A0A087X793_POEFO Loading...

Glypican-1

Cell surface proteoglycan.

AlphaFold DB (A0A3B3V187), UniProt , Accession A0A087X793, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 538 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.8	Very low	37.4	Very low	218 Å²	218	148.2 Å²	148.2	100%	1.074	83%	0.826	S	S	*	*				0	123.7	0	-85.6	164.8	73.9	0	0	108.2
2	R	33.8	Very low	37.3	Very low	228 Å²	228	141 Å²	141	86%	0.86	81%	0.81	S	S	*	*			trans	59.9	141.6	149.2	-61.9	-178.3	178.8	-174.2	-1	117.5
3	L	32.7	Very low	37.4	Very low	151 Å²	151	142.6 Å²	142.6	79%	0.791	81%	0.813	S	S	*	*			cis	-179.9	145.2	-10.7	-161.8	77.9	0	0	0	103.4
4	C	34.7	Very low	37.2	Very low	110 Å²	110	142.1 Å²	142.1	74%	0.743	82%	0.82	S	S	*	*			trans	28.9	133.9	151.9	-59.7	0	0	0	0	120.1
5	V	38	Very low	37.3	Very low	122 Å²	122	138.8 Å²	138.8	74%	0.739	82%	0.817	S	S	*	*				-160.6	133.3	53.9	167.5	0	0	0	0	108.2	L7	V5-L7 HydrophobicContact CG1-CD1 4.12Å
6	L	40.3	Very low	37.2	Very low	165 Å²	165	135.6 Å²	135.6	86%	0.864	81%	0.811	S	S	*	*			trans	-85.5	120.8	167.8	-90.2	141	0	0	0	109.3
7	L	38.7	Very low	37.4	Very low	163 Å²	163	134.9 Å²	134.9	85%	0.853	81%	0.811	S	S	*	*			trans	-115.2	106.9	160.6	-111.5	118.1	0	0	0	107.7	V5 A9	V5-L7 HydrophobicContact CG1-CD1 4.12Å; L7-A9 PolarHBondContact O-N 3.41Å
8	C	37.2	Very low	37.1	Very low	114 Å²	114	130.7 Å²	130.7	77%	0.77	80%	0.799	S	S	*	*			trans	-69.5	119.5	172.4	-76.1	0	0	0	0	109.9
9	A	37.1	Very low	37	Very low	98 Å²	98	129.6 Å²	129.6	81%	0.81	80%	0.798	S	S	*	*			trans	-80	113.7	165.9	0	0	0	0	0	109.3	L7	L7-A9 PolarHBondContact O-N 3.41Å
10	V	42.1	Very low	36.9	Very low	132 Å²	132	129.9 Å²	129.9	80%	0.8	80%	0.799	S	S	*	*			trans	-95.5	115.8	166.2	175.3	0	0	0	0	107.7	G12	V10-G12 PolarHBondContact O-N 2.98Å
11	V	42.6	Very low	37.2	Very low	129 Å²	129	129 Å²	129	78%	0.782	80%	0.797	S	S	*	*			trans	-73.8	100	170.7	176.8	0	0	0	0	107.7
12	G	35.7	Very low	37.6	Very low	62 Å²	62	121.5 Å²	121.5	64%	0.639	78%	0.777	S	S	*	*			trans	-86.3	111.1	169	0	0	0	0	0	109.9	V10 C14	V10-G12 PolarHBondContact O-N 2.98Å; G12-C14 PolarHBondContact O-N 3.27Å
13	L	38.5	Very low	38.2	Very low	162 Å²	162	114.9 Å²	114.9	85%	0.848	77%	0.77	S	S	*	*			trans	-58.5	118.5	167.3	-97.9	74.5	0	0	0	109.3	A15	L13-A15 PolarHBondContact O-N 3.14Å
14	C	35.4	Very low	39.3	Very low	135 Å²	135	113.7 Å²	113.7	91%	0.912	77%	0.765	S	S	*	*			trans	-65.3	95.8	163.4	-72.7	0	0	0	0	109.4	G12 A16	G12-C14 PolarHBondContact O-N 3.27Å; C14-A16 PolarHBondContact O-N 2.74Å
15	A	37.3	Very low	41.6	Very low	93 Å²	93	116.5 Å²	116.5	77%	0.769	76%	0.76	S	S	*	*			trans	-81.6	100.7	152.9	0	0	0	0	0	106.8	L13 P17	L13-A15 PolarHBondContact O-N 3.14Å; A15-P17 WeakPolarHBondContact O-CD 3.17Å
16	A	36.8	Very low	44.1	Very low	87 Å²	87	115.1 Å²	115.1	72%	0.719	76%	0.756	S	S	*	*			trans	-58.2	122.2	164.6	0	0	0	0	0	107.6	C14 G18	C14-A16 PolarHBondContact O-N 2.74Å; A16-G18 PolarHBondContact O-N 3.08Å
17	P	39.7	Very low	46.7	Very low	125 Å²	125	107.3 Å²	107.3	81%	0.812	72%	0.715	S	S	*	*			trans	-65.6	107.7	165.5	26.2	-28	0	0	0	106	A15 S19	A15-P17 WeakPolarHBondContact O-CD 3.17Å; P17-S19 PolarHBondContact O-N 3.07Å
18	G	32.3	Very low	49.3	Very low	58 Å²	58	100.7 Å²	100.7	60%	0.598	69%	0.686	S	S	*	*			trans	-50.5	134.4	166.1	0	0	0	0	0	108.5	A16 V20	A16-G18 PolarHBondContact O-N 3.08Å; G18-V20 PolarHBondContact O-N 3.15Å
19	S	34.6	Very low	52	Low	110 Å²	110	101.7 Å²	101.7	77%	0.769	68%	0.684	S	S	*	*			trans	-48.1	109.6	169.5	48.3	0	0	0	0	109.7	P17 S21	P17-S19 PolarHBondContact O-N 3.07Å; S19-S21 VanDerWaalsContact C-N 3.28Å; S19-S21 PolarHBondContact O-N 3.31Å
20	V	35.6	Very low	54.7	Low	135 Å²	135	97.4 Å²	97.4	82%	0.818	65%	0.647	S	S	*	*			trans	-68.9	92.5	167.2	-176.8	0	0	0	0	106.4	G18	G18-V20 PolarHBondContact O-N 3.15Å
21	S	44	Very low	57.3	Low	111 Å²	111	93.6 Å²	93.6	78%	0.776	62%	0.618	S	S	*	*			trans	-68	124.4	161.6	-78.5	0	0	0	0	108.3	S19	S19-S21 VanDerWaalsContact C-N 3.28Å; S19-S21 PolarHBondContact O-N 3.31Å
22	G	42.2	Very low	59.8	Low	62 Å²	62	94.4 Å²	94.4	64%	0.639	61%	0.614	S	S	*	*			trans	69.9	85.7	161.7	0	0	0	0	0	115.8	D24	G22-D24 PolarHBondContact O-N 3.44Å; G22-D24 VanDerWaalsContact O-N 3.12Å
23	A	46.5	Very low	62.6	Low	88 Å²	88	93.6 Å²	93.6	73%	0.727	59%	0.593	S	S	*	*			trans	-67.4	105.5	148.7	0	0	0	0	0	106.5	R25	A23-R25 PolarHBondContact O-N 3.07Å
24	D	57.3	Low	65.4	Low	126 Å²	126	86.1 Å²	86.1	67%	0.674	55%	0.553	S	S	*	*			trans	-53.1	105.2	171.6	-87.1	-18.5	0	0	0	108.3	G22 S26 T47	G22-D24 PolarHBondContact O-N 3.44Å; G22-D24 VanDerWaalsContact O-N 3.12Å; D24-S26 PolarHBondContact O-N 2.89Å; D24-T47 HydrophobicContact CB-CG2 3.91Å
25	R	81.8	Confident	68.3	Low	170 Å²	170	82.9 Å²	82.9	64%	0.642	53%	0.529	S	S	*	.			trans	-68.9	124.7	178.4	-75	-179.7	173.6	-178	-0.7	108	A23 T47 E48	A23-R25 PolarHBondContact O-N 3.07Å; R25-T47 WeakPolarHBondContact O-CA 3.27Å; R25-E48 HydrophobicContact CB-CB 4.49Å; R25-E48 HydrophobicContact CB-CG 3.8Å; R25-E48 VanDerWaalsContact CB-OE1 3.24Å; R25-E48 WeakPolarHBondContact CB-OE1 3.44Å; R25-E48 WeakPolarHBondContact CD-OE1 3.44Å; R25-E48 WeakPolarHBondContact CD-OE2 3.37Å; R25-E48 PolarHBondContact O-N 3.33Å
26	S	91.5	Very high	71	Confident	93 Å²	93	81.7 Å²	81.7	65%	0.65	53%	0.526	S	S	*	.	B	Isolated β-bridge	trans	-71.7	137.9	-177.1	175.7	0	0	0	0	111.3	D24 G28	D24-S26 PolarHBondContact O-N 2.89Å; S26-G28 VanDerWaalsContact C-N 3.27Å; S26-G28 PolarHBondContact O-N 3.2Å; S26-G28 PolarHBondContact OG-N 3.28Å; S26-G28 VanDerWaalsContact OG-N 3.16Å
27	C	94.7	Very high	73.8	Confident	1 Å²	1	81.1 Å²	81.1	1%	0.007	51%	0.507	C	S	.	.			trans	-89.1	14.1	172.5	-62.9	0	0	0	0	113.2	D29 L30 R31 L46 T47 E48 C63	C27-D29 PolarHBondContact O-N 3.14Å; C27-L30 PolarHBondContact O-N 3.37Å; C27-R31 VanDerWaalsContact O-CG 3.3Å; C27-R31 WeakPolarHBondContact O-CG 3.4Å; C27-R31 PolarHBondContact O-N 3.07Å; C27-L46 PolarHBondContact N-O 3.49Å; C27-T47 PolarHBondContact SG-O 2.97Å; C27-T47 VanDerWaalsContact SG-O 3.33Å; C27-E48 PolarHBondContact SG-N 3.03Å; C27-E48 VanDerWaalsContact SG-N 3.45Å; C27-C63 WeakPolarHBondContact CA-SG 3.34Å; C27-C63 HydrophobicContact CB-CB 3.61Å; C27-C63 WeakPolarHBondContact CB-SG 3.42Å; C27-C63 WeakPolarHBondContact SG-CA 3.31Å; C27-C63 WeakPolarHBondContact SG-CB 3.4Å; C27-C63 CovalentContact SG-SG 2.03Å; C27-C63 PolarHBondContact SG-SG 2.83Å
