HydrophobicContact CE3-CG 4.26Å; W743-L827 HydrophobicContact CZ3-CD1 4.18Å; W743-L827 HydrophobicContact CZ3-CD2 4.33Å; W743-L827 HydrophobicContact CZ3-CG 3.99Å
744	G	89.8	Confident	91.5	Very high	61 Å²	61	23 Å²	23	63%	0.629	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.5	23.6	175.9	0	0	0	0	0	113.9	L740 T741 L742	L740-G744 PolarHBondContact O-N 3.26Å; T741-G744 PolarHBondContact O-N 2.88Å; L742-G744 PolarHBondContact O-N 3.17Å
745	L	89.3	Confident	91.3	Very high	25 Å²	25	22.3 Å²	22.3	13%	0.131	13%	0.125	C	C	.	.			trans	-89.5	125.8	172	-65.3	172.8	0	0	0	109.8	L740 T751 V820	L740-L745 HydrophobicContact CB-CD1 4.25Å; L740-L745 HydrophobicContact CD2-CD1 3.48Å; L740-L745 VanDerWaalsContact CD2-CD1 3.48Å; L740-L745 HydrophobicContact CG-CD1 4.42Å; L740-L745 WeakPolarHBondContact O-CB 3.38Å; L740-L745 PolarHBondContact O-N 3.08Å; L740-L745 VanDerWaalsContact O-N 3.17Å; L745-T751 HydrophobicContact CB-CG2 4.47Å; L745-V820 HydrophobicContact CD1-CG2 4.41Å; L745-V820 HydrophobicContact CD2-CG2 3.78Å
746	D	87.7	Confident	91.1	Very high	39 Å²	39	22.5 Å²	22.5	21%	0.209	13%	0.126	C	C	.	.			trans	-83.1	155.1	171.7	-67.6	-39.3	0	0	0	110.4	N521 H526 D748 T751	N521-D746 HydrophobicContact CB-CB 3.64Å; N521-D746 VanDerWaalsContact CB-OD2 3.25Å; N521-D746 WeakPolarHBondContact CB-OD2 3.14Å; N521-D746 PolarHBondContact ND2-OD2 2.73Å; H526-D746 IonicContact CE1-OD2 3.19Å; D746-D748 PolarHBondContact O-N 3.38Å; D746-T751 VanDerWaalsContact O-CG2 3.31Å; D746-T751 WeakPolarHBondContact O-CG2 2.87Å
747	M	85.8	Confident	90.8	Very high	18 Å²	18	22.5 Å²	22.5	9%	0.089	13%	0.126	C	C	.	.	B	Isolated β-bridge	trans	-75.5	106.4	176.4	-175.3	176.2	161.9	0	0	110.4	I518 R519 I520 N521 L693 T697 T751 V752	I518-M747 HydrophobicContact CD1-CB 4.03Å; I518-M747 HydrophobicContact CD1-CG 4.28Å; I518-M747 HydrophobicContact CD1-SD 3.88Å; I518-M747 HydrophobicContact CG1-CB 3.95Å; I518-M747 HydrophobicContact CG1-SD 4.38Å; R519-M747 WeakPolarHBondContact O-CB 3.5Å; R519-M747 PolarHBondContact O-N 3.47Å; I520-M747 HydrophobicContact CG1-CB 4.23Å; I520-M747 HydrophobicContact CG1-CG 4.46Å; I520-M747 HydrophobicContact CG1-SD 4.08Å; N521-M747 PolarHBondContact N-O 3.41Å; L693-M747 HydrophobicContact CG-CE 4.17Å; T697-M747 HydrophobicContact CG2-CE 3.45Å; T697-M747 VanDerWaalsContact CG2-CE 3.45Å; T697-M747 WeakPolarHBondContact OG1-CE 3.39Å; M747-T751 WeakPolarHBondContact CA-OG1 3.18Å; M747-V752 HydrophobicContact CE-CG2 4.19Å; M747-V752 HydrophobicContact CG-CG2 4.43Å
748	D	86.7	Confident	90.6	Very high	9 Å²	9	21.2 Å²	21.2	5%	0.048	12%	0.119	C	C	.	.			trans	-127	169.3	173.6	70.3	17	0	0	0	110.7	L522 D746 T750 T751 V752	L522-D748 HydrophobicContact CD1-CB 4.28Å; D746-D748 PolarHBondContact O-N 3.38Å; D748-T750 PolarHBondContact O-N 2.74Å; D748-T750 VanDerWaalsContact O-N 3.1Å; D748-T750 WeakPolarHBondContact OD1-CA 3.19Å; D748-T750 WeakPolarHBondContact OD1-CB 3.31Å; D748-T750 PolarHBondContact OD1-N 3.1Å; D748-T751 PolarHBondContact N-OG1 3.04Å; D748-T751 PolarHBondContact O-N 3.42Å; D748-T751 PolarHBondContact O-OG1 3.39Å; D748-T751 WeakPolarHBondContact OD1-CG2 3.45Å; D748-T751 PolarHBondContact OD1-N 3.18Å; D748-T751 PolarHBondContact OD1-OG1 3.14Å; D748-V752 WeakPolarHBondContact O-CG2 3.23Å; D748-V752 PolarHBondContact O-N 2.87Å
749	P	86.8	Confident	90.4	Very high	3 Å²	3	21.2 Å²	21.2	2%	0.019	12%	0.119	C	C	.	.	H	α-helix	trans	-55.3	-29.3	178.6	-30	38.3	0	0	0	114.6	Y71 I399 L522 Q689 L693 I753	Y71-P749 HydrophobicContact CD1-CB 4.14Å; Y71-P749 HydrophobicContact CD1-CG 4.02Å; Y71-P749 HydrophobicContact CE1-CB 4.04Å; Y71-P749 HydrophobicContact CE1-CG 4.31Å; I399-P749 HydrophobicContact CD1-CB 4.13Å; I399-P749 HydrophobicContact CG1-CB 4.4Å; L522-P749 HydrophobicContact CD1-CG 4.29Å; Q689-P749 HydrophobicContact CG-CG 4.4Å; L693-P749 HydrophobicContact CD1-CG 4.28Å; P749-I753 WeakPolarHBondContact O-CG1 3.45Å; P749-I753 PolarHBondContact O-N 3.45Å
750	T	88.1	Confident	89.9	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-73.5	-41.3	179.3	-61.6	0	0	0	0	112	D748 V752 I753 S754 V817 V820 F821	D748-T750 PolarHBondContact O-N 2.74Å; D748-T750 VanDerWaalsContact O-N 3.1Å; D748-T750 WeakPolarHBondContact OD1-CA 3.19Å; D748-T750 WeakPolarHBondContact OD1-CB 3.31Å; D748-T750 PolarHBondContact OD1-N 3.1Å; T750-V752 VanDerWaalsContact C-N 3.33Å; T750-I753 PolarHBondContact O-N 3.4Å; T750-S754 PolarHBondContact O-N 3.33Å; T750-S754 PolarHBondContact O-OG 3.47Å; T750-V817 HydrophobicContact CG2-CB 4.3Å; T750-V817 HydrophobicContact CG2-CG1 3.86Å; T750-V817 HydrophobicContact CG2-CG2 4.37Å; T750-V820 HydrophobicContact CG2-CB 4.28Å; T750-V820 HydrophobicContact CG2-CG1 4.18Å; T750-F821 HydrophobicContact CG2-CD2 4.32Å; T750-F821 HydrophobicContact CG2-CE2 3.83Å; T750-F821 HydrophobicContact CG2-CZ 4.38Å
751	T	90	Very high	89.6	Confident	7 Å²	7	19.5 Å²	19.5	4%	0.043	11%	0.111	C	C	.	.	H	α-helix	trans	-64.9	-36.2	172.3	58.7	0	0	0	0	111.6	L745 D746 M747 D748 S754 I755 V820	L745-T751 HydrophobicContact CB-CG2 4.47Å; D746-T751 VanDerWaalsContact O-CG2 3.31Å; D746-T751 WeakPolarHBondContact O-CG2 2.87Å; M747-T751 WeakPolarHBondContact CA-OG1 3.18Å; D748-T751 PolarHBondContact N-OG1 3.04Å; D748-T751 PolarHBondContact O-N 3.42Å; D748-T751 PolarHBondContact O-OG1 3.39Å; D748-T751 WeakPolarHBondContact OD1-CG2 3.45Å; D748-T751 PolarHBondContact OD1-N 3.18Å; D748-T751 PolarHBondContact OD1-OG1 3.14Å; T751-S754 CarbonylContact O-C 3.51Å; T751-S754 WeakPolarHBondContact O-CB 3.19Å; T751-S754 PolarHBondContact O-N 3.25Å; T751-S754 VanDerWaalsContact O-N 3.14Å; T751-I755 VanDerWaalsContact O-CG1 3.27Å; T751-I755 WeakPolarHBondContact O-CG1 3.34Å; T751-I755 PolarHBondContact O-N 3.46Å; T751-V820 HydrophobicContact CG2-CG1 3.72Å; T751-V820 HydrophobicContact CG2-CG2 4.48Å
752	V	89.7	Confident	89.5	Confident	4 Å²	4	18.5 Å²	18.5	2%	0.024	11%	0.105	C	C	.	.	H	α-helix	trans	-61	-47.6	175.3	174.4	0	0	0	0	111.2	I399 L693 T697 E700 M747 D748 T750 S754 I755 L756	I399-V752 HydrophobicContact CD1-CB 4.47Å; I399-V752 HydrophobicContact CD1-CG1 4.25Å; L693-V752 HydrophobicContact CD1-CG2 3.97Å; T697-V752 HydrophobicContact CG2-CG1 4.06Å; T697-V752 HydrophobicContact CG2-CG2 3.83Å; T697-V752 WeakPolarHBondContact OG1-CG2 3.3Å; E700-V752 WeakPolarHBondContact OE2-CG1 3.43Å; M747-V752 HydrophobicContact CE-CG2 4.19Å; M747-V752 HydrophobicContact CG-CG2 4.43Å; D748-V752 WeakPolarHBondContact O-CG2 3.23Å; D748-V752 PolarHBondContact O-N 2.87Å; T750-V752 VanDerWaalsContact C-N 3.33Å; V752-S754 VanDerWaalsContact C-N 3.26Å; V752-S754 PolarHBondContact O-N 3.18Å; V752-I755 PolarHBondContact O-N 3.16Å; V752-L756 PolarHBondContact O-N 3.47Å
753	I	90.2	Very high	89.2	Confident	1 Å²	1	14.8 Å²	14.8	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-57.3	-44	173.5	-65	165.4	0	0	0	110.6	T330 I399 F402 P749 T750 I755 L756 M757 F821	T330-I753 HydrophobicContact CG2-CD1 4.19Å; I399-I753 HydrophobicContact CB-CD1 4.41Å; I399-I753 HydrophobicContact CB-CG1 4.18Å; I399-I753 HydrophobicContact CD1-CG1 4.42Å; I399-I753 HydrophobicContact CG1-CD1 3.92Å; I399-I753 HydrophobicContact CG1-CG1 3.78Å; I399-I753 HydrophobicContact CG2-CG1 3.97Å; F402-I753 HydrophobicContact CB-CD1 4.3Å; F402-I753 HydrophobicContact CD1-CG2 3.3Å; F402-I753 HydrophobicContact CD2-CG2 4.09Å; F402-I753 HydrophobicContact CE1-CG2 3.16Å; F402-I753 HydrophobicContact CE2-CG2 3.95Å; F402-I753 HydrophobicContact CG-CD1 4.31Å; F402-I753 HydrophobicContact CG-CG2 3.79Å; F402-I753 HydrophobicContact CZ-CG2 3.51Å; P749-I753 WeakPolarHBondContact O-CG1 3.45Å; P749-I753 PolarHBondContact O-N 3.45Å; T750-I753 PolarHBondContact O-N 3.4Å; I753-I755 VanDerWaalsContact C-N 3.34Å; I753-I755 PolarHBondContact O-N 3.44Å; I753-L756 PolarHBondContact O-N 2.92Å; I753-M757 WeakPolarHBondContact O-CB 3.38Å; I753-M757 PolarHBondContact O-N 3.46Å; I753-F821 HydrophobicContact CB-CE1 4.46Å; I753-F821 HydrophobicContact CB-CZ 4.24Å; I753-F821 HydrophobicContact CG2-CE1 3.82Å; I753-F821 HydrophobicContact CG2-CZ 3.77Å
754	S	90.8	Very high	89	Confident	0 Å²	0	9.6 Å²	9.6	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-65.6	-37.2	-178.7	-56.6	0	0	0	0	112.2	T750 T751 V752 S758 F821 T824	T750-S754 PolarHBondContact O-N 3.33Å; T750-S754 PolarHBondContact O-OG 3.47Å; T751-S754 CarbonylContact O-C 3.51Å; T751-S754 WeakPolarHBondContact O-CB 3.19Å; T751-S754 PolarHBondContact O-N 3.25Å; T751-S754 VanDerWaalsContact O-N 3.14Å; V752-S754 VanDerWaalsContact C-N 3.26Å; V752-S754 PolarHBondContact O-N 3.18Å; S754-S758 PolarHBondContact O-N 2.85Å; S754-F821 VanDerWaalsContact OG-CD1 3.32Å; S754-F821 WeakPolarHBondContact OG-CD1 3.37Å; S754-F821 WeakPolarHBondContact OG-CE1 3.45Å; S754-T824 WeakPolarHBondContact CB-OG1 3.4Å; S754-T824 WeakPolarHBondContact O-CG2 3.29Å
755	I	91.4	Very high	89	Confident	11 Å²	11	6.9 Å²	6.9	6%	0.056	4%	0.037	C	C	.	.	H	α-helix	trans	-67	-45.4	174.4	-68.9	162.2	0	0	0	110.2	V701 I737 L740 T751 V752 I753 M757 S758 I759	V701-I755 HydrophobicContact CG2-CG2 4.03Å; I737-I755 HydrophobicContact CD1-CG2 3.97Å; I737-I755 HydrophobicContact CG1-CD1 4.03Å; I737-I755 HydrophobicContact CG1-CG1 4.05Å; I737-I755 HydrophobicContact CG1-CG2 3.95Å; L740-I755 HydrophobicContact CD1-CG1 4.48Å; T751-I755 VanDerWaalsContact O-CG1 3.27Å; T751-I755 WeakPolarHBondContact O-CG1 3.34Å; T751-I755 PolarHBondContact O-N 3.46Å; V752-I755 PolarHBondContact O-N 3.16Å; I753-I755 VanDerWaalsContact C-N 3.34Å; I753-I755 PolarHBondContact O-N 3.44Å; I755-M757 VanDerWaalsContact C-N 3.28Å; I755-M757 PolarHBondContact O-N 3.36Å; I755-S758 WeakPolarHBondContact CA-OG 3.45Å; I755-S758 PolarHBondContact O-N 2.96Å; I755-S758 VanDerWaalsContact O-N 3.07Å; I755-S758 PolarHBondContact O-OG 3.13Å; I755-I759 HydrophobicContact CG2-CD1 4.46Å; I755-I759 WeakPolarHBondContact O-CG1 3.36Å; I755-I759 PolarHBondContact O-N 3.35Å
756	L	89.9	Confident	89.1	Confident	4 Å²	4	5.7 Å²	5.7	2%	0.021	3%	0.031	C	C	.	.	H	α-helix	trans	-60.4	-41.3	177.1	-172	64.6	0	0	0	111.7	S387 F388 A704 V752 I753 I759	S387-L756 WeakPolarHBondContact O-CD1 3.41Å; F388-L756 HydrophobicContact CD1-CD2 4.35Å; A704-L756 HydrophobicContact CB-CD1 4.02Å; V752-L756 PolarHBondContact O-N 3.47Å; I753-L756 PolarHBondContact O-N 2.92Å; L756-I759 WeakPolarHBondContact O-CB 3.27Å; L756-I759 PolarHBondContact O-N 3.5Å