28	G	93.6	Very high	76.4	Confident	24 Å²	24	78.3 Å²	78.3	25%	0.247	50%	0.501	C	S	.	.	H	α-helix	trans	-51.9	-48	-175.7	0	0	0	0	0	114	S26 L30 R31 Q32	S26-G28 VanDerWaalsContact C-N 3.27Å; S26-G28 PolarHBondContact O-N 3.2Å; S26-G28 PolarHBondContact OG-N 3.28Å; S26-G28 VanDerWaalsContact OG-N 3.16Å; G28-L30 PolarHBondContact O-N 3.21Å; G28-R31 WeakPolarHBondContact O-CB 3.41Å; G28-R31 PolarHBondContact O-N 3.41Å; G28-Q32 WeakPolarHBondContact O-CG 3.48Å; G28-Q32 PolarHBondContact O-N 3.18Å
29	D	92.3	Very high	79.5	Confident	134 Å²	134	77.8 Å²	77.8	72%	0.717	48%	0.483	S	S	*	.	H	α-helix	trans	-63.8	-42.2	-178.9	-63.6	-15	0	0	0	111.8	C27 Q32 F33	C27-D29 PolarHBondContact O-N 3.14Å; D29-Q32 PolarHBondContact O-N 3.49Å; D29-F33 WeakPolarHBondContact O-CB 3.47Å; D29-F33 PolarHBondContact O-N 3.01Å
30	L	94.8	Very high	82.3	Confident	9 Å²	9	77.5 Å²	77.5	5%	0.047	48%	0.476	C	S	.	.	H	α-helix	trans	-64.7	-41.7	176.1	-179.1	70.3	0	0	0	111.1	C27 G28 Q32 F33 Y34 C63 M68 H253	C27-L30 PolarHBondContact O-N 3.37Å; G28-L30 PolarHBondContact O-N 3.21Å; L30-Q32 VanDerWaalsContact C-N 3.33Å; L30-Q32 PolarHBondContact O-N 2.95Å; L30-F33 HydrophobicContact CD1-CD1 3.97Å; L30-F33 WeakPolarHBondContact O-CB 3.36Å; L30-F33 PolarHBondContact O-N 2.66Å; L30-Y34 VanDerWaalsContact O-CB 3.24Å; L30-Y34 WeakPolarHBondContact O-CB 3.11Å; L30-Y34 PolarHBondContact O-N 3.28Å; L30-C63 HydrophobicContact CB-CB 4.23Å; L30-C63 HydrophobicContact CD2-CB 3.28Å; L30-C63 WeakPolarHBondContact CD2-O 3.23Å; L30-C63 HydrophobicContact CG-CB 4.37Å; L30-M68 HydrophobicContact CD2-CE 3.71Å; L30-M68 HydrophobicContact CG-CE 4.23Å; L30-H253 HydrophobicContact CD1-CB 3.73Å
31	R	95.5	Very high	85	Confident	51 Å²	51	74.3 Å²	74.3	19%	0.192	45%	0.454	C	S	.	.	H	α-helix	trans	-60.8	-43.9	178.9	-69.7	171.8	71.9	78.1	5.1	111.5	C27 G28 Y34 T35 L41 V44 P45	C27-R31 VanDerWaalsContact O-CG 3.3Å; C27-R31 WeakPolarHBondContact O-CG 3.4Å; C27-R31 PolarHBondContact O-N 3.07Å; G28-R31 WeakPolarHBondContact O-CB 3.41Å; G28-R31 PolarHBondContact O-N 3.41Å; R31-Y34 PolarHBondContact O-N 3.28Å; R31-T35 WeakPolarHBondContact O-CB 3.36Å; R31-T35 PolarHBondContact O-N 2.92Å; R31-T35 PolarHBondContact O-OG1 2.88Å; R31-L41 HydrophobicContact CB-CD2 3.85Å; R31-L41 HydrophobicContact CG-CD2 4.17Å; R31-V44 HydrophobicContact CG-CG1 3.68Å; R31-V44 PolarHBondContact NH1-O 2.88Å; R31-P45 WeakPolarHBondContact CD-O 3.45Å; R31-P45 PolarHBondContact NH1-O 3.3Å
32	Q	95	Very high	87.2	Confident	146 Å²	146	77.3 Å²	77.3	68%	0.682	46%	0.456	S	S	*	.	H	α-helix	trans	-62.2	-47.3	175.3	-71.4	-178.5	0.7	0	0	111	G28 D29 L30 Y34 G36	G28-Q32 WeakPolarHBondContact O-CG 3.48Å; G28-Q32 PolarHBondContact O-N 3.18Å; D29-Q32 PolarHBondContact O-N 3.49Å; L30-Q32 VanDerWaalsContact C-N 3.33Å; L30-Q32 PolarHBondContact O-N 2.95Å; Q32-Y34 PolarHBondContact O-N 3.13Å; Q32-G36 PolarHBondContact O-N 3.39Å
33	F	95.5	Very high	89.2	Confident	46 Å²	46	77.3 Å²	77.3	20%	0.202	46%	0.455	C	S	.	.	H	α-helix	trans	-58.3	-48.2	175.4	166.8	-95.4	0	0	0	112.5	D29 L30 T35 G36 K37 L72 Y250 H253	D29-F33 WeakPolarHBondContact O-CB 3.47Å; D29-F33 PolarHBondContact O-N 3.01Å; L30-F33 HydrophobicContact CD1-CD1 3.97Å; L30-F33 WeakPolarHBondContact O-CB 3.36Å; L30-F33 PolarHBondContact O-N 2.66Å; F33-T35 PolarHBondContact O-N 3.49Å; F33-G36 CarbonylContact O-C 3.59Å; F33-G36 WeakPolarHBondContact O-CA 3.19Å; F33-G36 PolarHBondContact O-N 2.05Å; F33-G36 VanDerWaalsContact O-N 3.13Å; F33-K37 HydrophobicContact CE1-CG 4.23Å; F33-K37 HydrophobicContact CE2-CD 4.4Å; F33-K37 HydrophobicContact CE2-CG 3.97Å; F33-K37 HydrophobicContact CZ-CD 4.43Å; F33-K37 HydrophobicContact CZ-CG 3.78Å; F33-K37 PolarHBondContact O-N 3.35Å; F33-L72 HydrophobicContact CE1-CD2 3.96Å; F33-Y250 HydrophobicContact CE1-CD1 4.19Å; F33-Y250 HydrophobicContact CE1-CE1 4.32Å; F33-Y250 HydrophobicContact CE2-CE1 4.25Å; F33-Y250 AromaticContact CZ-CD1 3.7Å; F33-Y250 HydrophobicContact CZ-CD1 3.7Å; F33-Y250 AromaticContact CZ-CE1 3.44Å; F33-Y250 HydrophobicContact CZ-CE1 3.44Å; F33-Y250 VanDerWaalsContact CZ-CE1 3.44Å; F33-H253 AromaticContact CD1-ND1 3.87Å; F33-H253 AromaticContact CD2-CE1 3.77Å; F33-H253 AromaticContact CD2-ND1 3.77Å; F33-H253 HydrophobicContact CE1-CB 4.46Å; F33-H253 AromaticContact CE1-ND1 3.96Å; F33-H253 AromaticContact CE2-CE1 3.62Å; F33-H253 AromaticContact CE2-ND1 3.86Å; F33-H253 AromaticContact CG-ND1 3.77Å; F33-H253 AromaticContact CZ-CE1 3.99Å; F33-H253 AromaticContact CZ-ND1 3.98Å
34	Y	96.3	Very high	91.4	Very high	5 Å²	5	73.7 Å²	73.7	2%	0.02	42%	0.424	C	S	.	.	H	α-helix	trans	-63.8	-42.3	-176.5	-165.7	-115.2	0	0	0	111.8	L30 R31 Q32 K37 F39 T40 V44 M68 N71 L72	L30-Y34 VanDerWaalsContact O-CB 3.24Å; L30-Y34 WeakPolarHBondContact O-CB 3.11Å; L30-Y34 PolarHBondContact O-N 3.28Å; R31-Y34 PolarHBondContact O-N 3.28Å; Q32-Y34 PolarHBondContact O-N 3.13Å; Y34-K37 PolarHBondContact O-N 3.29Å; Y34-F39 HydrophobicContact CD1-CB 3.59Å; Y34-F39 HydrophobicContact CD1-CG 4.48Å; Y34-F39 HydrophobicContact CD2-CB 4.18Å; Y34-F39 AromaticContact CD2-CD2 3.68Å; Y34-F39 HydrophobicContact CD2-CD2 3.68Å; Y34-F39 HydrophobicContact CD2-CE2 4.47Å; Y34-F39 HydrophobicContact CD2-CG 4.25Å; Y34-F39 HydrophobicContact CE1-CB 3.24Å; Y34-F39 HydrophobicContact CE1-CD2 4.4Å; Y34-F39 HydrophobicContact CE1-CG 4Å; Y34-F39 HydrophobicContact CE2-CB 3.85Å; Y34-F39 AromaticContact CE2-CD2 3.37Å; Y34-F39 HydrophobicContact CE2-CD2 3.37Å; Y34-F39 HydrophobicContact CE2-CE2 4.03Å; Y34-F39 AromaticContact CE2-CG 3.71Å; Y34-F39 HydrophobicContact CE2-CG 3.71Å; Y34-F39 HydrophobicContact CG-CB 4.04Å; Y34-F39 HydrophobicContact CG-CD2 4.29Å; Y34-F39 AromaticContact CZ-CD2 3.77Å; Y34-F39 AromaticContact CZ-CG 3.56Å; Y34-F39 PolarHBondContact O-N 3.09Å; Y34-T40 WeakPolarHBondContact CE1-O 3.39Å; Y34-V44 HydrophobicContact CD1-CG2 3.78Å; Y34-V44 HydrophobicContact CE1-CG2 3.85Å; Y34-M68 HydrophobicContact CD1-CE 4.14Å; Y34-M68 HydrophobicContact CD2-CE 4.03Å; Y34-M68 HydrophobicContact CE1-CE 4.34Å; Y34-M68 HydrophobicContact CE1-CG 4.15Å; Y34-M68 HydrophobicContact CE2-CB 4.27Å; Y34-M68 HydrophobicContact CE2-CE 4.27Å; Y34-M68 HydrophobicContact CE2-CG 4.26Å; Y34-M68 HydrophobicContact CG-CE 3.98Å; Y34-N71 HydrophobicContact CE2-CB 4.5Å; Y34-N71 WeakPolarHBondContact OH-CB 3.31Å; Y34-N71 PolarHBondContact OH-ND2 3.47Å; Y34-L72 HydrophobicContact CD2-CD1 4.36Å; Y34-L72 HydrophobicContact CD2-CD2 4.04Å; Y34-L72 HydrophobicContact CD2-CG 4.23Å; Y34-L72 HydrophobicContact CE2-CD1 4.36Å; Y34-L72 HydrophobicContact CE2-CD2 4.1Å; Y34-L72 HydrophobicContact CE2-CG 3.96Å