757	M	89.4	Confident	89.1	Confident	0 Å²	0	4 Å²	4	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-63.1	-40.6	172.8	177.3	-162.4	70.6	0	0	112.2	I337 F388 I753 I755 I759 G760 L761 F821 T824 V825	I337-M757 HydrophobicContact CB-SD 4.35Å; I337-M757 HydrophobicContact CD1-SD 3.49Å; I337-M757 WeakPolarHBondContact CD1-SD 3.22Å; I337-M757 HydrophobicContact CG1-SD 3.77Å; I337-M757 HydrophobicContact CG2-CG 4.06Å; I337-M757 HydrophobicContact CG2-SD 3.62Å; F388-M757 HydrophobicContact CE1-CB 4.11Å; F388-M757 HydrophobicContact CZ-CB 3.97Å; F388-M757 HydrophobicContact CZ-CG 4.15Å; I753-M757 WeakPolarHBondContact O-CB 3.38Å; I753-M757 PolarHBondContact O-N 3.46Å; I755-M757 VanDerWaalsContact C-N 3.28Å; I755-M757 PolarHBondContact O-N 3.36Å; M757-I759 PolarHBondContact O-N 2.93Å; M757-G760 PolarHBondContact O-N 2.82Å; M757-L761 HydrophobicContact CE-CD1 4.14Å; M757-L761 HydrophobicContact CG-CD1 3.8Å; M757-L761 HydrophobicContact CG-CG 4.48Å; M757-L761 PolarHBondContact O-N 3.24Å; M757-L761 VanDerWaalsContact O-N 3.11Å; M757-L761 HydrophobicContact SD-CD1 4.2Å; M757-F821 HydrophobicContact CE-CD1 4.25Å; M757-F821 HydrophobicContact SD-CD1 4.25Å; M757-T824 HydrophobicContact CE-CG2 4.17Å; M757-V825 HydrophobicContact CE-CG2 3.62Å; M757-V825 HydrophobicContact SD-CG2 4.44Å
758	S	90.5	Very high	89.2	Confident	0 Å²	0	3.3 Å²	3.3	0%	0	2%	0.018	C	C	.	.	H	α-helix	trans	-62.1	-34.4	177.4	65.4	0	0	0	0	112.9	S754 I755 G760 L761 T762	S754-S758 PolarHBondContact O-N 2.85Å; I755-S758 WeakPolarHBondContact CA-OG 3.45Å; I755-S758 PolarHBondContact O-N 2.96Å; I755-S758 VanDerWaalsContact O-N 3.07Å; I755-S758 PolarHBondContact O-OG 3.13Å; S758-G760 VanDerWaalsContact C-N 3.35Å; S758-G760 PolarHBondContact O-N 3.34Å; S758-L761 PolarHBondContact O-N 3.32Å; S758-T762 WeakPolarHBondContact O-CB 3.2Å; S758-T762 WeakPolarHBondContact O-CG2 3.4Å; S758-T762 PolarHBondContact O-N 2.85Å; S758-T762 PolarHBondContact O-OG1 3.08Å
759	I	89.6	Confident	89.4	Confident	1 Å²	1	2.9 Å²	2.9	1%	0.005	2%	0.016	C	C	.	.	H	α-helix	trans	-60.5	-47	177.9	-70.4	169.3	0	0	0	110	V701 A704 M708 I755 L756 M757 T762 V763	V701-I759 HydrophobicContact CG1-CD1 4.14Å; V701-I759 HydrophobicContact CG2-CD1 4.35Å; A704-I759 HydrophobicContact CB-CD1 4.14Å; A704-I759 HydrophobicContact CB-CG2 4.3Å; M708-I759 HydrophobicContact CE-CG2 3.28Å; M708-I759 HydrophobicContact CG-CG2 4.25Å; M708-I759 HydrophobicContact SD-CG2 3.27Å; M708-I759 WeakPolarHBondContact SD-CG2 3.29Å; I755-I759 HydrophobicContact CG2-CD1 4.46Å; I755-I759 WeakPolarHBondContact O-CG1 3.36Å; I755-I759 PolarHBondContact O-N 3.35Å; L756-I759 WeakPolarHBondContact O-CB 3.27Å; L756-I759 PolarHBondContact O-N 3.5Å; M757-I759 PolarHBondContact O-N 2.93Å; I759-T762 PolarHBondContact O-OG1 3.23Å; I759-V763 WeakPolarHBondContact O-CG2 3.07Å
760	G	85.8	Confident	89.5	Confident	1 Å²	1	2.8 Å²	2.8	1%	0.01	2%	0.015	C	C	.	.	H	α-helix	trans	-61.6	-56.1	175.4	0	0	0	0	0	113	D384 M757 S758 T762 V763	D384-G760 WeakPolarHBondContact OD1-CA 3.41Å; M757-G760 PolarHBondContact O-N 2.82Å; S758-G760 VanDerWaalsContact C-N 3.35Å; S758-G760 PolarHBondContact O-N 3.34Å; G760-T762 PolarHBondContact O-N 2.98Å; G760-T762 VanDerWaalsContact O-N 3.12Å; G760-V763 VanDerWaalsContact O-CB 3.31Å; G760-V763 WeakPolarHBondContact O-CB 3.29Å; G760-V763 PolarHBondContact O-N 3.48Å
761	L	88.5	Confident	89.3	Confident	12 Å²	12	4.1 Å²	4.1	6%	0.063	2%	0.02	C	C	.	.	H	α-helix	trans	-58.5	-29.3	-178	-76.6	167.4	0	0	0	114.7	L341 M757 S758 V763 F765 V825 V828	L341-L761 HydrophobicContact CD2-CD2 3.18Å; L341-L761 HydrophobicContact CD2-CG 3.97Å; L341-L761 HydrophobicContact CG-CD2 3.9Å; M757-L761 HydrophobicContact CE-CD1 4.14Å; M757-L761 HydrophobicContact CG-CD1 3.8Å; M757-L761 HydrophobicContact CG-CG 4.48Å; M757-L761 PolarHBondContact O-N 3.24Å; M757-L761 VanDerWaalsContact O-N 3.11Å; M757-L761 HydrophobicContact SD-CD1 4.2Å; S758-L761 PolarHBondContact O-N 3.32Å; L761-V763 VanDerWaalsContact C-N 3.27Å; L761-V763 PolarHBondContact O-N 3.24Å; L761-F765 WeakPolarHBondContact O-CD2 3.49Å; L761-F765 WeakPolarHBondContact O-CE2 3.28Å; L761-V825 HydrophobicContact CD1-CG2 4.46Å; L761-V828 HydrophobicContact CB-CG1 3.67Å; L761-V828 HydrophobicContact CD1-CG1 4.37Å
762	T	90.9	Very high	89	Confident	0 Å²	0	4.6 Å²	4.6	0%	0	2%	0.022	C	C	.	.	H	α-helix	trans	-73.2	-21.9	-179.8	59.7	0	0	0	0	112.8	M732 S758 I759 G760 D764 V828	M732-T762 HydrophobicContact CB-CG2 3.93Å; M732-T762 HydrophobicContact CE-CG2 4.4Å; M732-T762 WeakPolarHBondContact CE-O 3.32Å; M732-T762 HydrophobicContact SD-CG2 4.31Å; S758-T762 WeakPolarHBondContact O-CB 3.2Å; S758-T762 WeakPolarHBondContact O-CG2 3.4Å; S758-T762 PolarHBondContact O-N 2.85Å; S758-T762 PolarHBondContact O-OG1 3.08Å; I759-T762 PolarHBondContact O-OG1 3.23Å; G760-T762 PolarHBondContact O-N 2.98Å; G760-T762 VanDerWaalsContact O-N 3.12Å; T762-D764 PolarHBondContact O-N 2.83Å; T762-V828 HydrophobicContact CG2-CG1 4.03Å
763	V	89.7	Confident	88.9	Confident	0 Å²	0	5.9 Å²	5.9	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-62.3	-43.5	-177.6	178	0	0	0	0	111.5	T383 M708 L729 I759 G760 L761 F765 T766 I767	T383-V763 HydrophobicContact CG2-CG1 4.1Å; T383-V763 HydrophobicContact CG2-CG2 4.4Å; T383-V763 WeakPolarHBondContact OG1-CG1 3.13Å; M708-V763 HydrophobicContact CG-CG2 4.39Å; M708-V763 HydrophobicContact SD-CG2 3.55Å; M708-V763 VanDerWaalsContact SD-CG2 3.55Å; L729-V763 HydrophobicContact CD2-CB 4.47Å; L729-V763 HydrophobicContact CD2-CG2 4.03Å; I759-V763 WeakPolarHBondContact O-CG2 3.07Å; G760-V763 VanDerWaalsContact O-CB 3.31Å; G760-V763 WeakPolarHBondContact O-CB 3.29Å; G760-V763 PolarHBondContact O-N 3.48Å; L761-V763 VanDerWaalsContact C-N 3.27Å; L761-V763 PolarHBondContact O-N 3.24Å; V763-F765 VanDerWaalsContact C-N 3.32Å; V763-F765 PolarHBondContact O-N 2.82Å; V763-T766 PolarHBondContact O-N 3.48Å; V763-T766 PolarHBondContact O-OG1 3.49Å; V763-I767 HydrophobicContact CG1-CB 4.48Å; V763-I767 HydrophobicContact CG1-CD1 3.13Å; V763-I767 HydrophobicContact CG1-CG1 3.58Å; V763-I767 PolarHBondContact O-N 2.96Å
764	D	87.8	Confident	88.6	Confident	6 Å²	6	11.5 Å²	11.5	3%	0.032	5%	0.049	C	C	.	.	H	α-helix	trans	-53.6	-49.6	-177.4	-57.1	-12.5	0	0	0	111.2	T380 T762 T766 H768	T380-D764 WeakPolarHBondContact CB-OD1 3.35Å; T380-D764 HydrophobicContact CG2-CB 4.42Å; T380-D764 WeakPolarHBondContact CG2-OD1 3.13Å; T762-D764 PolarHBondContact O-N 2.83Å; D764-T766 PolarHBondContact O-N 3.18Å; D764-T766 VanDerWaalsContact O-N 3.12Å; D764-H768 PolarHBondContact O-CD2 2.73Å; D764-H768 PolarHBondContact O-N 2.72Å
765	F	90.5	Very high	88.1	Confident	4 Å²	4	16.2 Å²	16.2	2%	0.018	7%	0.067	C	C	.	.	H	α-helix	trans	-57.9	-31	179.4	-64.9	-66.5	0	0	0	113.2	L761 V763 M769 L796 V828 V829 L833 A836	L761-F765 WeakPolarHBondContact O-CD2 3.49Å; L761-F765 WeakPolarHBondContact O-CE2 3.28Å; V763-F765 VanDerWaalsContact C-N 3.32Å; V763-F765 PolarHBondContact O-N 2.82Å; F765-M769 WeakPolarHBondContact O-CG 3.31Å; F765-L796 HydrophobicContact CD1-CB 4.48Å; F765-L796 HydrophobicContact CD1-CD2 4.02Å; F765-V828 HydrophobicContact CE2-CG1 4.29Å; F765-V829 HydrophobicContact CZ-CG2 4.48Å; F765-L833 HydrophobicContact CD1-CD2 4.22Å; F765-L833 HydrophobicContact CE1-CD2 3.83Å; F765-L833 HydrophobicContact CE1-CG 4.09Å; F765-A836 HydrophobicContact CB-CB 4.09Å; F765-A836 WeakPolarHBondContact O-CB 3.2Å
766	T	91.1	Very high	87.6	Confident	0 Å²	0	16.3 Å²	16.3	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-91.3	-44.4	-177.7	70.2	0	0	0	0	113.4	L729 M732 V763 D764 M769 A770 L840	L729-T766 HydrophobicContact CD2-CG2 3.67Å; L729-T766 HydrophobicContact CG-CG2 4.09Å; M732-T766 HydrophobicContact CE-CG2 3.22Å; V763-T766 PolarHBondContact O-N 3.48Å; V763-T766 PolarHBondContact O-OG1 3.49Å; D764-T766 PolarHBondContact O-N 3.18Å; D764-T766 VanDerWaalsContact O-N 3.12Å; T766-M769 PolarHBondContact O-N 3.1Å; T766-A770 WeakPolarHBondContact O-CB 3.25Å; T766-A770 PolarHBondContact O-N 3.49Å; T766-L840 HydrophobicContact CG2-CD1 3.88Å
767	I	88.8	Confident	87	Confident	2 Å²	2	21.6 Å²	21.6	1%	0.01	10%	0.103	C	C	.	.	H	α-helix	trans	-71.2	-42.4	-170.2	-67.1	-166.2	0	0	0	111	I379 V763 M769 A770 Y771	I379-I767 HydrophobicContact CB-CD1 4.2Å; I379-I767 HydrophobicContact CB-CG2 4.39Å; I379-I767 HydrophobicContact CD1-CG2 4.03Å; I379-I767 HydrophobicContact CG2-CD1 3.31Å; I379-I767 HydrophobicContact CG2-CG2 4.41Å; V763-I767 HydrophobicContact CG1-CB 4.48Å; V763-I767 HydrophobicContact CG1-CD1 3.13Å; V763-I767 HydrophobicContact CG1-CG1 3.58Å; V763-I767 PolarHBondContact O-N 2.96Å; I767-M769 VanDerWaalsContact C-N 3.33Å; I767-M769 PolarHBondContact O-N 2.99Å; I767-A770 PolarHBondContact O-N 2.98Å; I767-Y771 WeakPolarHBondContact O-CB 3.36Å; I767-Y771 PolarHBondContact O-N 2.7Å
768	H	87.7	Confident	86.6	Confident	5 Å²	5	23.2 Å²	23.2	2%	0.023	11%	0.112	C	C	.	.	H	α-helix	trans	-61.1	-43.8	176.9	-73.7	-71.4	0	0	0	111.5	I348 A376 D764 A770 H772 L796	I348-H768 VanDerWaalsContact CD1-NE2 3.34Å; I348-H768 WeakPolarHBondContact CD1-NE2 3.27Å; A376-H768 WeakPolarHBondContact CB-CE1 3.46Å; D764-H768 PolarHBondContact O-CD2 2.73Å; D764-H768 PolarHBondContact O-N 2.72Å; H768-A770 PolarHBondContact O-N 3.37Å; H768-H772 PolarHBondContact O-CD2 3.11Å; H768-H772 VanDerWaalsContact O-CD2 3.23Å; H768-H772 PolarHBondContact O-N 3.35Å; H768-H772 VanDerWaalsContact O-N 3.17Å; H768-L796 HydrophobicContact CB-CD1 4.4Å; H768-L796 HydrophobicContact CB-CD2 4.34Å
769	M	89.2	Confident	86.1	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.5	-42.9	175.9	-70.4	-59	-64	0	0	112.1	F765 T766 I767 Y773 L788 A792 L796 A836 P841 F844	F765-M769 WeakPolarHBondContact O-CG 3.31Å; T766-M769 PolarHBondContact O-N 3.1Å; I767-M769 VanDerWaalsContact C-N 3.33Å; I767-M769 PolarHBondContact O-N 2.99Å; M769-Y773 WeakPolarHBondContact O-CB 3.29Å; M769-Y773 PolarHBondContact O-N 3.32Å; M769-L788 HydrophobicContact CE-CD1 4.33Å; M769-L788 HydrophobicContact CE-CD2 3.43Å; M769-L788 VanDerWaalsContact CE-CD2 3.43Å; M769-L788 HydrophobicContact CE-CG 3.55Å; M769-L788 HydrophobicContact SD-CG 4.34Å; M769-A792 HydrophobicContact SD-CB 3.79Å; M769-L796 HydrophobicContact CG-CD1 3.64Å; M769-L796 HydrophobicContact SD-CD1 3.88Å; M769-A836 VanDerWaalsContact CE-O 3.28Å; M769-A836 WeakPolarHBondContact CE-O 3.47Å; M769-A836 HydrophobicContact CG-CB 3.93Å; M769-P841 HydrophobicContact CE-CG 3.74Å; M769-F844 HydrophobicContact CB-CE2 4.49Å
770	A	88.8	Confident	85.7	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.008	18%	0.181	C	C	.	.	H	α-helix	trans	-66.5	-45.3	179.9	0	0	0	0	0	112.5	I716 L721 V725 T766 I767 H768 Y773 Y774 F844	I716-A770 HydrophobicContact CD1-CB 4.42Å; L721-A770 HydrophobicContact CD1-CB 4.21Å; L721-A770 HydrophobicContact CD2-CB 4.21Å; L721-A770 HydrophobicContact CG-CB 4.23Å; V725-A770 HydrophobicContact CG2-CB 3.51Å; T766-A770 WeakPolarHBondContact O-CB 3.25Å; T766-A770 PolarHBondContact O-N 3.49Å; I767-A770 PolarHBondContact O-N 2.98Å; H768-A770 PolarHBondContact O-N 3.37Å; A770-Y773 PolarHBondContact O-N 2.97Å; A770-Y774 WeakPolarHBondContact O-CB 3.15Å; A770-Y774 PolarHBondContact O-N 2.95Å; A770-F844 HydrophobicContact CB-CZ 4.05Å