35	T	96.2	Very high	93.2	Very high	66 Å²	66	68.6 Å²	68.6	41%	0.405	40%	0.398	S	S	.	.	H	α-helix	trans	-67.6	-38.8	173.4	-46.8	0	0	0	0	111.3	R31 F33 K37 G38 L41	R31-T35 WeakPolarHBondContact O-CB 3.36Å; R31-T35 PolarHBondContact O-N 2.92Å; R31-T35 PolarHBondContact O-OG1 2.88Å; F33-T35 PolarHBondContact O-N 3.49Å; T35-K37 PolarHBondContact O-N 3.16Å; T35-G38 WeakPolarHBondContact O-CA 3.32Å; T35-G38 PolarHBondContact O-N 3.24Å; T35-L41 VanDerWaalsContact OG1-CD2 3.27Å; T35-L41 WeakPolarHBondContact OG1-CD2 3.43Å; T35-L41 WeakPolarHBondContact OG1-CG 3.03Å
36	G	95.9	Very high	93.7	Very high	68 Å²	68	66.3 Å²	66.3	70%	0.701	40%	0.398	S	S	*	.	H	α-helix	trans	-62.2	-25.8	175.2	0	0	0	0	0	113.6	Q32 F33 G38	Q32-G36 PolarHBondContact O-N 3.39Å; F33-G36 CarbonylContact O-C 3.59Å; F33-G36 WeakPolarHBondContact O-CA 3.19Å; F33-G36 PolarHBondContact O-N 2.05Å; F33-G36 VanDerWaalsContact O-N 3.13Å; G36-G38 VanDerWaalsContact C-N 3.28Å
37	K	94.9	Very high	93.8	Very high	75 Å²	75	64.5 Å²	64.5	33%	0.326	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	2.5	170.6	-68.6	-61.2	-161.2	163.4	0	113.9	F33 Y34 T35 F39 L75 E79 Y250	F33-K37 HydrophobicContact CE1-CG 4.23Å; F33-K37 HydrophobicContact CE2-CD 4.4Å; F33-K37 HydrophobicContact CE2-CG 3.97Å; F33-K37 HydrophobicContact CZ-CD 4.43Å; F33-K37 HydrophobicContact CZ-CG 3.78Å; F33-K37 PolarHBondContact O-N 3.35Å; Y34-K37 PolarHBondContact O-N 3.29Å; T35-K37 PolarHBondContact O-N 3.16Å; K37-F39 HydrophobicContact CB-CD2 3.98Å; K37-F39 HydrophobicContact CB-CE2 4.06Å; K37-L75 HydrophobicContact CB-CD2 3.97Å; K37-L75 HydrophobicContact CD-CD2 3.78Å; K37-L75 HydrophobicContact CG-CD2 3.86Å; K37-E79 IonicContact NZ-OE1 2.83Å; K37-E79 PolarHBondContact NZ-OE1 3.34Å; K37-Y250 WeakPolarHBondContact CE-OH 3.29Å; K37-Y250 PolarHBondContact NZ-OH 3.24Å; K37-Y250 VanDerWaalsContact NZ-OH 3.16Å
38	G	94.8	Very high	93.8	Very high	66 Å²	66	66.8 Å²	66.8	68%	0.68	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.9	9.6	174.9	0	0	0	0	0	115.4	T35 G36	T35-G38 WeakPolarHBondContact O-CA 3.32Å; T35-G38 PolarHBondContact O-N 3.24Å; G36-G38 VanDerWaalsContact C-N 3.28Å
39	F	96.5	Very high	93.9	Very high	48 Å²	48	68.6 Å²	68.6	21%	0.211	40%	0.397	C	S	.	.			trans	-89.9	156.2	177.6	-60.6	-68.1	0	0	0	112.8	Y34 K37 N71 L72 L75	Y34-F39 HydrophobicContact CD1-CB 3.59Å; Y34-F39 HydrophobicContact CD1-CG 4.48Å; Y34-F39 HydrophobicContact CD2-CB 4.18Å; Y34-F39 AromaticContact CD2-CD2 3.68Å; Y34-F39 HydrophobicContact CD2-CD2 3.68Å; Y34-F39 HydrophobicContact CD2-CE2 4.47Å; Y34-F39 HydrophobicContact CD2-CG 4.25Å; Y34-F39 HydrophobicContact CE1-CB 3.24Å; Y34-F39 HydrophobicContact CE1-CD2 4.4Å; Y34-F39 HydrophobicContact CE1-CG 4Å; Y34-F39 HydrophobicContact CE2-CB 3.85Å; Y34-F39 AromaticContact CE2-CD2 3.37Å; Y34-F39 HydrophobicContact CE2-CD2 3.37Å; Y34-F39 HydrophobicContact CE2-CE2 4.03Å; Y34-F39 AromaticContact CE2-CG 3.71Å; Y34-F39 HydrophobicContact CE2-CG 3.71Å; Y34-F39 HydrophobicContact CG-CB 4.04Å; Y34-F39 HydrophobicContact CG-CD2 4.29Å; Y34-F39 AromaticContact CZ-CD2 3.77Å; Y34-F39 AromaticContact CZ-CG 3.56Å; Y34-F39 PolarHBondContact O-N 3.09Å; K37-F39 HydrophobicContact CB-CD2 3.98Å; K37-F39 HydrophobicContact CB-CE2 4.06Å; F39-N71 HydrophobicContact CD1-CB 4.11Å; F39-N71 HydrophobicContact CE1-CB 3.69Å; F39-N71 HydrophobicContact CE2-CB 4.47Å; F39-N71 HydrophobicContact CZ-CB 3.88Å; F39-L72 HydrophobicContact CE2-CD2 4.17Å; F39-L75 HydrophobicContact CE2-CD2 3.98Å; F39-L75 HydrophobicContact CZ-CB 4.28Å; F39-L75 HydrophobicContact CZ-CD2 4.47Å
40	T	93.6	Very high	94	Very high	103 Å²	103	65.7 Å²	65.7	63%	0.632	39%	0.387	S	S	*	.			trans	-80.1	147.7	177.7	54.8	0	0	0	0	111.9	Y34 E42	Y34-T40 WeakPolarHBondContact CE1-O 3.39Å; T40-E42 PolarHBondContact O-N 3.26Å
41	L	92.4	Very high	94	Very high	68 Å²	68	65.3 Å²	65.3	36%	0.356	39%	0.385	S	S	.	.			trans	-80.3	2.6	177.3	-71	175.6	0	0	0	114.5	R31 T35 G43 V44	R31-L41 HydrophobicContact CB-CD2 3.85Å; R31-L41 HydrophobicContact CG-CD2 4.17Å; T35-L41 VanDerWaalsContact OG1-CD2 3.27Å; T35-L41 WeakPolarHBondContact OG1-CD2 3.43Å; T35-L41 WeakPolarHBondContact OG1-CG 3.03Å; L41-G43 PolarHBondContact O-N 3.38Å; L41-V44 HydrophobicContact CD2-CB 4.32Å; L41-V44 HydrophobicContact CD2-CG1 4.45Å; L41-V44 HydrophobicContact CD2-CG2 4.25Å; L41-V44 PolarHBondContact O-N 3.02Å
42	E	90.2	Very high	93.9	Very high	175 Å²	175	70.1 Å²	70.1	82%	0.818	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	125.9	176.4	-169.1	174.2	-176.7	0	0	110.4	T40 V44	T40-E42 PolarHBondContact O-N 3.26Å; E42-V44 PolarHBondContact O-N 3.13Å
43	G	83.7	Confident	93.9	Very high	61 Å²	61	66.1 Å²	66.1	63%	0.629	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	7.2	-178.5	0	0	0	0	0	115.4	L41 T65	L41-G43 PolarHBondContact O-N 3.38Å; G43-T65 WeakPolarHBondContact O-CG2 3.28Å
44	V	93.6	Very high	93.9	Very high	12 Å²	12	64.1 Å²	64.1	7%	0.073	38%	0.383	C	S	.	.			trans	-83.2	127.8	174.6	-176.8	0	0	0	0	109.8	R31 Y34 L41 E42 M68	R31-V44 HydrophobicContact CG-CG1 3.68Å; R31-V44 PolarHBondContact NH1-O 2.88Å; Y34-V44 HydrophobicContact CD1-CG2 3.78Å; Y34-V44 HydrophobicContact CE1-CG2 3.85Å; L41-V44 HydrophobicContact CD2-CB 4.32Å; L41-V44 HydrophobicContact CD2-CG1 4.45Å; L41-V44 HydrophobicContact CD2-CG2 4.25Å; L41-V44 PolarHBondContact O-N 3.02Å; E42-V44 PolarHBondContact O-N 3.13Å; V44-M68 HydrophobicContact CB-CE 4.47Å; V44-M68 HydrophobicContact CB-SD 4.16Å; V44-M68 HydrophobicContact CG1-CE 3.71Å; V44-M68 HydrophobicContact CG1-SD 3.84Å; V44-M68 HydrophobicContact CG2-CE 4.08Å; V44-M68 HydrophobicContact CG2-CG 4.38Å; V44-M68 HydrophobicContact CG2-SD 3.85Å
45	P	94.1	Very high	93.8	Very high	19 Å²	19	73.6 Å²	73.6	12%	0.123	42%	0.418	C	S	.	.			trans	-58.7	152.7	177.8	-24.7	34.5	0	0	0	113.6	R31 T47 I49 C63 T65	R31-P45 WeakPolarHBondContact CD-O 3.45Å; R31-P45 PolarHBondContact NH1-O 3.3Å; P45-T47 WeakPolarHBondContact CB-O 3.41Å; P45-I49 HydrophobicContact CB-CG2 4.13Å; P45-I49 HydrophobicContact CG-CD1 3.73Å; P45-I49 HydrophobicContact CG-CG1 4.09Å; P45-I49 HydrophobicContact CG-CG2 4.33Å; P45-C63 WeakPolarHBondContact CD-O 3.43Å; P45-T65 HydrophobicContact CG-CG2 4.15Å