771	Y	84.3	Confident	85.5	Confident	27 Å²	27	40.5 Å²	40.5	11%	0.106	20%	0.197	C	C	.	.	H	α-helix	trans	-61.5	-51.8	-179.4	179.6	-96.6	0	0	0	111.7	E26 E372 I767 Y773 Y774 R775	E26-Y771 PolarHBondContact OE1-OH 2.84Å; E372-Y771 HydrophobicContact CG-CE1 4.18Å; I767-Y771 WeakPolarHBondContact O-CB 3.36Å; I767-Y771 PolarHBondContact O-N 2.7Å; Y771-Y773 VanDerWaalsContact C-N 3.32Å; Y771-Y773 PolarHBondContact O-N 3.28Å; Y771-Y774 PolarHBondContact O-N 3.16Å; Y771-R775 PolarHBondContact O-N 3.43Å; Y771-R775 PolarHBondContact OH-NE 3.19Å; Y771-R775 PolarHBondContact OH-NH1 3.44Å
772	H	84.6	Confident	85.2	Confident	18 Å²	18	42.7 Å²	42.7	8%	0.083	21%	0.207	C	C	.	.	H	α-helix	trans	-68.8	-30.4	178.6	-72.4	-75.1	0	0	0	112.3	E372 H768 C776 L788 A792	E372-H772 IonicContact OE1-CE1 3.06Å; E372-H772 PolarHBondContact OE1-CE1 2.96Å; E372-H772 IonicContact OE1-ND1 3.98Å; E372-H772 PolarHBondContact OE1-ND1 2.96Å; H768-H772 PolarHBondContact O-CD2 3.11Å; H768-H772 VanDerWaalsContact O-CD2 3.23Å; H768-H772 PolarHBondContact O-N 3.35Å; H768-H772 VanDerWaalsContact O-N 3.17Å; H772-C776 VanDerWaalsContact O-CB 3.29Å; H772-C776 WeakPolarHBondContact O-CB 3.3Å; H772-C776 PolarHBondContact O-N 3.22Å; H772-L788 HydrophobicContact CB-CD1 3.51Å; H772-A792 HydrophobicContact CB-CB 4.21Å
773	Y	86.9	Confident	84.9	Confident	30 Å²	30	50.5 Å²	50.5	12%	0.118	24%	0.236	C	C	.	.	H	α-helix	trans	-65.9	-41	173.9	179.2	-98.3	0	0	0	112.6	L721 M769 A770 Y771 R775 K784 M785 L788 F844	L721-Y773 HydrophobicContact CD1-CD1 4.14Å; M769-Y773 WeakPolarHBondContact O-CB 3.29Å; M769-Y773 PolarHBondContact O-N 3.32Å; A770-Y773 PolarHBondContact O-N 2.97Å; Y771-Y773 VanDerWaalsContact C-N 3.32Å; Y771-Y773 PolarHBondContact O-N 3.28Å; Y773-R775 VanDerWaalsContact C-N 3.35Å; Y773-K784 HydrophobicContact CD2-CD 4.22Å; Y773-K784 HydrophobicContact CE2-CD 3.75Å; Y773-K784 VanDerWaalsContact CE2-NZ 3.3Å; Y773-K784 VanDerWaalsContact CZ-NZ 3.33Å; Y773-K784 WeakPolarHBondContact O-CE 3.27Å; Y773-K784 PolarHBondContact O-NZ 3.46Å; Y773-M785 HydrophobicContact CD2-CE 4.49Å; Y773-M785 HydrophobicContact CE2-CE 3.91Å; Y773-L788 HydrophobicContact CD2-CD2 4.06Å; Y773-F844 HydrophobicContact CD1-CB 4.18Å; Y773-F844 AromaticContact CD1-CD2 3.84Å; Y773-F844 HydrophobicContact CD1-CD2 3.84Å; Y773-F844 HydrophobicContact CD1-CE2 4.43Å; Y773-F844 HydrophobicContact CD1-CG 4.05Å; Y773-F844 HydrophobicContact CD2-CB 4.24Å; Y773-F844 AromaticContact CD2-CD2 3.86Å; Y773-F844 HydrophobicContact CD2-CD2 3.86Å; Y773-F844 HydrophobicContact CD2-CG 4.45Å; Y773-F844 HydrophobicContact CE1-CB 3.79Å; Y773-F844 HydrophobicContact CE1-CD2 4.33Å; Y773-F844 HydrophobicContact CE1-CG 4.13Å; Y773-F844 HydrophobicContact CE2-CB 3.86Å; Y773-F844 HydrophobicContact CE2-CD2 4.35Å; Y773-F844 HydrophobicContact CG-CB 4.39Å; Y773-F844 AromaticContact CG-CD2 3.58Å; Y773-F844 HydrophobicContact CG-CD2 3.58Å; Y773-F844 HydrophobicContact CG-CE2 4.14Å; Y773-F844 HydrophobicContact CG-CG 4.22Å; Y773-F844 PolarHBondContact OH-O 3.19Å
774	Y	83.6	Confident	84.8	Confident	120 Å²	120	51.9 Å²	51.9	47%	0.471	24%	0.242	S	C	.	.	H	α-helix	trans	-64.2	-39	177.9	178.6	-104.9	0	0	0	111.9	K718 L721 A770 Y771	K718-Y774 HydrophobicContact CB-CE2 4.45Å; L721-Y774 HydrophobicContact CD2-CD2 4.49Å; A770-Y774 WeakPolarHBondContact O-CB 3.15Å; A770-Y774 PolarHBondContact O-N 2.95Å; Y771-Y774 PolarHBondContact O-N 3.16Å
775	R	80.3	Confident	84.8	Confident	99 Å²	99	51.7 Å²	51.7	37%	0.374	24%	0.241	S	C	.	.	H	α-helix	trans	-86	-12.8	-178.2	-69.2	-169.5	161	-148.3	-18.8	115.1	D23 E26 Y771 Y773 P777	D23-R775 IonicContact OD1-NH2 3.64Å; E26-R775 VanDerWaalsContact CD-CZ 3.44Å; E26-R775 VanDerWaalsContact CD-NH1 3.25Å; E26-R775 IonicContact OE1-CZ 2.85Å; E26-R775 IonicContact OE1-NE 3.2Å; E26-R775 IonicContact OE1-NH1 3.94Å; E26-R775 PolarHBondContact OE1-NH1 3.07Å; E26-R775 IonicContact OE1-NH2 3.32Å; E26-R775 PolarHBondContact OE1-NH2 3.01Å; E26-R775 IonicContact OE2-CZ 2.61Å; E26-R775 IonicContact OE2-NH1 3.34Å; E26-R775 PolarHBondContact OE2-NH1 3.05Å; E26-R775 IonicContact OE2-NH2 3.08Å; E26-R775 PolarHBondContact OE2-NH2 2.97Å; Y771-R775 PolarHBondContact O-N 3.43Å; Y771-R775 PolarHBondContact OH-NE 3.19Å; Y771-R775 PolarHBondContact OH-NH1 3.44Å; Y773-R775 VanDerWaalsContact C-N 3.35Å; R775-P777 VanDerWaalsContact O-CD 3.28Å; R775-P777 WeakPolarHBondContact O-CD 3.15Å
776	C	81.7	Confident	84.6	Confident	12 Å²	12	52.7 Å²	52.7	8%	0.081	25%	0.246	C	C	.	.			trans	-69.5	117	-176.5	-174.4	0	0	0	0	111.4	H772 V778 K784	H772-C776 VanDerWaalsContact O-CB 3.29Å; H772-C776 WeakPolarHBondContact O-CB 3.3Å; H772-C776 PolarHBondContact O-N 3.22Å; C776-V778 PolarHBondContact O-N 2.94Å; C776-K784 HydrophobicContact CB-CG 4.23Å
777	P	77.3	Confident	84.4	Confident	116 Å²	116	55.4 Å²	55.4	75%	0.753	26%	0.261	S	S	*	.			trans	-76.3	-9.3	-175.1	31.1	-36	0	0	0	113.6	R775	R775-P777 VanDerWaalsContact O-CD 3.28Å; R775-P777 WeakPolarHBondContact O-CD 3.15Å
778	V	81.7	Confident	84.3	Confident	33 Å²	33	55.4 Å²	55.4	20%	0.2	26%	0.26	C	S	.	.			trans	-77.5	125.5	-174.8	-178.6	0	0	0	0	110.3	C776 Q780 R783 K784 L787	C776-V778 PolarHBondContact O-N 2.94Å; V778-Q780 HydrophobicContact CG1-CB 4.46Å; V778-R783 HydrophobicContact CG1-CB 3.95Å; V778-R783 HydrophobicContact CG1-CG 4.01Å; V778-K784 HydrophobicContact CB-CB 4.2Å; V778-K784 HydrophobicContact CB-CG 4.39Å; V778-K784 HydrophobicContact CG1-CB 4.16Å; V778-K784 WeakPolarHBondContact O-CD 3.3Å; V778-K784 VanDerWaalsContact O-CG 3.32Å; V778-K784 WeakPolarHBondContact O-CG 3.45Å; V778-L787 HydrophobicContact CG2-CD2 3.9Å
779	Q	78.6	Confident	84.4	Confident	190 Å²	190	55.4 Å²	55.4	89%	0.888	26%	0.26	S	S	*	.			trans	-86.8	-31.9	177.2	-65.9	-149.1	-4.6	0	0	114.3	T781	Q779-T781 PolarHBondContact O-N 2.99Å
780	Q	81.4	Confident	84.1	Confident	120 Å²	120	57.3 Å²	57.3	56%	0.561	27%	0.271	S	S	*	.	S	Bend	trans	-65.7	117.9	179.8	-175.5	-177.3	5.1	0	0	110.4	V778 E782 R783 K784	V778-Q780 HydrophobicContact CG1-CB 4.46Å; Q780-E782 PolarHBondContact O-N 3.34Å; Q780-R783 HydrophobicContact CB-CB 4.33Å; Q780-R783 HydrophobicContact CG-CB 4.48Å; Q780-R783 PolarHBondContact O-N 2.91Å; Q780-K784 VanDerWaalsContact O-CB 3.28Å; Q780-K784 WeakPolarHBondContact O-CB 3.43Å; Q780-K784 PolarHBondContact O-N 2.9Å
781	T	82.3	Confident	83.8	Confident	56 Å²	56	58.9 Å²	58.9	34%	0.344	28%	0.279	S	S	.	.	H	α-helix	trans	-52.9	-52.8	-171.9	-46.3	0	0	0	0	113.3	W491 Q779 R783 K784 M785 T845	W491-T781 HydrophobicContact CZ3-CG2 4.33Å; Q779-T781 PolarHBondContact O-N 2.99Å; T781-R783 PolarHBondContact O-N 2.86Å; T781-K784 WeakPolarHBondContact O-CB 3.38Å; T781-K784 PolarHBondContact O-N 3.11Å; T781-M785 HydrophobicContact CG2-CE 4.27Å; T781-M785 HydrophobicContact CG2-CG 4.4Å; T781-M785 VanDerWaalsContact O-CG 3.26Å; T781-M785 WeakPolarHBondContact O-CG 3.29Å; T781-M785 PolarHBondContact O-N 3.32Å; T781-T845 HydrophobicContact CG2-CG2 3.54Å
782	E	82.1	Confident	83.9	Confident	58 Å²	58	57.7 Å²	57.7	27%	0.271	28%	0.275	S	S	.	.	H	α-helix	trans	-58.7	-50.3	-178.3	-174.7	-167.8	159.5	0	0	111.5	K488 W491 T492 Q780 K784 M785 L786	K488-E782 WeakPolarHBondContact CE-OE1 3.5Å; W491-E782 HydrophobicContact CB-CG 4.33Å; T492-E782 WeakPolarHBondContact CG2-OE1 3.12Å; Q780-E782 PolarHBondContact O-N 3.34Å; E782-K784 VanDerWaalsContact C-N 3.31Å; E782-K784 PolarHBondContact O-N 3.37Å; E782-M785 PolarHBondContact O-N 3.38Å; E782-L786 HydrophobicContact CG-CD1 4.23Å; E782-L786 WeakPolarHBondContact O-CG 3.37Å; E782-L786 PolarHBondContact O-N 2.98Å
783	R	84.5	Confident	84.1	Confident	163 Å²	163	56.9 Å²	56.9	62%	0.615	27%	0.271	S	S	*	.	H	α-helix	trans	-65.7	-36.5	-179.8	-170.9	177	179.2	173.8	-1.3	111.7	V778 Q780 T781 L787	V778-R783 HydrophobicContact CG1-CB 3.95Å; V778-R783 HydrophobicContact CG1-CG 4.01Å; Q780-R783 HydrophobicContact CB-CB 4.33Å; Q780-R783 HydrophobicContact CG-CB 4.48Å; Q780-R783 PolarHBondContact O-N 2.91Å; T781-R783 PolarHBondContact O-N 2.86Å; R783-L787 WeakPolarHBondContact O-CB 3.3Å; R783-L787 PolarHBondContact O-N 3.3Å
784	K	87.3	Confident	84.1	Confident	30 Å²	30	57 Å²	57	13%	0.13	27%	0.271	C	S	.	.	H	α-helix	trans	-61.3	-46.3	175	-165.9	-175.1	-171.5	-179	0	110.6	Y773 C776 V778 Q780 T781 E782 L787 L788	Y773-K784 HydrophobicContact CD2-CD 4.22Å; Y773-K784 HydrophobicContact CE2-CD 3.75Å; Y773-K784 VanDerWaalsContact CE2-NZ 3.3Å; Y773-K784 VanDerWaalsContact CZ-NZ 3.33Å; Y773-K784 WeakPolarHBondContact O-CE 3.27Å; Y773-K784 PolarHBondContact O-NZ 3.46Å; C776-K784 HydrophobicContact CB-CG 4.23Å; V778-K784 HydrophobicContact CB-CB 4.2Å; V778-K784 HydrophobicContact CB-CG 4.39Å; V778-K784 HydrophobicContact CG1-CB 4.16Å; V778-K784 WeakPolarHBondContact O-CD 3.3Å; V778-K784 VanDerWaalsContact O-CG 3.32Å; V778-K784 WeakPolarHBondContact O-CG 3.45Å; Q780-K784 VanDerWaalsContact O-CB 3.28Å; Q780-K784 WeakPolarHBondContact O-CB 3.43Å; Q780-K784 PolarHBondContact O-N 2.9Å; T781-K784 WeakPolarHBondContact O-CB 3.38Å; T781-K784 PolarHBondContact O-N 3.11Å; E782-K784 VanDerWaalsContact C-N 3.31Å; E782-K784 PolarHBondContact O-N 3.37Å; K784-L787 PolarHBondContact O-N 3.28Å; K784-L788 WeakPolarHBondContact O-CB 3.43Å; K784-L788 PolarHBondContact O-N 3.22Å
785	M	87.4	Confident	84.3	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-70	-39.6	-179.7	-63.5	-51.2	175.6	0	0	112.5	Y487 W491 Y773 T781 E782 L787 L788 F789 P841 T845	Y487-M785 HydrophobicContact CE1-CB 4.3Å; Y487-M785 WeakPolarHBondContact CE1-O 3.41Å; W491-M785 HydrophobicContact CD2-CB 4.1Å; W491-M785 HydrophobicContact CD2-CG 4.07Å; W491-M785 HydrophobicContact CE3-CG 4.25Å; W491-M785 HydrophobicContact CG-CB 4.38Å; W491-M785 HydrophobicContact CH2-CE 4.15Å; W491-M785 HydrophobicContact CH2-CG 3.82Å; W491-M785 HydrophobicContact CH2-SD 4.36Å; W491-M785 HydrophobicContact CZ2-CB 4.1Å; W491-M785 HydrophobicContact CZ2-CG 3.61Å; W491-M785 HydrophobicContact CZ2-SD 4.18Å; W491-M785 HydrophobicContact CZ3-CG 4.13Å; Y773-M785 HydrophobicContact CD2-CE 4.49Å; Y773-M785 HydrophobicContact CE2-CE 3.91Å; T781-M785 HydrophobicContact CG2-CE 4.27Å; T781-M785 HydrophobicContact CG2-CG 4.4Å; T781-M785 VanDerWaalsContact O-CG 3.26Å; T781-M785 WeakPolarHBondContact O-CG 3.29Å; T781-M785 PolarHBondContact O-N 3.32Å; E782-M785 PolarHBondContact O-N 3.38Å; M785-L787 VanDerWaalsContact C-N 3.32Å; M785-L787 PolarHBondContact O-N 3.48Å; M785-L788 PolarHBondContact O-N 2.88Å; M785-L788 HydrophobicContact SD-CD2 4.13Å; M785-F789 WeakPolarHBondContact O-CB 3.31Å; M785-F789 PolarHBondContact O-N 3.29Å; M785-P841 HydrophobicContact CE-CB 4.31Å; M785-P841 VanDerWaalsContact CE-O 3.25Å; M785-P841 WeakPolarHBondContact CE-O 3.35Å; M785-P841 HydrophobicContact SD-CB 3.87Å; M785-T845 HydrophobicContact CE-CG2 3.49Å; M785-T845 VanDerWaalsContact CE-CG2 3.49Å
786	L	87	Confident	84.8	Confident	25 Å²	25	47 Å²	47	13%	0.131	23%	0.234	C	C	.	.	H	α-helix	trans	-62.7	-40.1	174.4	-70.4	175.6	0	0	0	112.2	Y487 K488 E782 F789 D790	Y487-L786 HydrophobicContact CD1-CD2 4.1Å; K488-L786 HydrophobicContact CB-CD2 3.75Å; K488-L786 HydrophobicContact CD-CD1 4.24Å; K488-L786 HydrophobicContact CG-CD1 4.12Å; K488-L786 HydrophobicContact CG-CD2 4.24Å; E782-L786 HydrophobicContact CG-CD1 4.23Å; E782-L786 WeakPolarHBondContact O-CG 3.37Å; E782-L786 PolarHBondContact O-N 2.98Å; L786-F789 PolarHBondContact O-N 3.38Å; L786-D790 PolarHBondContact O-N 3.47Å; L786-D790 VanDerWaalsContact O-N 3.16Å
787	L	86.3	Confident	85.3	Confident	58 Å²	58	47.3 Å²	47.3	30%	0.304	23%	0.234	S	C	.	.	H	α-helix	trans	-67.3	-42.9	174.5	-178.1	59.6	0	0	0	110.9	V778 R783 K784 M785 F789 D790 L791	V778-L787 HydrophobicContact CG2-CD2 3.9Å; R783-L787 WeakPolarHBondContact O-CB 3.3Å; R783-L787 PolarHBondContact O-N 3.3Å; K784-L787 PolarHBondContact O-N 3.28Å; M785-L787 VanDerWaalsContact C-N 3.32Å; M785-L787 PolarHBondContact O-N 3.48Å; L787-F789 VanDerWaalsContact C-N 3.28Å; L787-F789 PolarHBondContact O-N 2.79Å; L787-D790 PolarHBondContact O-N 2.86Å; L787-D790 VanDerWaalsContact O-N 3.12Å; L787-L791 HydrophobicContact CD1-CD1 4.08Å; L787-L791 HydrophobicContact CD1-CD2 4.47Å; L787-L791 HydrophobicContact CD1-CG 4.1Å; L787-L791 HydrophobicContact CD2-CD1 4.48Å; L787-L791 HydrophobicContact CG-CD1 3.81Å; L787-L791 HydrophobicContact CG-CG 4.26Å; L787-L791 VanDerWaalsContact O-CG 3.23Å; L787-L791 WeakPolarHBondContact O-CG 3.37Å; L787-L791 PolarHBondContact O-N 2.82Å
788	L	87.8	Confident	85.8	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-60.3	-38.1	176.4	-174.8	62.5	0	0	0	112.4	M769 H772 Y773 K784 M785 L791 A792 G793	M769-L788 HydrophobicContact CE-CD1 4.33Å; M769-L788 HydrophobicContact CE-CD2 3.43Å; M769-L788 VanDerWaalsContact CE-CD2 3.43Å; M769-L788 HydrophobicContact CE-CG 3.55Å; M769-L788 HydrophobicContact SD-CG 4.34Å; H772-L788 HydrophobicContact CB-CD1 3.51Å; Y773-L788 HydrophobicContact CD2-CD2 4.06Å; K784-L788 WeakPolarHBondContact O-CB 3.43Å; K784-L788 PolarHBondContact O-N 3.22Å; M785-L788 PolarHBondContact O-N 2.88Å; M785-L788 HydrophobicContact SD-CD2 4.13Å; L788-L791 PolarHBondContact O-N 3.17Å; L788-A792 HydrophobicContact CD1-CB 4.42Å; L788-A792 PolarHBondContact O-N 3Å; L788-G793 PolarHBondContact O-N 3.34Å
789	F	88.9	Confident	86.2	Confident	5 Å²	5	41 Å²	41	2%	0.022	19%	0.192	C	C	.	.	I	π-helix	trans	-63.1	-43.3	173.3	178.5	-92.4	0	0	0	112.2	L483 K484 Y487 M785 L786 L787 L791 G793 W794 I797 L837	L483-F789 HydrophobicContact CB-CZ 3.93Å; K484-F789 HydrophobicContact CB-CD1 4.3Å; K484-F789 HydrophobicContact CB-CE1 3.98Å; K484-F789 HydrophobicContact CG-CD1 4.43Å; Y487-F789 HydrophobicContact CD1-CB 3.59Å; Y487-F789 HydrophobicContact CD1-CD1 4.46Å; Y487-F789 AromaticContact CD1-CD2 3.81Å; Y487-F789 HydrophobicContact CD1-CD2 3.81Å; Y487-F789 AromaticContact CD1-CG 3.69Å; Y487-F789 HydrophobicContact CD1-CG 3.69Å; Y487-F789 HydrophobicContact CD2-CD2 4.16Å; Y487-F789 HydrophobicContact CE1-CB 3.51Å; Y487-F789 HydrophobicContact CE1-CD2 4.1Å; Y487-F789 HydrophobicContact CE1-CG 4.04Å; Y487-F789 HydrophobicContact CE2-CD2 4.43Å; Y487-F789 HydrophobicContact CG-CB 4.47Å; Y487-F789 AromaticContact CG-CD2 3.84Å; Y487-F789 HydrophobicContact CG-CD2 3.84Å; Y487-F789 HydrophobicContact CG-CE2 4.33Å; Y487-F789 HydrophobicContact CG-CG 4.12Å; M785-F789 WeakPolarHBondContact O-CB 3.31Å; M785-F789 PolarHBondContact O-N 3.29Å; L786-F789 PolarHBondContact O-N 3.38Å; L787-F789 VanDerWaalsContact C-N 3.28Å; L787-F789 PolarHBondContact O-N 2.79Å; F789-L791 VanDerWaalsContact C-N 3.31Å; F789-L791 PolarHBondContact O-N 2.8Å; F789-G793 CarbonylContact O-C 3.46Å; F789-G793 WeakPolarHBondContact O-CA 3.29Å; F789-G793 PolarHBondContact O-N 3.19Å; F789-G793 VanDerWaalsContact O-N 3.15Å; F789-W794 PolarHBondContact O-N 3.04Å; F789-I797 HydrophobicContact CE2-CD1 3.99Å; F789-I797 HydrophobicContact CZ-CD1 4.19Å; F789-L837 HydrophobicContact CD2-CD2 4.08Å; F789-L837 HydrophobicContact CE2-CD2 4.13Å
790	D	83.6	Confident	86.8	Confident	40 Å²	40	31.9 Å²	31.9	21%	0.214	15%	0.15	C	C	.	.	I	π-helix	trans	-64.7	-36.4	176.5	-66.1	-35.8	0	0	0	112.3	K484 L786 L787	K484-D790 WeakPolarHBondContact CD-OD1 3.24Å; K484-D790 VanDerWaalsContact CE-OD1 3.25Å; K484-D790 WeakPolarHBondContact CE-OD1 3.2Å; K484-D790 WeakPolarHBondContact CE-OD2 3.34Å; K484-D790 IonicContact NZ-OD1 3.97Å; K484-D790 PolarHBondContact NZ-OD1 3.35Å; K484-D790 IonicContact NZ-OD2 2.67Å; K484-D790 PolarHBondContact NZ-OD2 2.99Å; L786-D790 PolarHBondContact O-N 3.47Å; L786-D790 VanDerWaalsContact O-N 3.16Å; L787-D790 PolarHBondContact O-N 2.86Å; L787-D790 VanDerWaalsContact O-N 3.12Å
791	L	82.6	Confident	87.3	Confident	34 Å²	34	30.5 Å²	30.5	18%	0.178	15%	0.145	C	C	.	.	I	π-helix	trans	-81.5	-44.8	-174.2	-65.7	174.1	0	0	0	113.1	Q355 L787 L788 F789	Q355-L791 HydrophobicContact CG-CD2 4.25Å; Q355-L791 PolarHBondContact NE2-O 3.46Å; L787-L791 HydrophobicContact CD1-CD1 4.08Å; L787-L791 HydrophobicContact CD1-CD2 4.47Å; L787-L791 HydrophobicContact CD1-CG 4.1Å; L787-L791 HydrophobicContact CD2-CD1 4.48Å; L787-L791 HydrophobicContact CG-CD1 3.81Å; L787-L791 HydrophobicContact CG-CG 4.26Å; L787-L791 VanDerWaalsContact O-CG 3.23Å; L787-L791 WeakPolarHBondContact O-CG 3.37Å; L787-L791 PolarHBondContact O-N 2.82Å; L788-L791 PolarHBondContact O-N 3.17Å; F789-L791 VanDerWaalsContact C-N 3.31Å; F789-L791 PolarHBondContact O-N 2.8Å
792	A	85.3	Confident	87.7	Confident	3 Å²	3	27.9 Å²	27.9	3%	0.025	13%	0.128	C	C	.	.	I	π-helix	trans	-124	-40.7	-171.5	0	0	0	0	0	112.9	M769 H772 L788 W794 P795 L796	M769-A792 HydrophobicContact SD-CB 3.79Å; H772-A792 HydrophobicContact CB-CB 4.21Å; L788-A792 HydrophobicContact CD1-CB 4.42Å; L788-A792 PolarHBondContact O-N 3Å; A792-W794 PolarHBondContact O-N 3.21Å; A792-P795 WeakPolarHBondContact O-CD 3.18Å; A792-L796 WeakPolarHBondContact O-CB 3.31Å; A792-L796 VanDerWaalsContact O-CG 3.26Å; A792-L796 WeakPolarHBondContact O-CG 3.4Å; A792-L796 PolarHBondContact O-N 2.7Å; A792-L796 VanDerWaalsContact O-N 3.08Å
793	G	88.8	Confident	88.2	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.117	C	C	.	.	I	π-helix	trans	-63.3	-38.3	-175.6	0	0	0	0	0	113.9	L788 F789 I797	L788-G793 PolarHBondContact O-N 3.34Å; F789-G793 CarbonylContact O-C 3.46Å; F789-G793 WeakPolarHBondContact O-CA 3.29Å; F789-G793 PolarHBondContact O-N 3.19Å; F789-G793 VanDerWaalsContact O-N 3.15Å; G793-I797 WeakPolarHBondContact O-CG1 3.45Å; G793-I797 PolarHBondContact O-N 3.2Å
794	W	88.2	Confident	88.6	Confident	34 Å²	34	20 Å²	20	13%	0.129	10%	0.1	C	C	.	.	H	α-helix	trans	-69.1	-51.1	177.8	174.5	-101	0	0	0	113	N477 Q480 L483 F789 A792 L796 I797 E798	N477-W794 HydrophobicContact CB-CZ2 4.43Å; Q480-W794 HydrophobicContact CB-CD2 3.63Å; Q480-W794 HydrophobicContact CB-CE3 3.73Å; Q480-W794 HydrophobicContact CB-CG 4.31Å; Q480-W794 HydrophobicContact CB-CH2 3.99Å; Q480-W794 HydrophobicContact CB-CZ2 3.9Å; Q480-W794 HydrophobicContact CB-CZ3 3.92Å; Q480-W794 HydrophobicContact CG-CB 4.27Å; Q480-W794 HydrophobicContact CG-CD2 3.58Å; Q480-W794 HydrophobicContact CG-CE3 3.87Å; Q480-W794 HydrophobicContact CG-CG 3.76Å; L483-W794 HydrophobicContact CD1-CE3 4.36Å; L483-W794 HydrophobicContact CD1-CZ3 3.67Å; F789-W794 PolarHBondContact O-N 3.04Å; A792-W794 PolarHBondContact O-N 3.21Å; W794-L796 VanDerWaalsContact C-N 3.26Å; W794-L796 PolarHBondContact O-N 3.01Å; W794-I797 PolarHBondContact O-N 3.47Å; W794-I797 VanDerWaalsContact O-N 3.07Å; W794-E798 HydrophobicContact CZ2-CG 4.09Å; W794-E798 VanDerWaalsContact CZ2-OE1 3.25Å; W794-E798 WeakPolarHBondContact CZ2-OE1 3.37Å; W794-E798 PolarHBondContact NE1-OE1 2.82Å; W794-E798 PolarHBondContact O-N 2.68Å; W794-E798 VanDerWaalsContact O-N 3.11Å
795	P	87.8	Confident	88.9	Confident	6 Å²	6	20.4 Å²	20.4	4%	0.039	10%	0.104	C	C	.	.	H	α-helix	trans	-53.7	-40.6	172	-28.8	35.2	0	0	0	113.6	A351 A792 I797 E798 G799	A351-P795 HydrophobicContact CB-CB 4.27Å; A351-P795 HydrophobicContact CB-CG 3.56Å; A792-P795 WeakPolarHBondContact O-CD 3.18Å; P795-I797 VanDerWaalsContact C-N 3.31Å; P795-I797 PolarHBondContact O-N 3.47Å; P795-E798 WeakPolarHBondContact O-CB 3.48Å; P795-E798 PolarHBondContact O-N 2.95Å; P795-E798 VanDerWaalsContact O-N 3.1Å; P795-G799 PolarHBondContact O-N 3.41Å
796	L	90.6	Very high	89	Confident	2 Å²	2	20.4 Å²	20.4	1%	0.01	10%	0.104	C	C	.	.	H	α-helix	trans	-63.5	-34.3	177.4	-73.5	171.9	0	0	0	113.2	F765 H768 M769 A792 W794 G800 L833 A836	F765-L796 HydrophobicContact CD1-CB 4.48Å; F765-L796 HydrophobicContact CD1-CD2 4.02Å; H768-L796 HydrophobicContact CB-CD1 4.4Å; H768-L796 HydrophobicContact CB-CD2 4.34Å; M769-L796 HydrophobicContact CG-CD1 3.64Å; M769-L796 HydrophobicContact SD-CD1 3.88Å; A792-L796 WeakPolarHBondContact O-CB 3.31Å; A792-L796 VanDerWaalsContact O-CG 3.26Å; A792-L796 WeakPolarHBondContact O-CG 3.4Å; A792-L796 PolarHBondContact O-N 2.7Å; A792-L796 VanDerWaalsContact O-N 3.08Å; W794-L796 VanDerWaalsContact C-N 3.26Å; W794-L796 PolarHBondContact O-N 3.01Å; L796-G800 PolarHBondContact O-N 3.17Å; L796-L833 HydrophobicContact CB-CD2 4.47Å; L796-L833 WeakPolarHBondContact O-CD2 3.34Å; L796-A836 HydrophobicContact CD1-CB 3.98Å
797	I	91.5	Very high	89.3	Confident	19 Å²	19	19.2 Å²	19.2	10%	0.097	10%	0.098	C	C	.	.	H	α-helix	trans	-68	-41	173.4	-67.5	166	0	0	0	110.2	L483 F789 G793 W794 P795 G800 M801 L833 L837	L483-I797 HydrophobicContact CD1-CD1 4.42Å; F789-I797 HydrophobicContact CE2-CD1 3.99Å; F789-I797 HydrophobicContact CZ-CD1 4.19Å; G793-I797 WeakPolarHBondContact O-CG1 3.45Å; G793-I797 PolarHBondContact O-N 3.2Å; W794-I797 PolarHBondContact O-N 3.47Å; W794-I797 VanDerWaalsContact O-N 3.07Å; P795-I797 VanDerWaalsContact C-N 3.31Å; P795-I797 PolarHBondContact O-N 3.47Å; I797-G800 PolarHBondContact O-N 3.22Å; I797-M801 HydrophobicContact CG2-CG 4.48Å; I797-M801 HydrophobicContact CG2-SD 4.28Å; I797-M801 WeakPolarHBondContact O-CB 3.39Å; I797-M801 VanDerWaalsContact O-CG 3.3Å; I797-M801 WeakPolarHBondContact O-CG 3.48Å; I797-M801 PolarHBondContact O-N 3.47Å; I797-L833 HydrophobicContact CG1-CD2 4Å; I797-L837 HydrophobicContact CD1-CD1 3.8Å; I797-L837 HydrophobicContact CD1-CD2 4.45Å; I797-L837 HydrophobicContact CG1-CD1 3.88Å