46	L	92.9	Very high	93.7	Very high	123 Å²	123	72.7 Å²	72.7	64%	0.644	41%	0.41	S	S	*	.	S	Bend	trans	-90.6	-34.9	171.3	-68.6	171.9	0	0	0	111.6	C27	C27-L46 PolarHBondContact N-O 3.49Å
47	T	94.4	Very high	93.7	Very high	54 Å²	54	69.8 Å²	69.8	33%	0.331	38%	0.379	S	S	.	.	B	Isolated β-bridge	trans	-129	163	179	52.7	0	0	0	0	109.8	D24 R25 C27 P45 I49	D24-T47 HydrophobicContact CB-CG2 3.91Å; R25-T47 WeakPolarHBondContact O-CA 3.27Å; C27-T47 PolarHBondContact SG-O 2.97Å; C27-T47 VanDerWaalsContact SG-O 3.33Å; P45-T47 WeakPolarHBondContact CB-O 3.41Å; T47-I49 PolarHBondContact O-N 3.4Å
48	E	94.6	Very high	93.7	Very high	49 Å²	49	67.4 Å²	67.4	23%	0.229	37%	0.371	C	S	.	.			trans	-55.6	133.6	178.3	-76.7	-179.2	-172.8	0	0	111.6	R25 C27 P61 T62	R25-E48 HydrophobicContact CB-CB 4.49Å; R25-E48 HydrophobicContact CB-CG 3.8Å; R25-E48 VanDerWaalsContact CB-OE1 3.24Å; R25-E48 WeakPolarHBondContact CB-OE1 3.44Å; R25-E48 WeakPolarHBondContact CD-OE1 3.44Å; R25-E48 WeakPolarHBondContact CD-OE2 3.37Å; R25-E48 PolarHBondContact O-N 3.33Å; C27-E48 PolarHBondContact SG-N 3.03Å; C27-E48 VanDerWaalsContact SG-N 3.45Å; E48-P61 WeakPolarHBondContact OE2-CB 3.42Å; E48-T62 WeakPolarHBondContact CA-O 3.38Å
49	I	94.8	Very high	93.7	Very high	63 Å²	63	70.7 Å²	70.7	32%	0.323	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	166.4	176.2	58.8	167.1	0	0	0	110.6	P45 T47 G51 T62 T65	P45-I49 HydrophobicContact CB-CG2 4.13Å; P45-I49 HydrophobicContact CG-CD1 3.73Å; P45-I49 HydrophobicContact CG-CG1 4.09Å; P45-I49 HydrophobicContact CG-CG2 4.33Å; T47-I49 PolarHBondContact O-N 3.4Å; I49-G51 PolarHBondContact O-N 3.11Å; I49-T62 HydrophobicContact CG1-CG2 4.1Å; I49-T62 VanDerWaalsContact CG1-O 3.29Å; I49-T62 WeakPolarHBondContact CG1-O 3.39Å; I49-T62 PolarHBondContact N-O 3.23Å; I49-T62 PolarHBondContact O-N 2.86Å; I49-T65 HydrophobicContact CD1-CG2 4.46Å
50	S	94.4	Very high	93.5	Very high	73 Å²	73	69.5 Å²	69.5	51%	0.51	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	132.1	168.5	-178	0	0	0	0	110.2	H53	S50-H53 PolarHBondContact O-CE1 2.99Å; S50-H53 PolarHBondContact O-ND1 3.33Å; S50-H53 VanDerWaalsContact O-ND1 3.17Å
51	G	94.3	Very high	93.5	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	36%	0.363	C	S	.	.			trans	-98.8	24.3	-179.4	0	0	0	0	0	115.1	I49 H53 L54 G60	I49-G51 PolarHBondContact O-N 3.11Å; G51-H53 PolarHBondContact O-N 2.83Å; G51-L54 WeakPolarHBondContact O-CB 3.16Å; G51-L54 VanDerWaalsContact O-CG 3.28Å; G51-L54 WeakPolarHBondContact O-CG 3.39Å; G51-L54 PolarHBondContact O-N 3.03Å; G51-L54 VanDerWaalsContact O-N 3.16Å; G51-G60 WeakPolarHBondContact CA-O 3.37Å; G51-G60 PolarHBondContact N-O 3.31Å
52	E	94.9	Very high	93.7	Very high	153 Å²	153	65 Å²	65	72%	0.715	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-24.5	176.6	-72.4	174.9	-174.3	0	0	112.9	L54 Q59	E52-L54 VanDerWaalsContact C-N 3.32Å; E52-L54 PolarHBondContact O-N 3.4Å; E52-Q59 PolarHBondContact O-NE2 3.45Å
53	H	94.5	Very high	93.9	Very high	61 Å²	61	56.9 Å²	56.9	28%	0.282	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-10.7	177.4	59.8	-86.2	0	0	0	114.7	S50 G51 C64	S50-H53 PolarHBondContact O-CE1 2.99Å; S50-H53 PolarHBondContact O-ND1 3.33Å; S50-H53 VanDerWaalsContact O-ND1 3.17Å; G51-H53 PolarHBondContact O-N 2.83Å; H53-C64 PolarHBondContact NE2-O 3.11Å
54	L	95.1	Very high	94.6	Very high	5 Å²	5	54 Å²	54	3%	0.026	28%	0.279	C	S	.	.			trans	-68.1	141.8	-176.3	-63.2	173.5	0	0	0	111.5	G51 E52 C57 T62 C64	G51-L54 WeakPolarHBondContact O-CB 3.16Å; G51-L54 VanDerWaalsContact O-CG 3.28Å; G51-L54 WeakPolarHBondContact O-CG 3.39Å; G51-L54 PolarHBondContact O-N 3.03Å; G51-L54 VanDerWaalsContact O-N 3.16Å; E52-L54 VanDerWaalsContact C-N 3.32Å; E52-L54 PolarHBondContact O-N 3.4Å; L54-C57 HydrophobicContact CD1-CB 3.99Å; L54-T62 HydrophobicContact CD1-CG2 3.91Å; L54-T62 HydrophobicContact CD2-CG2 4.41Å; L54-T62 HydrophobicContact CG-CG2 4.33Å; L54-C64 HydrophobicContact CD2-CB 4.47Å
55	R	93.6	Very high	94.7	Very high	203 Å²	203	54.9 Å²	54.9	77%	0.766	29%	0.285	S	S	*	.	S	Bend	trans	-116.2	-22.7	-176.7	-60.3	-60.6	-174.5	167.6	-0.3	113.9	I66 E69	R55-I66 HydrophobicContact CG-CD1 3.97Å; R55-I66 HydrophobicContact CG-CG1 4.46Å; R55-E69 PolarHBondContact N-OE1 3.17Å; R55-E69 PolarHBondContact N-OE2 3.18Å
56	M	95.1	Very high	94.7	Very high	47 Å²	47	58.5 Å²	58.5	23%	0.232	30%	0.302	C	S	.	.	S	Bend	trans	-118.6	-42.5	-177.7	-47.5	-178.1	-173	0	0	111.2	E69 A73 K243 M246	M56-E69 VanDerWaalsContact CA-OE1 3.27Å; M56-E69 WeakPolarHBondContact CA-OE1 3.1Å; M56-E69 HydrophobicContact CB-CG 4.03Å; M56-E69 VanDerWaalsContact CB-OE1 3.26Å; M56-E69 WeakPolarHBondContact CB-OE1 3.43Å; M56-E69 HydrophobicContact CG-CG 3.93Å; M56-E69 VanDerWaalsContact N-CD 3.32Å; M56-E69 PolarHBondContact N-OE1 2.91Å; M56-E69 PolarHBondContact N-OE2 3.11Å; M56-E69 HydrophobicContact SD-CG 3.99Å; M56-A73 HydrophobicContact CE-CB 3.98Å; M56-A73 HydrophobicContact SD-CB 3.64Å; M56-K243 HydrophobicContact CE-CG 3.96Å; M56-K243 HydrophobicContact CG-CB 4.26Å; M56-K243 HydrophobicContact CG-CG 4Å; M56-K243 HydrophobicContact SD-CB 4.26Å; M56-K243 HydrophobicContact SD-CG 3.92Å; M56-M246 HydrophobicContact CB-CB 4.45Å; M56-M246 HydrophobicContact CB-CG 4.1Å; M56-M246 HydrophobicContact SD-CB 3.85Å; M56-M246 HydrophobicContact SD-CG 3.83Å
57	C	96.4	Very high	94.8	Very high	7 Å²	7	55.4 Å²	55.4	5%	0.047	29%	0.294	C	S	.	.	S	Bend	trans	-76.9	148.1	175.7	-64.3	0	0	0	0	112	L54 Q59 E69 C251	L54-C57 HydrophobicContact CD1-CB 3.99Å; C57-Q59 PolarHBondContact O-N 3Å; C57-E69 PolarHBondContact N-OE1 3.38Å; C57-C251 WeakPolarHBondContact CA-SG 3.39Å; C57-C251 HydrophobicContact CB-CB 3.85Å; C57-C251 WeakPolarHBondContact CB-SG 3.33Å; C57-C251 WeakPolarHBondContact SG-CA 3.25Å; C57-C251 WeakPolarHBondContact SG-CB 3.46Å; C57-C251 CovalentContact SG-SG 2.03Å; C57-C251 PolarHBondContact SG-SG 2.85Å
58	P	94.9	Very high	94.9	Very high	26 Å²	26	53 Å²	53	17%	0.169	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-57.4	131.8	172.8	-21	30.6	0	0	0	111.4	R255 W416 G418	P58-R255 PolarHBondContact O-NH1 2.76Å; P58-W416 HydrophobicContact CG-CH2 4.25Å; P58-G418 WeakPolarHBondContact CG-O 3.46Å
59	Q	94.1	Very high	95	Very high	135 Å²	135	50.8 Å²	50.8	63%	0.631	27%	0.269	S	S	*	.	S	Bend	trans	-61.3	144.8	178.3	-65.6	-179.6	-17.1	0	0	111.3	E52 C57 R255	E52-Q59 PolarHBondContact O-NE2 3.45Å; C57-Q59 PolarHBondContact O-N 3Å; Q59-R255 PolarHBondContact O-NH1 3.14Å
60	G	92.1	Very high	95.1	Very high	22 Å²	22	49.5 Å²	49.5	23%	0.227	27%	0.272	C	S	.	.	S	Bend	trans	148.3	-172.9	-176.9	0	0	0	0	0	111.8	G51 T62	G51-G60 WeakPolarHBondContact CA-O 3.37Å; G51-G60 PolarHBondContact N-O 3.31Å; G60-T62 PolarHBondContact O-N 2.87Å
61	P	93.9	Very high	95.2	Very high	76 Å²	76	49.6 Å²	49.6	49%	0.494	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	129.8	175	-23.5	33.9	0	0	0	111	E48	E48-P61 WeakPolarHBondContact OE2-CB 3.42Å
62	T	95.6	Very high	95.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	154.8	-174	-170.4	0	0	0	0	112.5	E48 I49 L54 G60 C64 C254	E48-T62 WeakPolarHBondContact CA-O 3.38Å; I49-T62 HydrophobicContact CG1-CG2 4.1Å; I49-T62 VanDerWaalsContact CG1-O 3.29Å; I49-T62 WeakPolarHBondContact CG1-O 3.39Å; I49-T62 PolarHBondContact N-O 3.23Å; I49-T62 PolarHBondContact O-N 2.86Å; L54-T62 HydrophobicContact CD1-CG2 3.91Å; L54-T62 HydrophobicContact CD2-CG2 4.41Å; L54-T62 HydrophobicContact CG-CG2 4.33Å; G60-T62 PolarHBondContact O-N 2.87Å; T62-C64 WeakPolarHBondContact CG2-O 3.47Å; T62-C64 PolarHBondContact OG1-N 3.01Å; T62-C64 VanDerWaalsContact OG1-N 3.09Å; T62-C254 VanDerWaalsContact CA-O 3.3Å; T62-C254 WeakPolarHBondContact CA-O 3.49Å; T62-C254 PolarHBondContact OG1-O 3.39Å
63	C	96	Very high	95.5	Very high	6 Å²	6	42.4 Å²	42.4	4%	0.041	23%	0.233	C	C	.	.	S	Bend	trans	-100.3	5	168.9	-71.2	0	0	0	0	113.1	C27 L30 P45 C254	C27-C63 WeakPolarHBondContact CA-SG 3.34Å; C27-C63 HydrophobicContact CB-CB 3.61Å; C27-C63 WeakPolarHBondContact CB-SG 3.42Å; C27-C63 WeakPolarHBondContact SG-CA 3.31Å; C27-C63 WeakPolarHBondContact SG-CB 3.4Å; C27-C63 CovalentContact SG-SG 2.03Å; C27-C63 PolarHBondContact SG-SG 2.83Å; L30-C63 HydrophobicContact CB-CB 4.23Å; L30-C63 HydrophobicContact CD2-CB 3.28Å; L30-C63 WeakPolarHBondContact CD2-O 3.23Å; L30-C63 HydrophobicContact CG-CB 4.37Å; P45-C63 WeakPolarHBondContact CD-O 3.43Å; C63-C254 PolarHBondContact N-O 3.49Å
64	C	96.6	Very high	95.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.239	C	C	.	.			trans	-108.4	137.8	-177.4	-73	0	0	0	0	112.7	H53 L54 T62 M68 C254	H53-C64 PolarHBondContact NE2-O 3.11Å; L54-C64 HydrophobicContact CD2-CB 4.47Å; T62-C64 WeakPolarHBondContact CG2-O 3.47Å; T62-C64 PolarHBondContact OG1-N 3.01Å; T62-C64 VanDerWaalsContact OG1-N 3.09Å; C64-M68 HydrophobicContact CB-CB 4.32Å; C64-C254 HydrophobicContact CB-CB 3.65Å; C64-C254 WeakPolarHBondContact CB-SG 3.43Å; C64-C254 WeakPolarHBondContact SG-CA 3.31Å; C64-C254 WeakPolarHBondContact SG-CB 3.47Å; C64-C254 CovalentContact SG-SG 2.03Å; C64-C254 PolarHBondContact SG-SG 2.91Å
65	T	95.8	Very high	95.7	Very high	31 Å²	31	42.2 Å²	42.2	19%	0.19	24%	0.243	C	C	.	.			trans	-90.8	170.6	165.7	67.2	0	0	0	0	111	G43 P45 I49 A67 M68 E69	G43-T65 WeakPolarHBondContact O-CG2 3.28Å; P45-T65 HydrophobicContact CG-CG2 4.15Å; I49-T65 HydrophobicContact CD1-CG2 4.46Å; T65-A67 PolarHBondContact O-N 3.33Å; T65-M68 HydrophobicContact CG2-SD 4.42Å; T65-M68 WeakPolarHBondContact O-CB 3.42Å; T65-M68 PolarHBondContact O-N 3.4Å; T65-M68 VanDerWaalsContact O-N 3.16Å; T65-M68 WeakPolarHBondContact OG1-CG 3.36Å; T65-M68 PolarHBondContact OG1-N 3.02Å; T65-E69 PolarHBondContact O-N 3.29Å
66	I	94.9	Very high	95.9	Very high	94 Å²	94	32.6 Å²	32.6	48%	0.482	21%	0.207	S	C	.	.	H	α-helix	trans	-60.3	-34.7	175	-162.2	167.5	0	0	0	112.4	R55 E69 G70	R55-I66 HydrophobicContact CG-CD1 3.97Å; R55-I66 HydrophobicContact CG-CG1 4.46Å; I66-E69 PolarHBondContact O-N 3.42Å; I66-G70 PolarHBondContact O-N 3.19Å
67	A	95.2	Very high	96	Very high	59 Å²	59	30.8 Å²	30.8	49%	0.488	20%	0.2	S	C	.	.	H	α-helix	trans	-68.4	-40.8	176.1	0	0	0	0	0	111.3	T65 E69 G70 N71	T65-A67 PolarHBondContact O-N 3.33Å; A67-E69 VanDerWaalsContact C-N 3.34Å; A67-G70 PolarHBondContact O-N 2.92Å; A67-N71 WeakPolarHBondContact O-CB 3.39Å; A67-N71 VanDerWaalsContact O-CG 3.26Å; A67-N71 PolarHBondContact O-N 3.41Å
68	M	96.5	Very high	96	Very high	4 Å²	4	37 Å²	37	2%	0.02	23%	0.228	C	C	.	.	H	α-helix	trans	-63.8	-41.1	174.3	-65.6	174.5	72.8	0	0	111.7	L30 Y34 V44 C64 T65 N71 L72	L30-M68 HydrophobicContact CD2-CE 3.71Å; L30-M68 HydrophobicContact CG-CE 4.23Å; Y34-M68 HydrophobicContact CD1-CE 4.14Å; Y34-M68 HydrophobicContact CD2-CE 4.03Å; Y34-M68 HydrophobicContact CE1-CE 4.34Å; Y34-M68 HydrophobicContact CE1-CG 4.15Å; Y34-M68 HydrophobicContact CE2-CB 4.27Å; Y34-M68 HydrophobicContact CE2-CE 4.27Å; Y34-M68 HydrophobicContact CE2-CG 4.26Å; Y34-M68 HydrophobicContact CG-CE 3.98Å; V44-M68 HydrophobicContact CB-CE 4.47Å; V44-M68 HydrophobicContact CB-SD 4.16Å; V44-M68 HydrophobicContact CG1-CE 3.71Å; V44-M68 HydrophobicContact CG1-SD 3.84Å; V44-M68 HydrophobicContact CG2-CE 4.08Å; V44-M68 HydrophobicContact CG2-CG 4.38Å; V44-M68 HydrophobicContact CG2-SD 3.85Å; C64-M68 HydrophobicContact CB-CB 4.32Å; T65-M68 HydrophobicContact CG2-SD 4.42Å; T65-M68 WeakPolarHBondContact O-CB 3.42Å; T65-M68 PolarHBondContact O-N 3.4Å; T65-M68 VanDerWaalsContact O-N 3.16Å; T65-M68 WeakPolarHBondContact OG1-CG 3.36Å; T65-M68 PolarHBondContact OG1-N 3.02Å; M68-N71 PolarHBondContact O-N 2.88Å; M68-L72 WeakPolarHBondContact O-CB 3.43Å; M68-L72 VanDerWaalsContact O-CG 3.32Å; M68-L72 WeakPolarHBondContact O-CG 3.35Å; M68-L72 PolarHBondContact O-N 3.42Å
69	E	96	Very high	96.1	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-60.5	-46.2	176.1	-175.9	173.9	-123.9	0	0	111.4	R55 M56 C57 T65 I66 A67 L72 A73 M246	R55-E69 PolarHBondContact N-OE1 3.17Å; R55-E69 PolarHBondContact N-OE2 3.18Å; M56-E69 VanDerWaalsContact CA-OE1 3.27Å; M56-E69 WeakPolarHBondContact CA-OE1 3.1Å; M56-E69 HydrophobicContact CB-CG 4.03Å; M56-E69 VanDerWaalsContact CB-OE1 3.26Å; M56-E69 WeakPolarHBondContact CB-OE1 3.43Å; M56-E69 HydrophobicContact CG-CG 3.93Å; M56-E69 VanDerWaalsContact N-CD 3.32Å; M56-E69 PolarHBondContact N-OE1 2.91Å; M56-E69 PolarHBondContact N-OE2 3.11Å; M56-E69 HydrophobicContact SD-CG 3.99Å; C57-E69 PolarHBondContact N-OE1 3.38Å; T65-E69 PolarHBondContact O-N 3.29Å; I66-E69 PolarHBondContact O-N 3.42Å; A67-E69 VanDerWaalsContact C-N 3.34Å; E69-L72 PolarHBondContact O-N 3.39Å; E69-A73 WeakPolarHBondContact O-CB 3.47Å; E69-A73 PolarHBondContact O-N 3.08Å; E69-M246 HydrophobicContact CG-CE 4.19Å; E69-M246 HydrophobicContact CG-CG 4.28Å