798	E	88.8	Confident	89.6	Confident	15 Å²	15	19.7 Å²	19.7	7%	0.07	10%	0.1	C	C	.	.	H	α-helix	trans	-62.7	-47	176.1	-65.2	177.6	154.5	0	0	111.2	V288 F347 W794 P795 M801 C802	V288-E798 VanDerWaalsContact CG1-CD 3.43Å; V288-E798 HydrophobicContact CG1-CG 3.9Å; V288-E798 WeakPolarHBondContact CG1-OE1 3.37Å; F347-E798 HydrophobicContact CD1-CB 4Å; F347-E798 HydrophobicContact CD2-CB 4.46Å; F347-E798 HydrophobicContact CE1-CB 4.28Å; F347-E798 HydrophobicContact CG-CB 4.1Å; W794-E798 HydrophobicContact CZ2-CG 4.09Å; W794-E798 VanDerWaalsContact CZ2-OE1 3.25Å; W794-E798 WeakPolarHBondContact CZ2-OE1 3.37Å; W794-E798 PolarHBondContact NE1-OE1 2.82Å; W794-E798 PolarHBondContact O-N 2.68Å; W794-E798 VanDerWaalsContact O-N 3.11Å; P795-E798 WeakPolarHBondContact O-CB 3.48Å; P795-E798 PolarHBondContact O-N 2.95Å; P795-E798 VanDerWaalsContact O-N 3.1Å; E798-M801 PolarHBondContact O-N 3.24Å; E798-C802 WeakPolarHBondContact O-CB 3.46Å; E798-C802 PolarHBondContact O-N 2.89Å
799	G	89.2	Confident	89.7	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-60.8	-45.3	173.9	0	0	0	0	0	112.9	D344 P795 M801 C802 T803	D344-G799 WeakPolarHBondContact OD1-CA 3.17Å; P795-G799 PolarHBondContact O-N 3.41Å; G799-M801 PolarHBondContact O-N 3.34Å; G799-C802 VanDerWaalsContact O-CB 3.29Å; G799-C802 WeakPolarHBondContact O-CB 3.13Å; G799-C802 PolarHBondContact O-N 3.04Å; G799-C802 VanDerWaalsContact O-N 3.17Å; G799-T803 WeakPolarHBondContact O-CG2 3.35Å; G799-T803 PolarHBondContact O-N 3.46Å; G799-T803 PolarHBondContact O-OG1 3.04Å; G799-T803 VanDerWaalsContact O-OG1 3.09Å
800	G	92	Very high	89.8	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-60.8	-40.5	173.7	0	0	0	0	0	113.3	L796 I797 T803 L804 V829	L796-G800 PolarHBondContact O-N 3.17Å; I797-G800 PolarHBondContact O-N 3.22Å; G800-T803 WeakPolarHBondContact CA-OG1 3.29Å; G800-T803 PolarHBondContact O-OG1 3.41Å; G800-L804 WeakPolarHBondContact O-CG 3.45Å; G800-L804 PolarHBondContact O-N 2.94Å; G800-L804 VanDerWaalsContact O-N 3.15Å; G800-V829 WeakPolarHBondContact O-CG1 3.45Å
801	M	92	Very high	90.1	Very high	91 Å²	91	20.9 Å²	20.9	45%	0.448	11%	0.109	S	C	.	.	H	α-helix	trans	-68.7	-36.7	174.5	-74.9	-175.6	65.5	0	0	112.2	L284 I797 E798 G799 L805	L284-M801 HydrophobicContact CD1-CE 4.19Å; I797-M801 HydrophobicContact CG2-CG 4.48Å; I797-M801 HydrophobicContact CG2-SD 4.28Å; I797-M801 WeakPolarHBondContact O-CB 3.39Å; I797-M801 VanDerWaalsContact O-CG 3.3Å; I797-M801 WeakPolarHBondContact O-CG 3.48Å; I797-M801 PolarHBondContact O-N 3.47Å; E798-M801 PolarHBondContact O-N 3.24Å; G799-M801 PolarHBondContact O-N 3.34Å; M801-L805 WeakPolarHBondContact O-CB 3.45Å; M801-L805 WeakPolarHBondContact O-CG 3.42Å; M801-L805 PolarHBondContact O-N 2.81Å
802	C	91	Very high	90.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.4	-51.6	174.8	179.7	0	0	0	0	111.1	L281 L284 V343 F347 E798 G799 L804 L805 A806	L281-C802 HydrophobicContact CD2-CB 4.38Å; L281-C802 WeakPolarHBondContact CD2-O 3.31Å; L281-C802 WeakPolarHBondContact CD2-SG 3.34Å; L284-C802 HydrophobicContact CD2-CB 3.93Å; V343-C802 VanDerWaalsContact CB-SG 3.57Å; V343-C802 WeakPolarHBondContact CG1-SG 3.25Å; F347-C802 HydrophobicContact CE2-CB 3.87Å; E798-C802 WeakPolarHBondContact O-CB 3.46Å; E798-C802 PolarHBondContact O-N 2.89Å; G799-C802 VanDerWaalsContact O-CB 3.29Å; G799-C802 WeakPolarHBondContact O-CB 3.13Å; G799-C802 PolarHBondContact O-N 3.04Å; G799-C802 VanDerWaalsContact O-N 3.17Å; C802-L804 VanDerWaalsContact C-N 3.33Å; C802-L804 PolarHBondContact O-N 3.3Å; C802-L805 PolarHBondContact O-N 3.34Å; C802-L805 VanDerWaalsContact O-N 3.13Å; C802-A806 WeakPolarHBondContact O-CB 3.43Å; C802-A806 PolarHBondContact O-N 3.47Å
803	T	91.4	Very high	90.4	Very high	5 Å²	5	25.3 Å²	25.3	3%	0.031	13%	0.127	C	C	.	.	H	α-helix	trans	-60.9	-40.4	-179.9	50.2	0	0	0	0	112.4	A340 G799 G800 M807 V829	A340-T803 HydrophobicContact CB-CG2 4Å; G799-T803 WeakPolarHBondContact O-CG2 3.35Å; G799-T803 PolarHBondContact O-N 3.46Å; G799-T803 PolarHBondContact O-OG1 3.04Å; G799-T803 VanDerWaalsContact O-OG1 3.09Å; G800-T803 WeakPolarHBondContact CA-OG1 3.29Å; G800-T803 PolarHBondContact O-OG1 3.41Å; T803-M807 WeakPolarHBondContact O-CG 3.36Å; T803-M807 PolarHBondContact O-N 3.04Å; T803-V829 WeakPolarHBondContact OG1-CG2 3.37Å
804	L	93.2	Very high	90.3	Very high	51 Å²	51	27.2 Å²	27.2	27%	0.267	14%	0.139	S	C	.	.	H	α-helix	trans	-63	-45.4	172.7	-73.2	172.4	0	0	0	112.8	G800 C802 M807 L808 V826 V829	G800-L804 WeakPolarHBondContact O-CG 3.45Å; G800-L804 PolarHBondContact O-N 2.94Å; G800-L804 VanDerWaalsContact O-N 3.15Å; C802-L804 VanDerWaalsContact C-N 3.33Å; C802-L804 PolarHBondContact O-N 3.3Å; L804-M807 PolarHBondContact O-N 3.39Å; L804-L808 WeakPolarHBondContact O-CB 3.17Å; L804-L808 PolarHBondContact O-N 3.01Å; L804-V826 HydrophobicContact CD2-CB 4.35Å; L804-V826 HydrophobicContact CD2-CG2 3.84Å; L804-V829 HydrophobicContact CD1-CB 4.32Å; L804-V829 HydrophobicContact CD1-CG1 3.71Å; L804-V829 HydrophobicContact CD2-CB 4.13Å; L804-V829 HydrophobicContact CD2-CG1 4.42Å; L804-V829 HydrophobicContact CD2-CG2 4.27Å; L804-V829 HydrophobicContact CG-CB 4.03Å; L804-V829 HydrophobicContact CG-CG1 3.85Å; L804-V829 HydrophobicContact CG-CG2 4.09Å
805	L	92.9	Very high	90.2	Very high	39 Å²	39	25.8 Å²	25.8	20%	0.204	13%	0.134	C	C	.	.	H	α-helix	trans	-71.6	-35.3	-177	-77	171.6	0	0	0	112.9	L281 L284 M801 C802 M807 L808	L281-L805 HydrophobicContact CD2-CB 4.23Å; L284-L805 HydrophobicContact CB-CD1 3.95Å; L284-L805 HydrophobicContact CD1-CD1 3.82Å; L284-L805 HydrophobicContact CD2-CD1 3.92Å; L284-L805 HydrophobicContact CG-CD1 4.1Å; M801-L805 WeakPolarHBondContact O-CB 3.45Å; M801-L805 WeakPolarHBondContact O-CG 3.42Å; M801-L805 PolarHBondContact O-N 2.81Å; C802-L805 PolarHBondContact O-N 3.34Å; C802-L805 VanDerWaalsContact O-N 3.13Å; L805-M807 VanDerWaalsContact C-N 3.29Å; L805-M807 PolarHBondContact O-N 3.42Å; L805-L808 HydrophobicContact CD2-CD2 3.92Å; L805-L808 PolarHBondContact O-N 3.39Å
806	A	90.7	Very high	90	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-57.7	-45.8	172.9	0	0	0	0	0	110.8	S277 L281 A340 C802 S809	S277-A806 WeakPolarHBondContact CB-O 3.5Å; L281-A806 HydrophobicContact CD1-CB 4.02Å; L281-A806 HydrophobicContact CD2-CB 4.21Å; L281-A806 HydrophobicContact CG-CB 4.38Å; A340-A806 HydrophobicContact CB-CB 3.68Å; C802-A806 WeakPolarHBondContact O-CB 3.43Å; C802-A806 PolarHBondContact O-N 3.47Å; A806-S809 PolarHBondContact O-OG 2.98Å
807	M	92.2	Very high	89.8	Confident	1 Å²	1	28 Å²	28	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-84.8	-16	-177.3	-64.5	-65.2	-80.5	0	0	113.8	V333 F336 I337 T803 L804 L805 S809 L810 F821 F822 V825	V333-M807 HydrophobicContact CG1-CE 4.18Å; F336-M807 HydrophobicContact CB-SD 3.7Å; I337-M807 HydrophobicContact CD1-CE 4.39Å; I337-M807 HydrophobicContact CG1-CE 3.73Å; I337-M807 HydrophobicContact CG1-SD 3.84Å; T803-M807 WeakPolarHBondContact O-CG 3.36Å; T803-M807 PolarHBondContact O-N 3.04Å; L804-M807 PolarHBondContact O-N 3.39Å; L805-M807 VanDerWaalsContact C-N 3.29Å; L805-M807 PolarHBondContact O-N 3.42Å; M807-S809 PolarHBondContact O-N 3.49Å; M807-S809 VanDerWaalsContact O-N 3.15Å; M807-L810 HydrophobicContact CE-CD1 3.39Å; M807-L810 VanDerWaalsContact O-CB 3.32Å; M807-L810 WeakPolarHBondContact O-CB 3.38Å; M807-L810 PolarHBondContact O-N 2.87Å; M807-L810 HydrophobicContact SD-CD1 3.64Å; M807-F821 HydrophobicContact CE-CB 3.82Å; M807-F822 HydrophobicContact CB-CD2 4.24Å; M807-F822 WeakPolarHBondContact O-CD2 3.41Å; M807-V825 HydrophobicContact CB-CG1 4.39Å; M807-V825 HydrophobicContact CE-CG2 4.03Å; M807-V825 HydrophobicContact CG-CB 4.34Å; M807-V825 HydrophobicContact CG-CG1 4.11Å; M807-V825 HydrophobicContact CG-CG2 4.1Å
808	L	93.1	Very high	89.7	Confident	68 Å²	68	27.2 Å²	27.2	36%	0.356	14%	0.142	S	C	.	.	H	α-helix	trans	-56.8	-33.2	-179.1	-176.3	62.9	0	0	0	112.8	L280 L804 L805 L810 V811 F822	L280-L808 HydrophobicContact CD1-CB 4.48Å; L280-L808 HydrophobicContact CD1-CD2 4.32Å; L804-L808 WeakPolarHBondContact O-CB 3.17Å; L804-L808 PolarHBondContact O-N 3.01Å; L805-L808 HydrophobicContact CD2-CD2 3.92Å; L805-L808 PolarHBondContact O-N 3.39Å; L808-L810 PolarHBondContact O-N 3.26Å; L808-V811 HydrophobicContact CD1-CG2 4.23Å; L808-V811 WeakPolarHBondContact O-CB 3.3Å; L808-V811 WeakPolarHBondContact O-CG2 3.49Å; L808-V811 PolarHBondContact O-N 3.17Å; L808-F822 HydrophobicContact CD1-CE2 4.24Å; L808-F822 HydrophobicContact CD1-CZ 4.35Å
809	S	90.2	Very high	89.7	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-59.4	-29.1	177.1	65.3	0	0	0	0	113.3	F336 A806 M807 V811 F812	F336-S809 WeakPolarHBondContact CD1-OG 3.46Å; F336-S809 VanDerWaalsContact CE1-OG 3.29Å; F336-S809 WeakPolarHBondContact CE1-OG 3.35Å; A806-S809 PolarHBondContact O-OG 2.98Å; M807-S809 PolarHBondContact O-N 3.49Å; M807-S809 VanDerWaalsContact O-N 3.15Å; S809-V811 VanDerWaalsContact C-N 3.26Å; S809-V811 PolarHBondContact O-N 3.32Å; S809-F812 PolarHBondContact O-N 3.21Å
810	L	89.8	Confident	89.8	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-72.3	-17.6	-179.7	-63.6	177.3	0	0	0	113.4	V333 F336 M807 L808 F812 V813 A818	V333-L810 HydrophobicContact CG1-CD1 3.78Å; F336-L810 HydrophobicContact CB-CD1 4.34Å; F336-L810 HydrophobicContact CD1-CD2 4.06Å; F336-L810 HydrophobicContact CD1-CG 4.22Å; F336-L810 HydrophobicContact CD2-CD2 4.13Å; F336-L810 HydrophobicContact CE1-CD2 4.02Å; F336-L810 HydrophobicContact CE2-CD2 4.1Å; F336-L810 HydrophobicContact CG-CD1 4.42Å; F336-L810 HydrophobicContact CG-CD2 4.11Å; F336-L810 HydrophobicContact CG-CG 4.37Å; F336-L810 HydrophobicContact CZ-CD2 4.04Å; M807-L810 HydrophobicContact CE-CD1 3.39Å; M807-L810 VanDerWaalsContact O-CB 3.32Å; M807-L810 WeakPolarHBondContact O-CB 3.38Å; M807-L810 PolarHBondContact O-N 2.87Å; M807-L810 HydrophobicContact SD-CD1 3.64Å; L808-L810 PolarHBondContact O-N 3.26Å; L810-F812 PolarHBondContact O-N 2.8Å; L810-V813 HydrophobicContact CD2-CG2 4.25Å; L810-V813 WeakPolarHBondContact O-CB 3.3Å; L810-V813 PolarHBondContact O-N 2.94Å; L810-A818 HydrophobicContact CB-CB 4.29Å
811	V	90.6	Very high	89.8	Confident	71 Å²	71	28.7 Å²	28.7	43%	0.43	15%	0.152	S	C	.	.	G	3₁₀ helix	trans	-60.9	-29.3	174.6	178.6	0	0	0	0	111.5	L808 S809 V813 F822	L808-V811 HydrophobicContact CD1-CG2 4.23Å; L808-V811 WeakPolarHBondContact O-CB 3.3Å; L808-V811 WeakPolarHBondContact O-CG2 3.49Å; L808-V811 PolarHBondContact O-N 3.17Å; S809-V811 VanDerWaalsContact C-N 3.26Å; S809-V811 PolarHBondContact O-N 3.32Å; V811-V813 VanDerWaalsContact C-N 3.31Å; V811-F822 HydrophobicContact CG2-CD1 3.57Å; V811-F822 HydrophobicContact CG2-CD2 3.61Å; V811-F822 HydrophobicContact CG2-CE1 3.4Å; V811-F822 HydrophobicContact CG2-CE2 3.46Å; V811-F822 VanDerWaalsContact CG2-CE2 3.46Å; V811-F822 HydrophobicContact CG2-CG 3.66Å; V811-F822 HydrophobicContact CG2-CZ 3.34Å
812	F	88.4	Confident	89.9	Confident	128 Å²	128	26.4 Å²	26.4	56%	0.561	14%	0.14	S	C	*	.	G	3₁₀ helix	trans	-82.7	-9.2	178.2	-59.1	-67.7	0	0	0	113.3	Y273 S809 L810 P814	Y273-F812 HydrophobicContact CD1-CB 4.22Å; Y273-F812 HydrophobicContact CE1-CB 3.61Å; Y273-F812 HydrophobicContact CE1-CG 4.31Å; Y273-F812 HydrophobicContact CE2-CB 4.36Å; S809-F812 PolarHBondContact O-N 3.21Å; L810-F812 PolarHBondContact O-N 2.8Å; F812-P814 WeakPolarHBondContact O-CD 3.49Å
813	V	86.9	Confident	90	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.012	15%	0.152	C	C	.	.	S	Bend	trans	-82.3	116.6	175.9	-178.6	0	0	0	0	107.7	A270 Y273 L810 V811 S815 A818	A270-V813 HydrophobicContact CB-CG1 4.36Å; A270-V813 HydrophobicContact CB-CG2 4.2Å; Y273-V813 HydrophobicContact CD2-CG2 3.66Å; Y273-V813 HydrophobicContact CE2-CG2 4.14Å; Y273-V813 HydrophobicContact CG-CG2 4.44Å; L810-V813 HydrophobicContact CD2-CG2 4.25Å; L810-V813 WeakPolarHBondContact O-CB 3.3Å; L810-V813 PolarHBondContact O-N 2.94Å; V811-V813 VanDerWaalsContact C-N 3.31Å; V813-S815 PolarHBondContact O-N 2.98Å; V813-A818 HydrophobicContact CB-CB 3.91Å; V813-A818 HydrophobicContact CG1-CB 3.98Å
814	P	86.2	Confident	90.1	Very high	40 Å²	40	29.5 Å²	29.5	26%	0.26	15%	0.151	S	C	.	.			trans	-76.9	55.7	-177.7	31	-32.7	0	0	0	110.8	V529 A530 F812	V529-P814 CarbonylContact C-O 3.55Å; V529-P814 VanDerWaalsContact CA-O 3.23Å; V529-P814 WeakPolarHBondContact CA-O 3.4Å; V529-P814 HydrophobicContact CG1-CB 4.25Å; V529-P814 HydrophobicContact CG1-CG 3.86Å; V529-P814 WeakPolarHBondContact CG1-O 3.38Å; A530-P814 HydrophobicContact CB-CB 4.07Å; A530-P814 PolarHBondContact N-O 3.03Å; F812-P814 WeakPolarHBondContact O-CD 3.49Å
815	S	85.4	Confident	90.1	Very high	3 Å²	3	27.3 Å²	27.3	2%	0.021	14%	0.139	C	C	.	.	B	Isolated β-bridge	trans	-129.5	137.2	179.5	-179.5	0	0	0	0	110.2	T266 V813 V817 A818 T819	T266-S815 WeakPolarHBondContact CG2-OG 3.4Å; T266-S815 PolarHBondContact OG1-OG 3.21Å; V813-S815 PolarHBondContact O-N 2.98Å; S815-V817 VanDerWaalsContact C-N 3.27Å; S815-V817 PolarHBondContact O-N 3.48Å; S815-V817 PolarHBondContact OG-N 3.4Å; S815-A818 PolarHBondContact O-N 3.32Å; S815-T819 WeakPolarHBondContact O-CB 3.35Å; S815-T819 PolarHBondContact O-N 2.9Å; S815-T819 PolarHBondContact O-OG1 2.91Å
816	N	84.3	Confident	90.2	Very high	54 Å²	54	27 Å²	27	29%	0.289	14%	0.139	S	C	.	.	H	α-helix	trans	-62.5	-36.8	174.8	-80	-20.1	0	0	0	111.1	G525 H526 T819 V820	G525-N816 PolarHBondContact O-ND2 2.99Å; H526-N816 WeakPolarHBondContact O-CB 3.44Å; N816-T819 WeakPolarHBondContact O-CB 3.35Å; N816-T819 PolarHBondContact O-N 3.35Å; N816-V820 WeakPolarHBondContact O-CG2 3.26Å; N816-V820 PolarHBondContact O-N 3.28Å
817	V	86.9	Confident	90.5	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.006	14%	0.144	C	C	.	.	H	α-helix	trans	-57.4	-53.9	176.1	175	0	0	0	0	110.8	L527 T750 S815 T819 V820 F821	L527-V817 HydrophobicContact CD2-CG2 4.09Å; T750-V817 HydrophobicContact CG2-CB 4.3Å; T750-V817 HydrophobicContact CG2-CG1 3.86Å; T750-V817 HydrophobicContact CG2-CG2 4.37Å; S815-V817 VanDerWaalsContact C-N 3.27Å; S815-V817 PolarHBondContact O-N 3.48Å; S815-V817 PolarHBondContact OG-N 3.4Å; V817-T819 VanDerWaalsContact C-N 3.27Å; V817-T819 PolarHBondContact O-N 3.39Å; V817-V820 PolarHBondContact O-N 3.19Å; V817-F821 HydrophobicContact CG1-CD2 4.02Å; V817-F821 HydrophobicContact CG1-CE2 3.79Å; V817-F821 WeakPolarHBondContact O-CD2 3.28Å; V817-F821 PolarHBondContact O-N 2.91Å
818	A	88.8	Confident	90.6	Very high	2 Å²	2	27.9 Å²	27.9	2%	0.017	14%	0.144	C	C	.	.	H	α-helix	trans	-59.7	-39.1	177.7	0	0	0	0	0	112	L810 V813 S815 F821 F822	L810-A818 HydrophobicContact CB-CB 4.29Å; V813-A818 HydrophobicContact CB-CB 3.91Å; V813-A818 HydrophobicContact CG1-CB 3.98Å; S815-A818 PolarHBondContact O-N 3.32Å; A818-F821 PolarHBondContact O-N 3.33Å; A818-F822 WeakPolarHBondContact O-CB 3.08Å; A818-F822 PolarHBondContact O-N 3.35Å
819	T	89.6	Confident	90.7	Very high	39 Å²	39	24.8 Å²	24.8	24%	0.239	13%	0.128	C	C	.	.	H	α-helix	trans	-64.2	-42.3	177.9	-59.4	0	0	0	0	112.2	S815 N816 V817 F822 R823	S815-T819 WeakPolarHBondContact O-CB 3.35Å; S815-T819 PolarHBondContact O-N 2.9Å; S815-T819 PolarHBondContact O-OG1 2.91Å; N816-T819 WeakPolarHBondContact O-CB 3.35Å; N816-T819 PolarHBondContact O-N 3.35Å; V817-T819 VanDerWaalsContact C-N 3.27Å; V817-T819 PolarHBondContact O-N 3.39Å; T819-F822 PolarHBondContact O-N 3.17Å; T819-R823 HydrophobicContact CG2-CG 4.3Å; T819-R823 WeakPolarHBondContact O-CB 3.26Å; T819-R823 VanDerWaalsContact O-CG 3.26Å; T819-R823 WeakPolarHBondContact O-CG 3.36Å; T819-R823 PolarHBondContact O-N 2.88Å
820	V	91.1	Very high	91	Very high	8 Å²	8	28.2 Å²	28.2	5%	0.048	15%	0.149	C	C	.	.	H	α-helix	trans	-62.3	-47.3	178.1	169.6	0	0	0	0	110.9	L745 T750 T751 N816 V817 R823 T824	L745-V820 HydrophobicContact CD1-CG2 4.41Å; L745-V820 HydrophobicContact CD2-CG2 3.78Å; T750-V820 HydrophobicContact CG2-CB 4.28Å; T750-V820 HydrophobicContact CG2-CG1 4.18Å; T751-V820 HydrophobicContact CG2-CG1 3.72Å; T751-V820 HydrophobicContact CG2-CG2 4.48Å; N816-V820 WeakPolarHBondContact O-CG2 3.26Å; N816-V820 PolarHBondContact O-N 3.28Å; V817-V820 PolarHBondContact O-N 3.19Å; V820-R823 PolarHBondContact O-N 3.45Å; V820-T824 WeakPolarHBondContact O-CB 3.38Å; V820-T824 PolarHBondContact O-N 3.18Å; V820-T824 PolarHBondContact O-OG1 2.8Å
821	F	91.9	Very high	91.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-60.9	-47.7	176.9	-79.4	-70.8	0	0	0	111.7	V333 I337 F402 T750 I753 S754 M757 M807 V817 A818 T824 V825	V333-F821 HydrophobicContact CB-CD2 4.26Å; V333-F821 HydrophobicContact CB-CE2 4.34Å; V333-F821 HydrophobicContact CG1-CB 4.24Å; V333-F821 HydrophobicContact CG1-CD1 4.49Å; V333-F821 HydrophobicContact CG1-CD2 3.96Å; V333-F821 HydrophobicContact CG1-CE2 4.46Å; V333-F821 HydrophobicContact CG1-CG 3.99Å; V333-F821 HydrophobicContact CG2-CD2 4.05Å; V333-F821 HydrophobicContact CG2-CE2 4.21Å; I337-F821 HydrophobicContact CD1-CD1 3.88Å; I337-F821 HydrophobicContact CD1-CE1 4.01Å; F402-F821 HydrophobicContact CE2-CE1 4.34Å; F402-F821 HydrophobicContact CE2-CZ 4.16Å; F402-F821 HydrophobicContact CZ-CE1 4.31Å; T750-F821 HydrophobicContact CG2-CD2 4.32Å; T750-F821 HydrophobicContact CG2-CE2 3.83Å; T750-F821 HydrophobicContact CG2-CZ 4.38Å; I753-F821 HydrophobicContact CB-CE1 4.46Å; I753-F821 HydrophobicContact CB-CZ 4.24Å; I753-F821 HydrophobicContact CG2-CE1 3.82Å; I753-F821 HydrophobicContact CG2-CZ 3.77Å; S754-F821 VanDerWaalsContact OG-CD1 3.32Å; S754-F821 WeakPolarHBondContact OG-CD1 3.37Å; S754-F821 WeakPolarHBondContact OG-CE1 3.45Å; M757-F821 HydrophobicContact CE-CD1 4.25Å; M757-F821 HydrophobicContact SD-CD1 4.25Å; M807-F821 HydrophobicContact CE-CB 3.82Å; V817-F821 HydrophobicContact CG1-CD2 4.02Å; V817-F821 HydrophobicContact CG1-CE2 3.79Å; V817-F821 WeakPolarHBondContact O-CD2 3.28Å; V817-F821 PolarHBondContact O-N 2.91Å; A818-F821 PolarHBondContact O-N 3.33Å; F821-T824 PolarHBondContact O-N 3.48Å; F821-V825 WeakPolarHBondContact O-CG2 3.39Å; F821-V825 PolarHBondContact O-N 3.1Å
822	F	92.7	Very high	91.5	Very high	42 Å²	42	25.5 Å²	25.5	18%	0.184	13%	0.132	C	C	.	.	H	α-helix	trans	-59.8	-49.1	178.3	174.8	-101.9	0	0	0	112.1	M807 L808 V811 A818 T819 T824 V825 V826	M807-F822 HydrophobicContact CB-CD2 4.24Å; M807-F822 WeakPolarHBondContact O-CD2 3.41Å; L808-F822 HydrophobicContact CD1-CE2 4.24Å; L808-F822 HydrophobicContact CD1-CZ 4.35Å; V811-F822 HydrophobicContact CG2-CD1 3.57Å; V811-F822 HydrophobicContact CG2-CD2 3.61Å; V811-F822 HydrophobicContact CG2-CE1 3.4Å; V811-F822 HydrophobicContact CG2-CE2 3.46Å; V811-F822 VanDerWaalsContact CG2-CE2 3.46Å; V811-F822 HydrophobicContact CG2-CG 3.66Å; V811-F822 HydrophobicContact CG2-CZ 3.34Å; A818-F822 WeakPolarHBondContact O-CB 3.08Å; A818-F822 PolarHBondContact O-N 3.35Å; T819-F822 PolarHBondContact O-N 3.17Å; F822-T824 VanDerWaalsContact C-N 3.28Å; F822-T824 PolarHBondContact O-N 3.18Å; F822-V825 PolarHBondContact O-N 3.14Å; F822-V826 HydrophobicContact CD1-CG2 4.24Å; F822-V826 HydrophobicContact CD2-CG2 4.31Å; F822-V826 HydrophobicContact CE1-CG2 3.75Å; F822-V826 HydrophobicContact CE2-CG2 3.82Å; F822-V826 HydrophobicContact CZ-CG2 3.52Å; F822-V826 WeakPolarHBondContact O-CG2 3.4Å; F822-V826 PolarHBondContact O-N 3.1Å
823	R	93.6	Very high	91.8	Very high	71 Å²	71	21 Å²	21	27%	0.268	11%	0.113	S	C	.	.	H	α-helix	trans	-58.6	-40.6	177.7	-74.3	-179.4	-174.3	-174.5	6.8	111.9	L740 W743 T819 V820 V826 L827	L740-R823 HydrophobicContact CD2-CB 4.42Å; W743-R823 HydrophobicContact CD2-CG 4.33Å; W743-R823 HydrophobicContact CE3-CB 3.9Å; W743-R823 HydrophobicContact CE3-CG 4.05Å; W743-R823 HydrophobicContact CH2-CB 4.05Å; W743-R823 HydrophobicContact CH2-CG 3.7Å; W743-R823 HydrophobicContact CZ2-CG 3.98Å; W743-R823 HydrophobicContact CZ3-CB 3.58Å; W743-R823 HydrophobicContact CZ3-CG 3.72Å; T819-R823 HydrophobicContact CG2-CG 4.3Å; T819-R823 WeakPolarHBondContact O-CB 3.26Å; T819-R823 VanDerWaalsContact O-CG 3.26Å; T819-R823 WeakPolarHBondContact O-CG 3.36Å; T819-R823 PolarHBondContact O-N 2.88Å; V820-R823 PolarHBondContact O-N 3.45Å; R823-V826 PolarHBondContact O-N 3.07Å; R823-L827 WeakPolarHBondContact O-CG 3.26Å; R823-L827 PolarHBondContact O-N 3.07Å
824	T	94.3	Very high	92.2	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-63.4	-48.5	177.4	-54.7	0	0	0	0	111.3	V736 L740 S754 M757 V820 F821 F822 V826 L827 V828	V736-T824 HydrophobicContact CG1-CG2 3.97Å; L740-T824 HydrophobicContact CD1-CG2 4.2Å; S754-T824 WeakPolarHBondContact CB-OG1 3.4Å; S754-T824 WeakPolarHBondContact O-CG2 3.29Å; M757-T824 HydrophobicContact CE-CG2 4.17Å; V820-T824 WeakPolarHBondContact O-CB 3.38Å; V820-T824 PolarHBondContact O-N 3.18Å; V820-T824 PolarHBondContact O-OG1 2.8Å; F821-T824 PolarHBondContact O-N 3.48Å; F822-T824 VanDerWaalsContact C-N 3.28Å; F822-T824 PolarHBondContact O-N 3.18Å; T824-V826 VanDerWaalsContact C-N 3.32Å; T824-V826 PolarHBondContact O-N 2.94Å; T824-L827 PolarHBondContact O-N 3.1Å; T824-L827 VanDerWaalsContact O-N 3.13Å; T824-V828 HydrophobicContact CG2-CG2 4.26Å; T824-V828 VanDerWaalsContact O-CG2 3.3Å; T824-V828 WeakPolarHBondContact O-CG2 3.33Å; T824-V828 PolarHBondContact O-N 3.42Å