70	G	96.6	Very high	96.2	Very high	37 Å²	37	33 Å²	33	38%	0.381	21%	0.208	S	C	.	.	H	α-helix	trans	-61.2	-44.8	174.8	0	0	0	0	0	113.4	I66 A67 A73 G74	I66-G70 PolarHBondContact O-N 3.19Å; A67-G70 PolarHBondContact O-N 2.92Å; G70-A73 PolarHBondContact O-N 3.27Å; G70-G74 PolarHBondContact O-N 3.5Å
71	N	96.9	Very high	96.5	Very high	74 Å²	74	33.5 Å²	33.5	40%	0.396	20%	0.204	S	C	.	.	H	α-helix	trans	-63.6	-45.8	178.9	-74.6	-10.1	0	0	0	112.2	Y34 F39 A67 M68 G74 L75	Y34-N71 HydrophobicContact CE2-CB 4.5Å; Y34-N71 WeakPolarHBondContact OH-CB 3.31Å; Y34-N71 PolarHBondContact OH-ND2 3.47Å; F39-N71 HydrophobicContact CD1-CB 4.11Å; F39-N71 HydrophobicContact CE1-CB 3.69Å; F39-N71 HydrophobicContact CE2-CB 4.47Å; F39-N71 HydrophobicContact CZ-CB 3.88Å; A67-N71 WeakPolarHBondContact O-CB 3.39Å; A67-N71 VanDerWaalsContact O-CG 3.26Å; A67-N71 PolarHBondContact O-N 3.41Å; M68-N71 PolarHBondContact O-N 2.88Å; N71-G74 PolarHBondContact O-N 2.93Å; N71-L75 PolarHBondContact O-N 2.87Å
72	L	97.5	Very high	96.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-69.5	-34	177.7	-70.4	172.2	0	0	0	112	F33 Y34 F39 M68 E69 L75 S76 M246 Y250	F33-L72 HydrophobicContact CE1-CD2 3.96Å; Y34-L72 HydrophobicContact CD2-CD1 4.36Å; Y34-L72 HydrophobicContact CD2-CD2 4.04Å; Y34-L72 HydrophobicContact CD2-CG 4.23Å; Y34-L72 HydrophobicContact CE2-CD1 4.36Å; Y34-L72 HydrophobicContact CE2-CD2 4.1Å; Y34-L72 HydrophobicContact CE2-CG 3.96Å; F39-L72 HydrophobicContact CE2-CD2 4.17Å; M68-L72 WeakPolarHBondContact O-CB 3.43Å; M68-L72 VanDerWaalsContact O-CG 3.32Å; M68-L72 WeakPolarHBondContact O-CG 3.35Å; M68-L72 PolarHBondContact O-N 3.42Å; E69-L72 PolarHBondContact O-N 3.39Å; L72-L75 HydrophobicContact CD2-CD2 4.36Å; L72-L75 PolarHBondContact O-N 3.17Å; L72-S76 PolarHBondContact O-N 3.35Å; L72-S76 PolarHBondContact O-OG 3.01Å; L72-M246 HydrophobicContact CB-CE 3.74Å; L72-M246 HydrophobicContact CB-SD 3.47Å; L72-M246 WeakPolarHBondContact CB-SD 3.4Å; L72-M246 HydrophobicContact CD1-CE 4.07Å; L72-Y250 HydrophobicContact CB-CD2 3.96Å; L72-Y250 HydrophobicContact CB-CG 4.25Å; L72-Y250 HydrophobicContact CD2-CD2 4.26Å; L72-Y250 HydrophobicContact CD2-CG 4.27Å; L72-Y250 VanDerWaalsContact O-CD2 3.31Å; L72-Y250 WeakPolarHBondContact O-CD2 3.46Å
73	A	98	Very high	96.7	Very high	2 Å²	2	34.8 Å²	34.8	2%	0.017	21%	0.214	C	C	.	.	H	α-helix	trans	-62.6	-48.8	174.3	0	0	0	0	0	111.1	M56 E69 G70 L75 S76 A77 T242 M246	M56-A73 HydrophobicContact CE-CB 3.98Å; M56-A73 HydrophobicContact SD-CB 3.64Å; E69-A73 WeakPolarHBondContact O-CB 3.47Å; E69-A73 PolarHBondContact O-N 3.08Å; G70-A73 PolarHBondContact O-N 3.27Å; A73-L75 VanDerWaalsContact C-N 3.31Å; A73-L75 PolarHBondContact O-N 2.92Å; A73-S76 PolarHBondContact O-N 3.05Å; A73-S76 PolarHBondContact O-OG 2.93Å; A73-A77 PolarHBondContact O-N 3.48Å; A73-T242 HydrophobicContact CB-CG2 3.95Å; A73-M246 HydrophobicContact CB-CB 3.77Å; A73-M246 HydrophobicContact CB-CG 3.99Å; A73-M246 HydrophobicContact CB-SD 4.24Å; A73-M246 PolarHBondContact N-SD 2.85Å; A73-M246 VanDerWaalsContact N-SD 3.45Å
74	G	97.4	Very high	96.8	Very high	39 Å²	39	35.1 Å²	35.1	40%	0.402	22%	0.215	S	C	.	.	H	α-helix	trans	-57.2	-43.5	174.1	0	0	0	0	0	112.5	G70 N71 A77 Q78	G70-G74 PolarHBondContact O-N 3.5Å; N71-G74 PolarHBondContact O-N 2.93Å; G74-A77 PolarHBondContact O-N 3.17Å; G74-Q78 WeakPolarHBondContact O-CB 2.83Å; G74-Q78 PolarHBondContact O-N 3.29Å
75	L	97.6	Very high	96.8	Very high	24 Å²	24	40 Å²	40	13%	0.126	23%	0.234	C	C	.	.	H	α-helix	trans	-61.2	-47.4	175.5	178.3	64.1	0	0	0	112.2	K37 F39 N71 L72 A73 A77 Q78 E79 Y250	K37-L75 HydrophobicContact CB-CD2 3.97Å; K37-L75 HydrophobicContact CD-CD2 3.78Å; K37-L75 HydrophobicContact CG-CD2 3.86Å; F39-L75 HydrophobicContact CE2-CD2 3.98Å; F39-L75 HydrophobicContact CZ-CB 4.28Å; F39-L75 HydrophobicContact CZ-CD2 4.47Å; N71-L75 PolarHBondContact O-N 2.87Å; L72-L75 HydrophobicContact CD2-CD2 4.36Å; L72-L75 PolarHBondContact O-N 3.17Å; A73-L75 VanDerWaalsContact C-N 3.31Å; A73-L75 PolarHBondContact O-N 2.92Å; L75-A77 VanDerWaalsContact C-N 3.31Å; L75-A77 PolarHBondContact O-N 2.84Å; L75-Q78 PolarHBondContact O-N 3.13Å; L75-E79 HydrophobicContact CD1-CG 4.04Å; L75-E79 HydrophobicContact CG-CG 4.4Å; L75-E79 WeakPolarHBondContact O-CB 3.19Å; L75-E79 WeakPolarHBondContact O-CG 3.14Å; L75-E79 PolarHBondContact O-N 3.22Å; L75-Y250 HydrophobicContact CB-CE2 4.31Å; L75-Y250 HydrophobicContact CD2-CE2 4Å; L75-Y250 HydrophobicContact CG-CE2 4.05Å
76	S	96.9	Very high	96.9	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.007	25%	0.253	C	S	.	.	H	α-helix	trans	-63	-38.4	-178.9	67.4	0	0	0	0	112.4	L72 A73 T80 M246	L72-S76 PolarHBondContact O-N 3.35Å; L72-S76 PolarHBondContact O-OG 3.01Å; A73-S76 PolarHBondContact O-N 3.05Å; A73-S76 PolarHBondContact O-OG 2.93Å; S76-T80 WeakPolarHBondContact O-CB 3.47Å; S76-T80 PolarHBondContact O-N 2.88Å; S76-T80 PolarHBondContact O-OG1 3.3Å; S76-M246 PolarHBondContact OG-N 3.3Å
77	A	97.4	Very high	97	Very high	9 Å²	9	41.7 Å²	41.7	7%	0.074	24%	0.243	C	C	.	.	H	α-helix	trans	-66	-47.3	174.7	0	0	0	0	0	110.9	A73 G74 L75 E79 T80 E81 L237 T242	A73-A77 PolarHBondContact O-N 3.48Å; G74-A77 PolarHBondContact O-N 3.17Å; L75-A77 VanDerWaalsContact C-N 3.31Å; L75-A77 PolarHBondContact O-N 2.84Å; A77-E79 PolarHBondContact O-N 3.01Å; A77-T80 PolarHBondContact O-N 3.16Å; A77-E81 WeakPolarHBondContact O-CB 3.32Å; A77-E81 WeakPolarHBondContact O-CG 3.34Å; A77-E81 PolarHBondContact O-N 3.45Å; A77-L237 HydrophobicContact CB-CD1 4.46Å; A77-T242 HydrophobicContact CB-CG2 4.03Å
78	Q	97	Very high	97.1	Very high	138 Å²	138	38.9 Å²	38.9	65%	0.645	22%	0.219	S	C	*	.	H	α-helix	trans	-61.1	-44.1	179	-176.8	-178.1	-3.8	0	0	112.6	G74 L75 G82	G74-Q78 WeakPolarHBondContact O-CB 2.83Å; G74-Q78 PolarHBondContact O-N 3.29Å; L75-Q78 PolarHBondContact O-N 3.13Å; Q78-G82 PolarHBondContact O-N 2.9Å