825	V	93.7	Very high	92.6	Very high	4 Å²	4	21.3 Å²	21.3	2%	0.024	11%	0.11	C	C	.	.	H	α-helix	trans	-62.5	-39.4	178.2	173	0	0	0	0	111.7	M757 L761 M807 F821 F822 L827 V828 V829	M757-V825 HydrophobicContact CE-CG2 3.62Å; M757-V825 HydrophobicContact SD-CG2 4.44Å; L761-V825 HydrophobicContact CD1-CG2 4.46Å; M807-V825 HydrophobicContact CB-CG1 4.39Å; M807-V825 HydrophobicContact CE-CG2 4.03Å; M807-V825 HydrophobicContact CG-CB 4.34Å; M807-V825 HydrophobicContact CG-CG1 4.11Å; M807-V825 HydrophobicContact CG-CG2 4.1Å; F821-V825 WeakPolarHBondContact O-CG2 3.39Å; F821-V825 PolarHBondContact O-N 3.1Å; F822-V825 PolarHBondContact O-N 3.14Å; V825-L827 VanDerWaalsContact C-N 3.32Å; V825-L827 PolarHBondContact O-N 3.07Å; V825-V828 PolarHBondContact O-N 2.9Å; V825-V829 HydrophobicContact CG1-CG2 4.12Å; V825-V829 WeakPolarHBondContact O-CB 3.32Å; V825-V829 WeakPolarHBondContact O-CG2 3.42Å; V825-V829 PolarHBondContact O-N 3.34Å
826	V	95	Very high	93	Very high	34 Å²	34	21.1 Å²	21.1	21%	0.206	11%	0.109	C	C	.	.	H	α-helix	trans	-58.7	-45.1	174.1	171.6	0	0	0	0	111.3	L804 F822 R823 T824 T830	L804-V826 HydrophobicContact CD2-CB 4.35Å; L804-V826 HydrophobicContact CD2-CG2 3.84Å; F822-V826 HydrophobicContact CD1-CG2 4.24Å; F822-V826 HydrophobicContact CD2-CG2 4.31Å; F822-V826 HydrophobicContact CE1-CG2 3.75Å; F822-V826 HydrophobicContact CE2-CG2 3.82Å; F822-V826 HydrophobicContact CZ-CG2 3.52Å; F822-V826 WeakPolarHBondContact O-CG2 3.4Å; F822-V826 PolarHBondContact O-N 3.1Å; R823-V826 PolarHBondContact O-N 3.07Å; T824-V826 VanDerWaalsContact C-N 3.32Å; T824-V826 PolarHBondContact O-N 2.94Å; V826-T830 HydrophobicContact CG1-CG2 4.45Å; V826-T830 WeakPolarHBondContact O-CB 3.39Å; V826-T830 WeakPolarHBondContact O-CG2 3.38Å; V826-T830 PolarHBondContact O-N 3.36Å; V826-T830 PolarHBondContact O-OG1 3.04Å
827	L	95.9	Very high	93.3	Very high	18 Å²	18	19.3 Å²	19.3	9%	0.094	10%	0.099	C	C	.	.	H	α-helix	trans	-65.7	-44.6	176.3	-71.4	174.4	0	0	0	112	L739 L740 W743 R823 T824 V825 V829 T830 L831	L739-L827 HydrophobicContact CB-CD1 3.9Å; L739-L827 HydrophobicContact CB-CD2 4.01Å; L739-L827 HydrophobicContact CD1-CD2 3.91Å; L740-L827 HydrophobicContact CD2-CD1 3.6Å; L740-L827 HydrophobicContact CG-CD1 3.68Å; W743-L827 HydrophobicContact CE3-CD1 3.97Å; W743-L827 HydrophobicContact CE3-CG 4.26Å; W743-L827 HydrophobicContact CZ3-CD1 4.18Å; W743-L827 HydrophobicContact CZ3-CD2 4.33Å; W743-L827 HydrophobicContact CZ3-CG 3.99Å; R823-L827 WeakPolarHBondContact O-CG 3.26Å; R823-L827 PolarHBondContact O-N 3.07Å; T824-L827 PolarHBondContact O-N 3.1Å; T824-L827 VanDerWaalsContact O-N 3.13Å; V825-L827 VanDerWaalsContact C-N 3.32Å; V825-L827 PolarHBondContact O-N 3.07Å; L827-V829 PolarHBondContact O-N 3.02Å; L827-T830 WeakPolarHBondContact CA-OG1 3.49Å; L827-T830 PolarHBondContact O-N 2.9Å; L827-T830 PolarHBondContact O-OG1 3.06Å; L827-T830 VanDerWaalsContact O-OG1 3.06Å; L827-L831 WeakPolarHBondContact O-CB 3.43Å; L827-L831 WeakPolarHBondContact O-CG 3.32Å; L827-L831 PolarHBondContact O-N 3.41Å
828	V	95.3	Very high	93.6	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.006	11%	0.112	C	C	.	.	H	α-helix	trans	-59.7	-47.6	179.1	170.3	0	0	0	0	111.5	V736 L761 T762 F765 T824 V825 G832	V736-V828 HydrophobicContact CG1-CG2 4.38Å; V736-V828 HydrophobicContact CG2-CG2 3.83Å; L761-V828 HydrophobicContact CB-CG1 3.67Å; L761-V828 HydrophobicContact CD1-CG1 4.37Å; T762-V828 HydrophobicContact CG2-CG1 4.03Å; F765-V828 HydrophobicContact CE2-CG1 4.29Å; T824-V828 HydrophobicContact CG2-CG2 4.26Å; T824-V828 VanDerWaalsContact O-CG2 3.3Å; T824-V828 WeakPolarHBondContact O-CG2 3.33Å; T824-V828 PolarHBondContact O-N 3.42Å; V825-V828 PolarHBondContact O-N 2.9Å; V828-G832 VanDerWaalsContact O-CA 3.29Å; V828-G832 WeakPolarHBondContact O-CA 3.35Å; V828-G832 PolarHBondContact O-N 3.05Å
829	V	95	Very high	93.7	Very high	3 Å²	3	22.2 Å²	22.2	2%	0.018	11%	0.112	C	C	.	.	H	α-helix	trans	-68.8	-43	-179.1	174.6	0	0	0	0	111.1	F765 G800 T803 L804 V825 L827 G832 L833	F765-V829 HydrophobicContact CZ-CG2 4.48Å; G800-V829 WeakPolarHBondContact O-CG1 3.45Å; T803-V829 WeakPolarHBondContact OG1-CG2 3.37Å; L804-V829 HydrophobicContact CD1-CB 4.32Å; L804-V829 HydrophobicContact CD1-CG1 3.71Å; L804-V829 HydrophobicContact CD2-CB 4.13Å; L804-V829 HydrophobicContact CD2-CG1 4.42Å; L804-V829 HydrophobicContact CD2-CG2 4.27Å; L804-V829 HydrophobicContact CG-CB 4.03Å; L804-V829 HydrophobicContact CG-CG1 3.85Å; L804-V829 HydrophobicContact CG-CG2 4.09Å; V825-V829 HydrophobicContact CG1-CG2 4.12Å; V825-V829 WeakPolarHBondContact O-CB 3.32Å; V825-V829 WeakPolarHBondContact O-CG2 3.42Å; V825-V829 PolarHBondContact O-N 3.34Å; L827-V829 PolarHBondContact O-N 3.02Å; V829-G832 PolarHBondContact O-N 3.47Å; V829-L833 HydrophobicContact CG1-CD1 3.81Å; V829-L833 HydrophobicContact CG1-CG 4.24Å; V829-L833 WeakPolarHBondContact O-CB 3.41Å; V829-L833 VanDerWaalsContact O-CG 3.27Å; V829-L833 WeakPolarHBondContact O-CG 3.5Å; V829-L833 PolarHBondContact O-N 3.2Å
830	T	95.2	Very high	93.8	Very high	72 Å²	72	20.4 Å²	20.4	44%	0.442	10%	0.101	S	C	.	.	H	α-helix	trans	-66.1	-44.1	-179.9	52.4	0	0	0	0	111.9	V826 L827 F834	V826-T830 HydrophobicContact CG1-CG2 4.45Å; V826-T830 WeakPolarHBondContact O-CB 3.39Å; V826-T830 WeakPolarHBondContact O-CG2 3.38Å; V826-T830 PolarHBondContact O-N 3.36Å; V826-T830 PolarHBondContact O-OG1 3.04Å; L827-T830 WeakPolarHBondContact CA-OG1 3.49Å; L827-T830 PolarHBondContact O-N 2.9Å; L827-T830 PolarHBondContact O-OG1 3.06Å; L827-T830 VanDerWaalsContact O-OG1 3.06Å; T830-F834 VanDerWaalsContact O-CB 3.3Å; T830-F834 WeakPolarHBondContact O-CB 3.41Å; T830-F834 PolarHBondContact O-N 3.45Å; T830-F834 VanDerWaalsContact O-N 3.11Å
831	L	96.3	Very high	93.8	Very high	14 Å²	14	20 Å²	20	7%	0.073	10%	0.098	C	C	.	.	H	α-helix	trans	-69.8	-41.8	175.5	-65.2	179.3	0	0	0	111.7	Y507 V736 L739 L827 F834 H835	Y507-L831 HydrophobicContact CD2-CD2 4.02Å; Y507-L831 HydrophobicContact CE2-CD1 4.1Å; Y507-L831 HydrophobicContact CE2-CD2 3.34Å; Y507-L831 HydrophobicContact CE2-CG 4.34Å; V736-L831 HydrophobicContact CG2-CD1 3.9Å; L739-L831 HydrophobicContact CD1-CD1 4.13Å; L739-L831 HydrophobicContact CD1-CD2 4.16Å; L827-L831 WeakPolarHBondContact O-CB 3.43Å; L827-L831 WeakPolarHBondContact O-CG 3.32Å; L827-L831 PolarHBondContact O-N 3.41Å; L831-F834 PolarHBondContact O-N 3.35Å; L831-H835 WeakPolarHBondContact O-CB 3.44Å; L831-H835 PolarHBondContact O-N 3.12Å; L831-H835 PolarHBondContact O-ND1 3.05Å
832	G	95	Very high	93.7	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-58.5	-51.7	177.9	0	0	0	0	0	112.1	V828 V829 F834 H835 A836	V828-G832 VanDerWaalsContact O-CA 3.29Å; V828-G832 WeakPolarHBondContact O-CA 3.35Å; V828-G832 PolarHBondContact O-N 3.05Å; V829-G832 PolarHBondContact O-N 3.47Å; G832-F834 PolarHBondContact O-N 2.88Å; G832-H835 PolarHBondContact O-N 3.38Å; G832-A836 VanDerWaalsContact O-CB 3.23Å; G832-A836 WeakPolarHBondContact O-CB 3.38Å; G832-A836 PolarHBondContact O-N 3.47Å
833	L	94.8	Very high	93.6	Very high	33 Å²	33	18.5 Å²	18.5	17%	0.173	9%	0.092	C	C	.	.	H	α-helix	trans	-64.2	-38.5	175.7	-69	176.7	0	0	0	112.3	F765 L796 I797 V829 L837	F765-L833 HydrophobicContact CD1-CD2 4.22Å; F765-L833 HydrophobicContact CE1-CD2 3.83Å; F765-L833 HydrophobicContact CE1-CG 4.09Å; L796-L833 HydrophobicContact CB-CD2 4.47Å; L796-L833 WeakPolarHBondContact O-CD2 3.34Å; I797-L833 HydrophobicContact CG1-CD2 4Å; V829-L833 HydrophobicContact CG1-CD1 3.81Å; V829-L833 HydrophobicContact CG1-CG 4.24Å; V829-L833 WeakPolarHBondContact O-CB 3.41Å; V829-L833 VanDerWaalsContact O-CG 3.27Å; V829-L833 WeakPolarHBondContact O-CG 3.5Å; V829-L833 PolarHBondContact O-N 3.2Å; L833-L837 HydrophobicContact CB-CD1 4.48Å; L833-L837 VanDerWaalsContact O-CB 3.26Å; L833-L837 WeakPolarHBondContact O-CB 3Å; L833-L837 VanDerWaalsContact O-CG 3.29Å; L833-L837 WeakPolarHBondContact O-CG 3.39Å; L833-L837 PolarHBondContact O-N 3.14Å
834	F	94.8	Very high	93.3	Very high	48 Å²	48	15.1 Å²	15.1	21%	0.211	8%	0.08	C	C	.	.	H	α-helix	trans	-62.3	-44.9	175.5	175.1	-110.2	0	0	0	111.8	I503 Y504 T830 L831 G832 F838 V839	I503-F834 HydrophobicContact CG2-CE2 4.3Å; I503-F834 HydrophobicContact CG2-CZ 3.86Å; Y504-F834 HydrophobicContact CD2-CE1 4.41Å; T830-F834 VanDerWaalsContact O-CB 3.3Å; T830-F834 WeakPolarHBondContact O-CB 3.41Å; T830-F834 PolarHBondContact O-N 3.45Å; T830-F834 VanDerWaalsContact O-N 3.11Å; L831-F834 PolarHBondContact O-N 3.35Å; G832-F834 PolarHBondContact O-N 2.88Å; F834-F838 AromaticContact CD2-CD2 3.99Å; F834-F838 HydrophobicContact CD2-CD2 3.99Å; F834-F838 HydrophobicContact CE2-CB 4.44Å; F834-F838 WeakPolarHBondContact O-CB 3.39Å; F834-F838 PolarHBondContact O-N 2.63Å; F834-F838 VanDerWaalsContact O-N 3.09Å; F834-V839 HydrophobicContact CD1-CG2 3.83Å; F834-V839 HydrophobicContact CE1-CG2 3.42Å; F834-V839 VanDerWaalsContact CE1-CG2 3.42Å; F834-V839 HydrophobicContact CE2-CG2 4.49Å; F834-V839 HydrophobicContact CZ-CG2 3.79Å; F834-V839 PolarHBondContact O-N 3.13Å
835	H	95	Very high	92.8	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.093	C	C	.	.	I	π-helix	trans	-68.9	-48.2	178.6	-75	75.9	0	0	0	111.5	Y504 Y507 S728 S731 M732 L831 G832 V839 L840	Y504-H835 AromaticContact CE2-NE2 3.55Å; Y507-H835 AromaticContact CE1-CE1 3.58Å; Y507-H835 AromaticContact CE1-NE2 3.69Å; Y507-H835 AromaticContact CZ-CE1 3.68Å; S728-H835 PolarHBondContact OG-CD2 3.39Å; S731-H835 PolarHBondContact OG-NE2 3.16Å; M732-H835 HydrophobicContact CG-CB 4.13Å; M732-H835 VanDerWaalsContact CG-CE1 3.47Å; M732-H835 WeakPolarHBondContact CG-CE1 3.48Å; M732-H835 VanDerWaalsContact CG-CG 3.49Å; M732-H835 WeakPolarHBondContact CG-ND1 3.47Å; M732-H835 HydrophobicContact SD-CB 3.68Å; L831-H835 WeakPolarHBondContact O-CB 3.44Å; L831-H835 PolarHBondContact O-N 3.12Å; L831-H835 PolarHBondContact O-ND1 3.05Å; G832-H835 PolarHBondContact O-N 3.38Å; H835-V839 PolarHBondContact O-N 2.73Å; H835-L840 WeakPolarHBondContact O-CB 3.43Å; H835-L840 PolarHBondContact O-N 3.09Å
836	A	93.3	Very high	92.2	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.118	C	C	.	.	I	π-helix	trans	-60.3	-47.3	180	0	0	0	0	0	112.5	F765 M769 L796 G832 P841	F765-A836 HydrophobicContact CB-CB 4.09Å; F765-A836 WeakPolarHBondContact O-CB 3.2Å; M769-A836 VanDerWaalsContact CE-O 3.28Å; M769-A836 WeakPolarHBondContact CE-O 3.47Å; M769-A836 HydrophobicContact CG-CB 3.93Å; L796-A836 HydrophobicContact CD1-CB 3.98Å; G832-A836 VanDerWaalsContact O-CB 3.23Å; G832-A836 WeakPolarHBondContact O-CB 3.38Å; G832-A836 PolarHBondContact O-N 3.47Å; A836-P841 WeakPolarHBondContact O-CD 3.34Å; A836-P841 VanDerWaalsContact O-CG 3.31Å; A836-P841 WeakPolarHBondContact O-CG 3.48Å