79	E	96.3	Very high	97.2	Very high	69 Å²	69	47 Å²	47	32%	0.322	25%	0.25	S	S	.	.	H	α-helix	trans	-63	-44.7	176.8	-73.4	173.4	155.5	0	0	110.9	K37 L75 A77 G82 L83 Y250	K37-E79 IonicContact NZ-OE1 2.83Å; K37-E79 PolarHBondContact NZ-OE1 3.34Å; L75-E79 HydrophobicContact CD1-CG 4.04Å; L75-E79 HydrophobicContact CG-CG 4.4Å; L75-E79 WeakPolarHBondContact O-CB 3.19Å; L75-E79 WeakPolarHBondContact O-CG 3.14Å; L75-E79 PolarHBondContact O-N 3.22Å; A77-E79 PolarHBondContact O-N 3.01Å; E79-G82 WeakPolarHBondContact O-CA 3.49Å; E79-G82 PolarHBondContact O-N 3.25Å; E79-L83 WeakPolarHBondContact O-CG 3.41Å; E79-L83 PolarHBondContact O-N 3.45Å; E79-Y250 VanDerWaalsContact CD-OH 3.22Å; E79-Y250 PolarHBondContact OE1-OH 2.55Å; E79-Y250 PolarHBondContact OE2-OH 3.4Å
80	T	96.8	Very high	97.2	Very high	7 Å²	7	50.8 Å²	50.8	4%	0.043	28%	0.276	C	S	.	.	H	α-helix	trans	-65.1	-45.5	178.7	-56.3	0	0	0	0	111.8	S76 A77 G82 L83 I84 L237 L245 M271	S76-T80 WeakPolarHBondContact O-CB 3.47Å; S76-T80 PolarHBondContact O-N 2.88Å; S76-T80 PolarHBondContact O-OG1 3.3Å; A77-T80 PolarHBondContact O-N 3.16Å; T80-G82 PolarHBondContact O-N 2.99Å; T80-L83 PolarHBondContact O-N 2.93Å; T80-I84 HydrophobicContact CG2-CD1 4.07Å; T80-I84 WeakPolarHBondContact O-CG1 3.07Å; T80-I84 PolarHBondContact O-N 2.82Å; T80-L237 HydrophobicContact CG2-CD1 4.35Å; T80-L245 HydrophobicContact CG2-CD1 4.03Å; T80-L245 HydrophobicContact CG2-CD2 4.22Å; T80-M271 HydrophobicContact CG2-CE 4.19Å; T80-M271 HydrophobicContact CG2-SD 4.2Å
81	E	97.4	Very high	97.3	Very high	33 Å²	33	49.6 Å²	49.6	15%	0.154	26%	0.261	C	S	.	.	H	α-helix	trans	-59.5	-37.2	172.6	-74.5	-173.5	179.6	0	0	111.9	A77 I84 R85 S236 L237	A77-E81 WeakPolarHBondContact O-CB 3.32Å; A77-E81 WeakPolarHBondContact O-CG 3.34Å; A77-E81 PolarHBondContact O-N 3.45Å; E81-I84 PolarHBondContact O-N 3.23Å; E81-R85 WeakPolarHBondContact O-CB 3.34Å; E81-R85 WeakPolarHBondContact O-CG 3.48Å; E81-R85 PolarHBondContact O-N 2.79Å; E81-R85 IonicContact OE2-CZ 3.78Å; E81-R85 IonicContact OE2-NH2 2.64Å; E81-R85 PolarHBondContact OE2-NH2 2.99Å; E81-S236 WeakPolarHBondContact OE1-CA 3.27Å; E81-L237 HydrophobicContact CG-CD1 3.74Å; E81-L237 HydrophobicContact CG-CG 3.74Å; E81-L237 PolarHBondContact OE1-N 3.1Å
82	G	97.1	Very high	97.3	Very high	33 Å²	33	47.3 Å²	47.3	34%	0.34	25%	0.248	S	C	.	.	H	α-helix	trans	-57	-48.9	173.2	0	0	0	0	0	112.2	Q78 E79 T80 R85 E86	Q78-G82 PolarHBondContact O-N 2.9Å; E79-G82 WeakPolarHBondContact O-CA 3.49Å; E79-G82 PolarHBondContact O-N 3.25Å; T80-G82 PolarHBondContact O-N 2.99Å; G82-R85 PolarHBondContact O-N 3.42Å; G82-E86 WeakPolarHBondContact O-CB 3.48Å; G82-E86 PolarHBondContact O-N 3.34Å
83	L	96.9	Very high	97.4	Very high	70 Å²	70	49.5 Å²	49.5	37%	0.366	27%	0.266	S	S	.	.	H	α-helix	trans	-63.6	-41.6	177.3	-64.6	173	0	0	0	112.4	E79 T80 E86 A87 L401	E79-L83 WeakPolarHBondContact O-CG 3.41Å; E79-L83 PolarHBondContact O-N 3.45Å; T80-L83 PolarHBondContact O-N 2.93Å; L83-E86 PolarHBondContact O-N 3.16Å; L83-A87 WeakPolarHBondContact O-CB 3.39Å; L83-A87 PolarHBondContact O-N 3.23Å; L83-L401 HydrophobicContact CB-CD2 3.54Å; L83-L401 HydrophobicContact CD1-CD2 4.21Å; L83-L401 HydrophobicContact CG-CD2 4.49Å
84	I	97.2	Very high	97.4	Very high	12 Å²	12	51.5 Å²	51.5	6%	0.062	28%	0.278	C	S	.	.	H	α-helix	trans	-61.3	-45.5	175.9	-67.6	159	0	0	0	110.6	T80 E81 A87 G88 L237 L275 L397 L401	T80-I84 HydrophobicContact CG2-CD1 4.07Å; T80-I84 WeakPolarHBondContact O-CG1 3.07Å; T80-I84 PolarHBondContact O-N 2.82Å; E81-I84 PolarHBondContact O-N 3.23Å; I84-A87 PolarHBondContact O-N 2.81Å; I84-G88 PolarHBondContact O-N 2.86Å; I84-L237 HydrophobicContact CD1-CD2 4.26Å; I84-L275 HydrophobicContact CD1-CD2 3.78Å; I84-L275 HydrophobicContact CG1-CD2 4.36Å; I84-L397 HydrophobicContact CG2-CD2 4.49Å; I84-L401 HydrophobicContact CG1-CD1 3.92Å
85	R	97.8	Very high	97.4	Very high	102 Å²	102	49.7 Å²	49.7	39%	0.385	26%	0.259	S	S	.	.	H	α-helix	trans	-65.1	-39	177.8	-70.1	172.8	-155	172.5	7.9	111.8	E81 G82 G88 R89 S233	E81-R85 WeakPolarHBondContact O-CB 3.34Å; E81-R85 WeakPolarHBondContact O-CG 3.48Å; E81-R85 PolarHBondContact O-N 2.79Å; E81-R85 IonicContact OE2-CZ 3.78Å; E81-R85 IonicContact OE2-NH2 2.64Å; E81-R85 PolarHBondContact OE2-NH2 2.99Å; G82-R85 PolarHBondContact O-N 3.42Å; R85-G88 PolarHBondContact O-N 2.69Å; R85-R89 WeakPolarHBondContact O-CB 3.37Å; R85-R89 VanDerWaalsContact O-CG 3.26Å; R85-R89 WeakPolarHBondContact O-CG 3.26Å; R85-R89 PolarHBondContact O-N 3.12Å; R85-S233 VanDerWaalsContact CG-O 3.3Å; R85-S233 WeakPolarHBondContact CG-O 3.28Å
86	E	97.2	Very high	97.4	Very high	130 Å²	130	51 Å²	51	61%	0.607	27%	0.266	S	S	*	.	H	α-helix	trans	-64.1	-48.1	176.5	-174.8	178.1	-177.8	0	0	111.4	G82 L83 G88 R89 S90	G82-E86 WeakPolarHBondContact O-CB 3.48Å; G82-E86 PolarHBondContact O-N 3.34Å; L83-E86 PolarHBondContact O-N 3.16Å; E86-G88 VanDerWaalsContact C-N 3.31Å; E86-G88 PolarHBondContact O-N 3.27Å; E86-R89 PolarHBondContact O-N 3.3Å; E86-S90 PolarHBondContact O-N 3.36Å
87	A	96.9	Very high	97.5	Very high	31 Å²	31	55.2 Å²	55.2	26%	0.256	29%	0.289	S	S	.	.	H	α-helix	trans	-58.2	-43.7	174.7	0	0	0	0	0	111.6	L83 I84 S90 L91 L397	L83-A87 WeakPolarHBondContact O-CB 3.39Å; L83-A87 PolarHBondContact O-N 3.23Å; I84-A87 PolarHBondContact O-N 2.81Å; A87-S90 PolarHBondContact O-N 3.27Å; A87-L91 PolarHBondContact O-N 2.97Å; A87-L91 VanDerWaalsContact O-N 3.08Å; A87-L397 HydrophobicContact CB-CD1 3.83Å
88	G	97.8	Very high	97.5	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-65	-36.6	176.4	0	0	0	0	0	113.6	I84 R85 E86 L91 Q92 I229 Y393	I84-G88 PolarHBondContact O-N 2.86Å; R85-G88 PolarHBondContact O-N 2.69Å; E86-G88 VanDerWaalsContact C-N 3.31Å; E86-G88 PolarHBondContact O-N 3.27Å; G88-L91 PolarHBondContact O-N 2.84Å; G88-Q92 WeakPolarHBondContact O-CB 3.5Å; G88-Q92 WeakPolarHBondContact O-CG 3.26Å; G88-Q92 PolarHBondContact O-N 3.27Å; G88-Q92 PolarHBondContact O-NE2 3.32Å; G88-Q92 VanDerWaalsContact O-NE2 3.1Å; G88-I229 VanDerWaalsContact O-CG2 3.31Å; G88-I229 WeakPolarHBondContact O-CG2 3.41Å; G88-Y393 WeakPolarHBondContact CA-OH 3.49Å; G88-Y393 PolarHBondContact N-OH 3.2Å
89	R	98.1	Very high	97.5	Very high	176 Å²	176	50.6 Å²	50.6	66%	0.664	27%	0.266	S	S	*	.	H	α-helix	trans	-67.5	-40.3	174.7	-77.2	172.5	-176.6	175.7	1.2	112	R85 E86 L91 Q92 A93	R85-R89 WeakPolarHBondContact O-CB 3.37Å; R85-R89 VanDerWaalsContact O-CG 3.26Å; R85-R89 WeakPolarHBondContact O-CG 3.26Å; R85-R89 PolarHBondContact O-N 3.12Å; E86-R89 PolarHBondContact O-N 3.3Å; R89-L91 VanDerWaalsContact C-N 3.33Å; R89-Q92 PolarHBondContact O-N 3.04Å; R89-A93 WeakPolarHBondContact O-CB 3.33Å; R89-A93 PolarHBondContact O-N 3.04Å