837	L	92.3	Very high	91.3	Very high	15 Å²	15	21.3 Å²	21.3	8%	0.079	11%	0.113	C	C	.	.	I	π-helix	trans	-85.9	-32.6	-171.5	-60.4	174.6	0	0	0	113.1	Y487 F789 I797 L833 P841	Y487-L837 VanDerWaalsContact CE2-O 3.25Å; Y487-L837 WeakPolarHBondContact CE2-O 3.17Å; Y487-L837 PolarHBondContact OH-O 3.23Å; F789-L837 HydrophobicContact CD2-CD2 4.08Å; F789-L837 HydrophobicContact CE2-CD2 4.13Å; I797-L837 HydrophobicContact CD1-CD1 3.8Å; I797-L837 HydrophobicContact CD1-CD2 4.45Å; I797-L837 HydrophobicContact CG1-CD1 3.88Å; L833-L837 HydrophobicContact CB-CD1 4.48Å; L833-L837 VanDerWaalsContact O-CB 3.26Å; L833-L837 WeakPolarHBondContact O-CB 3Å; L833-L837 VanDerWaalsContact O-CG 3.29Å; L833-L837 WeakPolarHBondContact O-CG 3.39Å; L833-L837 PolarHBondContact O-N 3.14Å; L837-P841 WeakPolarHBondContact O-CG 3.24Å
838	F	91.8	Very high	89.4	Confident	63 Å²	63	32.1 Å²	32.1	28%	0.276	16%	0.16	S	C	.	.	I	π-helix	trans	-116	-55.4	-172.4	-56.4	-76.7	0	0	0	112.7	F490 F834 V842	F490-F838 HydrophobicContact CD1-CD1 4.17Å; F490-F838 HydrophobicContact CD1-CE1 4.45Å; F490-F838 HydrophobicContact CD2-CD1 4.29Å; F490-F838 HydrophobicContact CD2-CE1 4.32Å; F490-F838 AromaticContact CE1-CD1 3.96Å; F490-F838 HydrophobicContact CE1-CD1 3.96Å; F490-F838 HydrophobicContact CE2-CD1 4.08Å; F490-F838 HydrophobicContact CG-CD1 4.34Å; F490-F838 HydrophobicContact CG-CE1 4.28Å; F490-F838 AromaticContact CZ-CD1 3.91Å; F490-F838 HydrophobicContact CZ-CD1 3.91Å; F834-F838 AromaticContact CD2-CD2 3.99Å; F834-F838 HydrophobicContact CD2-CD2 3.99Å; F834-F838 HydrophobicContact CE2-CB 4.44Å; F834-F838 WeakPolarHBondContact O-CB 3.39Å; F834-F838 PolarHBondContact O-N 2.63Å; F834-F838 VanDerWaalsContact O-N 3.09Å; F838-V842 WeakPolarHBondContact O-CG2 3.47Å; F838-V842 PolarHBondContact O-N 3.35Å
839	V	92.1	Very high	89.1	Confident	2 Å²	2	33.7 Å²	33.7	1%	0.012	17%	0.167	C	C	.	.	I	π-helix	trans	-68.3	-57.1	-170.9	-176.1	0	0	0	0	111.2	Y504 F834 H835 V842 L843	Y504-V839 HydrophobicContact CD1-CG1 4.13Å; Y504-V839 HydrophobicContact CD2-CB 4.46Å; Y504-V839 HydrophobicContact CD2-CG1 3.75Å; Y504-V839 HydrophobicContact CD2-CG2 3.81Å; Y504-V839 HydrophobicContact CE1-CG1 4.14Å; Y504-V839 HydrophobicContact CE2-CG1 3.78Å; Y504-V839 HydrophobicContact CE2-CG2 4.41Å; Y504-V839 HydrophobicContact CG-CG1 3.94Å; Y504-V839 HydrophobicContact CG-CG2 4.23Å; F834-V839 HydrophobicContact CD1-CG2 3.83Å; F834-V839 HydrophobicContact CE1-CG2 3.42Å; F834-V839 VanDerWaalsContact CE1-CG2 3.42Å; F834-V839 HydrophobicContact CE2-CG2 4.49Å; F834-V839 HydrophobicContact CZ-CG2 3.79Å; F834-V839 PolarHBondContact O-N 3.13Å; H835-V839 PolarHBondContact O-N 2.73Å; V839-V842 PolarHBondContact O-N 3.25Å; V839-V842 VanDerWaalsContact O-N 3.13Å; V839-L843 HydrophobicContact CG1-CD1 3.71Å; V839-L843 HydrophobicContact CG1-CG 4.11Å; V839-L843 WeakPolarHBondContact O-CG 3.12Å; V839-L843 PolarHBondContact O-N 2.94Å
840	L	91.8	Very high	88.8	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.4	-49	-177	-83.4	172.7	0	0	0	112.5	T766 H835 V842 L843 F844	T766-L840 HydrophobicContact CG2-CD1 3.88Å; H835-L840 WeakPolarHBondContact O-CB 3.43Å; H835-L840 PolarHBondContact O-N 3.09Å; L840-V842 VanDerWaalsContact C-N 3.28Å; L840-V842 PolarHBondContact O-N 3.07Å; L840-L843 PolarHBondContact O-N 2.79Å; L840-L843 VanDerWaalsContact O-N 3.15Å; L840-F844 HydrophobicContact CB-CE2 4.28Å; L840-F844 HydrophobicContact CB-CZ 4.16Å; L840-F844 HydrophobicContact CD2-CE1 3.76Å; L840-F844 HydrophobicContact CD2-CZ 3.84Å; L840-F844 HydrophobicContact CG-CZ 4.45Å; L840-F844 WeakPolarHBondContact O-CB 3.5Å; L840-F844 WeakPolarHBondContact O-CD1 3.42Å; L840-F844 WeakPolarHBondContact O-CG 3.38Å; L840-F844 PolarHBondContact O-N 3.47Å
841	P	90.6	Very high	88.4	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-55.2	-41	174.5	-34.6	42	0	0	0	113.6	W491 M769 M785 A836 L837 T845	W491-P841 HydrophobicContact CH2-CB 4.07Å; W491-P841 HydrophobicContact CZ2-CB 3.57Å; M769-P841 HydrophobicContact CE-CG 3.74Å; M785-P841 HydrophobicContact CE-CB 4.31Å; M785-P841 VanDerWaalsContact CE-O 3.25Å; M785-P841 WeakPolarHBondContact CE-O 3.35Å; M785-P841 HydrophobicContact SD-CB 3.87Å; A836-P841 WeakPolarHBondContact O-CD 3.34Å; A836-P841 VanDerWaalsContact O-CG 3.31Å; A836-P841 WeakPolarHBondContact O-CG 3.48Å; L837-P841 WeakPolarHBondContact O-CG 3.24Å; P841-T845 WeakPolarHBondContact O-CG2 3.45Å; P841-T845 PolarHBondContact O-N 3.28Å
842	V	89.8	Confident	88	Confident	7 Å²	7	34.4 Å²	34.4	4%	0.042	17%	0.165	C	C	.	.	H	α-helix	trans	-67.4	-45.1	176.2	173.6	0	0	0	0	110.8	W491 R497 M501 F838 V839 L840 F844 T845	W491-V842 HydrophobicContact CH2-CG2 3.91Å; W491-V842 HydrophobicContact CZ2-CG2 4.42Å; R497-V842 HydrophobicContact CG-CG2 4.48Å; M501-V842 HydrophobicContact CG-CG1 3.87Å; M501-V842 HydrophobicContact SD-CG1 3.73Å; F838-V842 WeakPolarHBondContact O-CG2 3.47Å; F838-V842 PolarHBondContact O-N 3.35Å; V839-V842 PolarHBondContact O-N 3.25Å; V839-V842 VanDerWaalsContact O-N 3.13Å; L840-V842 VanDerWaalsContact C-N 3.28Å; L840-V842 PolarHBondContact O-N 3.07Å; V842-F844 VanDerWaalsContact C-N 3.32Å; V842-F844 PolarHBondContact O-N 2.95Å; V842-T845 PolarHBondContact O-N 3.14Å; V842-T845 VanDerWaalsContact O-N 3.1Å; V842-T845 PolarHBondContact O-OG1 3.26Å
843	L	89.8	Confident	87.5	Confident	3 Å²	3	36.6 Å²	36.6	2%	0.016	18%	0.176	C	C	.	.	H	α-helix	trans	-61.9	-38.3	176.3	-66.7	178.7	0	0	0	112.2	M501 W724 V839 L840 T845 L846	M501-L843 HydrophobicContact CE-CD2 3.94Å; M501-L843 HydrophobicContact SD-CD2 4.24Å; W724-L843 HydrophobicContact CD2-CB 4.1Å; W724-L843 HydrophobicContact CE3-CB 4.15Å; W724-L843 HydrophobicContact CE3-CD1 3.83Å; W724-L843 HydrophobicContact CE3-CD2 4.01Å; W724-L843 HydrophobicContact CE3-CG 4.22Å; W724-L843 HydrophobicContact CG-CB 4.31Å; W724-L843 HydrophobicContact CH2-CD2 4.25Å; W724-L843 HydrophobicContact CZ3-CD1 4.32Å; W724-L843 HydrophobicContact CZ3-CD2 3.8Å; V839-L843 HydrophobicContact CG1-CD1 3.71Å; V839-L843 HydrophobicContact CG1-CG 4.11Å; V839-L843 WeakPolarHBondContact O-CG 3.12Å; V839-L843 PolarHBondContact O-N 2.94Å; L840-L843 PolarHBondContact O-N 2.79Å; L840-L843 VanDerWaalsContact O-N 3.15Å; L843-T845 VanDerWaalsContact C-N 3.26Å; L843-T845 PolarHBondContact O-N 3.1Å; L843-L846 HydrophobicContact CD2-CD1 4.1Å; L843-L846 WeakPolarHBondContact O-CA 3.15Å; L843-L846 VanDerWaalsContact O-CB 3.25Å; L843-L846 WeakPolarHBondContact O-CB 3.36Å; L843-L846 PolarHBondContact O-N 3.31Å
844	F	87.9	Confident	87.1	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-63.6	-30.1	175.1	-67.1	-14.6	0	0	0	112.5	L721 W724 V725 M769 A770 Y773 L840 V842 L846 T847	L721-F844 HydrophobicContact CD1-CD1 3.62Å; L721-F844 HydrophobicContact CD1-CD2 4.48Å; L721-F844 HydrophobicContact CD1-CE1 3.25Å; L721-F844 HydrophobicContact CD1-CE2 4.16Å; L721-F844 HydrophobicContact CD1-CG 4.24Å; L721-F844 HydrophobicContact CD1-CZ 3.55Å; W724-F844 HydrophobicContact CB-CD1 4.36Å; W724-F844 HydrophobicContact CB-CE1 4.18Å; V725-F844 HydrophobicContact CG2-CZ 4.47Å; M769-F844 HydrophobicContact CB-CE2 4.49Å; A770-F844 HydrophobicContact CB-CZ 4.05Å; Y773-F844 HydrophobicContact CD1-CB 4.18Å; Y773-F844 AromaticContact CD1-CD2 3.84Å; Y773-F844 HydrophobicContact CD1-CD2 3.84Å; Y773-F844 HydrophobicContact CD1-CE2 4.43Å; Y773-F844 HydrophobicContact CD1-CG 4.05Å; Y773-F844 HydrophobicContact CD2-CB 4.24Å; Y773-F844 AromaticContact CD2-CD2 3.86Å; Y773-F844 HydrophobicContact CD2-CD2 3.86Å; Y773-F844 HydrophobicContact CD2-CG 4.45Å; Y773-F844 HydrophobicContact CE1-CB 3.79Å; Y773-F844 HydrophobicContact CE1-CD2 4.33Å; Y773-F844 HydrophobicContact CE1-CG 4.13Å; Y773-F844 HydrophobicContact CE2-CB 3.86Å; Y773-F844 HydrophobicContact CE2-CD2 4.35Å; Y773-F844 HydrophobicContact CG-CB 4.39Å; Y773-F844 AromaticContact CG-CD2 3.58Å; Y773-F844 HydrophobicContact CG-CD2 3.58Å; Y773-F844 HydrophobicContact CG-CE2 4.14Å; Y773-F844 HydrophobicContact CG-CG 4.22Å; Y773-F844 PolarHBondContact OH-O 3.19Å; L840-F844 HydrophobicContact CB-CE2 4.28Å; L840-F844 HydrophobicContact CB-CZ 4.16Å; L840-F844 HydrophobicContact CD2-CE1 3.76Å; L840-F844 HydrophobicContact CD2-CZ 3.84Å; L840-F844 HydrophobicContact CG-CZ 4.45Å; L840-F844 WeakPolarHBondContact O-CB 3.5Å; L840-F844 WeakPolarHBondContact O-CD1 3.42Å; L840-F844 WeakPolarHBondContact O-CG 3.38Å; L840-F844 PolarHBondContact O-N 3.47Å; V842-F844 VanDerWaalsContact C-N 3.32Å; V842-F844 PolarHBondContact O-N 2.95Å; F844-L846 PolarHBondContact O-N 3.46Å; F844-T847 WeakPolarHBondContact O-CB 3.44Å; F844-T847 PolarHBondContact O-N 3.37Å; F844-T847 PolarHBondContact O-OG1 3.23Å
845	T	83.8	Confident	86.5	Confident	46 Å²	46	36 Å²	36	28%	0.282	17%	0.174	S	C	.	.	H	α-helix	trans	-68.1	-17	172.4	67.7	0	0	0	0	113.8	W491 T781 M785 P841 V842 L843 T847	W491-T845 HydrophobicContact CH2-CG2 4.27Å; W491-T845 HydrophobicContact CZ3-CG2 4.25Å; T781-T845 HydrophobicContact CG2-CG2 3.54Å; M785-T845 HydrophobicContact CE-CG2 3.49Å; M785-T845 VanDerWaalsContact CE-CG2 3.49Å; P841-T845 WeakPolarHBondContact O-CG2 3.45Å; P841-T845 PolarHBondContact O-N 3.28Å; V842-T845 PolarHBondContact O-N 3.14Å; V842-T845 VanDerWaalsContact O-N 3.1Å; V842-T845 PolarHBondContact O-OG1 3.26Å; L843-T845 VanDerWaalsContact C-N 3.26Å; L843-T845 PolarHBondContact O-N 3.1Å; T845-T847 VanDerWaalsContact C-N 3.34Å
846	L	81.5	Confident	85.9	Confident	106 Å²	106	38.8 Å²	38.8	56%	0.555	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-16.3	172.5	-54.3	174.3	0	0	0	112	W724 L843 F844 K848	W724-L846 HydrophobicContact CZ2-CD1 4.48Å; L843-L846 HydrophobicContact CD2-CD1 4.1Å; L843-L846 WeakPolarHBondContact O-CA 3.15Å; L843-L846 VanDerWaalsContact O-CB 3.25Å; L843-L846 WeakPolarHBondContact O-CB 3.36Å; L843-L846 PolarHBondContact O-N 3.31Å; F844-L846 PolarHBondContact O-N 3.46Å; L846-K848 PolarHBondContact O-N 2.85Å
847	T	74.5	Confident	85.2	Confident	16 Å²	16	42 Å²	42	10%	0.098	20%	0.203	C	C	.	.			trans	-72.6	126.2	173	67.1	0	0	0	0	109.8	D720 F844 T845	D720-T847 HydrophobicContact CB-CG2 4.06Å; F844-T847 WeakPolarHBondContact O-CB 3.44Å; F844-T847 PolarHBondContact O-N 3.37Å; F844-T847 PolarHBondContact O-OG1 3.23Å; T845-T847 VanDerWaalsContact C-N 3.34Å
848	K	56.9	Low	84.6	Confident	246 Å²	246	44.5 Å²	44.5	100%	1.07	21%	0.214	S	C	*	.			trans	-75.5	0	175.3	-73.7	-175.3	178.5	177.9	0	112	K718 L846	K718-K848 PolarHBondContact NZ-O 2.92Å; L846-K848 PolarHBondContact O-N 2.85Å

Retrieved 848 of 848 residues in 485.2 ms (Link to these results)

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