90	S	97.5	Very high	97.6	Very high	79 Å²	79	54.2 Å²	54.2	55%	0.552	28%	0.276	S	S	*	.	H	α-helix	trans	-59.7	-46.3	174.7	-174.8	0	0	0	0	110.8	E86 A87 A93 T94	E86-S90 PolarHBondContact O-N 3.36Å; A87-S90 PolarHBondContact O-N 3.27Å; S90-A93 WeakPolarHBondContact O-CB 3.23Å; S90-A93 PolarHBondContact O-N 2.82Å; S90-T94 PolarHBondContact O-N 3.09Å; S90-T94 PolarHBondContact O-OG1 3.11Å
91	L	97.7	Very high	97.6	Very high	12 Å²	12	55.8 Å²	55.8	6%	0.063	29%	0.288	C	S	.	.	H	α-helix	trans	-63.4	-45.4	176.9	-171.9	67.1	0	0	0	112.5	A87 G88 R89 A93 T94 F95 I229 W285 M390 Y393	A87-L91 PolarHBondContact O-N 2.97Å; A87-L91 VanDerWaalsContact O-N 3.08Å; G88-L91 PolarHBondContact O-N 2.84Å; R89-L91 VanDerWaalsContact C-N 3.33Å; L91-A93 VanDerWaalsContact C-N 3.29Å; L91-A93 PolarHBondContact O-N 3.12Å; L91-T94 WeakPolarHBondContact O-CB 3.46Å; L91-T94 PolarHBondContact O-N 3.09Å; L91-T94 VanDerWaalsContact O-N 3.12Å; L91-F95 HydrophobicContact CD1-CD2 4.42Å; L91-F95 HydrophobicContact CD1-CE2 4.11Å; L91-F95 HydrophobicContact CG-CD2 4.18Å; L91-F95 HydrophobicContact CG-CE2 4.09Å; L91-F95 WeakPolarHBondContact O-CD2 3.38Å; L91-F95 PolarHBondContact O-N 3.19Å; L91-F95 VanDerWaalsContact O-N 3.11Å; L91-I229 HydrophobicContact CB-CD1 4.31Å; L91-I229 HydrophobicContact CB-CG2 4.37Å; L91-I229 HydrophobicContact CD2-CD1 3.34Å; L91-I229 HydrophobicContact CD2-CG1 3.72Å; L91-I229 HydrophobicContact CD2-CG2 4.15Å; L91-I229 HydrophobicContact CG-CD1 3.54Å; L91-I229 HydrophobicContact CG-CG1 4.39Å; L91-W285 HydrophobicContact CD2-CZ2 4.35Å; L91-M390 HydrophobicContact CD1-CB 3.91Å; L91-M390 HydrophobicContact CD1-CG 3.47Å; L91-M390 VanDerWaalsContact CD1-CG 3.47Å; L91-M390 HydrophobicContact CD1-SD 3.31Å; L91-M390 WeakPolarHBondContact CD1-SD 3.11Å; L91-M390 HydrophobicContact CG-SD 4.44Å; L91-Y393 HydrophobicContact CB-CE2 4.22Å; L91-Y393 HydrophobicContact CD1-CD2 4.33Å; L91-Y393 HydrophobicContact CD2-CD1 3.51Å; L91-Y393 HydrophobicContact CD2-CD2 3.7Å; L91-Y393 HydrophobicContact CD2-CE1 3.59Å; L91-Y393 HydrophobicContact CD2-CE2 3.76Å; L91-Y393 HydrophobicContact CD2-CG 3.56Å; L91-Y393 HydrophobicContact CG-CD2 4.48Å; L91-Y393 HydrophobicContact CG-CE2 4.45Å
92	Q	98	Very high	97.6	Very high	27 Å²	27	54.2 Å²	54.2	13%	0.126	28%	0.281	C	S	.	.	H	α-helix	trans	-56.5	-41.9	173.7	-81.2	169.1	76.8	0	0	112.3	G88 R89 T94 F95 N96 S226 I229	G88-Q92 WeakPolarHBondContact O-CB 3.5Å; G88-Q92 WeakPolarHBondContact O-CG 3.26Å; G88-Q92 PolarHBondContact O-N 3.27Å; G88-Q92 PolarHBondContact O-NE2 3.32Å; G88-Q92 VanDerWaalsContact O-NE2 3.1Å; R89-Q92 PolarHBondContact O-N 3.04Å; Q92-T94 VanDerWaalsContact C-N 3.27Å; Q92-T94 PolarHBondContact O-N 3.09Å; Q92-F95 PolarHBondContact O-N 2.97Å; Q92-N96 WeakPolarHBondContact O-CB 3.45Å; Q92-N96 PolarHBondContact O-N 3.09Å; Q92-N96 PolarHBondContact O-ND2 3.29Å; Q92-S226 WeakPolarHBondContact CG-O 3.41Å; Q92-I229 HydrophobicContact CG-CB 4.06Å; Q92-I229 HydrophobicContact CG-CG2 3.91Å
93	A	98.1	Very high	97.6	Very high	45 Å²	45	55.1 Å²	55.1	37%	0.372	28%	0.278	S	S	.	.	H	α-helix	trans	-60.1	-40.5	177.8	0	0	0	0	0	111.3	R89 S90 L91 N96 N97	R89-A93 WeakPolarHBondContact O-CB 3.33Å; R89-A93 PolarHBondContact O-N 3.04Å; S90-A93 WeakPolarHBondContact O-CB 3.23Å; S90-A93 PolarHBondContact O-N 2.82Å; L91-A93 VanDerWaalsContact C-N 3.29Å; L91-A93 PolarHBondContact O-N 3.12Å; A93-N96 PolarHBondContact O-N 3.48Å; A93-N97 WeakPolarHBondContact O-CB 3.34Å; A93-N97 PolarHBondContact O-N 3.16Å; A93-N97 PolarHBondContact O-ND2 3.02Å
94	T	97.8	Very high	97.6	Very high	45 Å²	45	54.9 Å²	54.9	28%	0.276	28%	0.279	S	S	.	.	H	α-helix	trans	-61	-51.7	174.3	-54.6	0	0	0	0	111.6	S90 L91 Q92 N96 N97 L98 M390	S90-T94 PolarHBondContact O-N 3.09Å; S90-T94 PolarHBondContact O-OG1 3.11Å; L91-T94 WeakPolarHBondContact O-CB 3.46Å; L91-T94 PolarHBondContact O-N 3.09Å; L91-T94 VanDerWaalsContact O-N 3.12Å; Q92-T94 VanDerWaalsContact C-N 3.27Å; Q92-T94 PolarHBondContact O-N 3.09Å; T94-N96 VanDerWaalsContact C-N 3.35Å; T94-N96 PolarHBondContact O-N 3.03Å; T94-N97 PolarHBondContact O-N 2.91Å; T94-N97 VanDerWaalsContact O-N 3.17Å; T94-L98 WeakPolarHBondContact O-CG 3.26Å; T94-L98 PolarHBondContact O-N 3.18Å; T94-M390 HydrophobicContact CG2-CE 4.04Å; T94-M390 HydrophobicContact CG2-SD 3.54Å; T94-M390 VanDerWaalsContact CG2-SD 3.54Å
95	F	98.3	Very high	97.5	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.3	-44.2	176.9	-86.3	-84.2	0	0	0	113	L91 Q92 N97 L98 H99 L222 S225 I229 W285 I289 L387 M390	L91-F95 HydrophobicContact CD1-CD2 4.42Å; L91-F95 HydrophobicContact CD1-CE2 4.11Å; L91-F95 HydrophobicContact CG-CD2 4.18Å; L91-F95 HydrophobicContact CG-CE2 4.09Å; L91-F95 WeakPolarHBondContact O-CD2 3.38Å; L91-F95 PolarHBondContact O-N 3.19Å; L91-F95 VanDerWaalsContact O-N 3.11Å; Q92-F95 PolarHBondContact O-N 2.97Å; F95-N97 VanDerWaalsContact C-N 3.29Å; F95-N97 PolarHBondContact O-N 2.98Å; F95-L98 PolarHBondContact O-N 2.7Å; F95-H99 WeakPolarHBondContact O-CB 3.38Å; F95-H99 PolarHBondContact O-N 2.88Å; F95-L222 HydrophobicContact CD1-CB 4.43Å; F95-L222 HydrophobicContact CD1-CD2 3.7Å; F95-L222 HydrophobicContact CE1-CD2 4.08Å; F95-S225 VanDerWaalsContact CE1-CB 3.42Å; F95-I229 HydrophobicContact CD2-CD1 3.65Å; F95-I229 HydrophobicContact CE2-CD1 3.74Å; F95-W285 HydrophobicContact CE1-CH2 4.37Å; F95-W285 AromaticContact CE2-CH2 3.5Å; F95-W285 HydrophobicContact CE2-CH2 3.5Å; F95-W285 AromaticContact CE2-CZ2 3.69Å; F95-W285 HydrophobicContact CE2-CZ2 3.69Å; F95-W285 AromaticContact CZ-CH2 3.38Å; F95-W285 HydrophobicContact CZ-CH2 3.38Å; F95-W285 AromaticContact CZ-CZ2 3.61Å; F95-W285 HydrophobicContact CZ-CZ2 3.61Å; F95-I289 HydrophobicContact CZ-CD1 3.92Å; F95-L387 HydrophobicContact CE1-CD2 4.11Å; F95-L387 HydrophobicContact CZ-CD2 4.43Å; F95-M390 HydrophobicContact CD2-CE 4.23Å; F95-M390 HydrophobicContact CD2-SD 3.94Å; F95-M390 HydrophobicContact CE1-CE 4.32Å; F95-M390 HydrophobicContact CE2-CE 3.74Å; F95-M390 HydrophobicContact CE2-SD 3.57Å; F95-M390 VanDerWaalsContact CE2-SD 3.57Å; F95-M390 HydrophobicContact CZ-CE 3.79Å; F95-M390 HydrophobicContact CZ-SD 4.22Å
96	N	97.9	Very high	97.5	Very high	52 Å²	52	50.2 Å²	50.2	28%	0.278	26%	0.261	S	S	.	.	H	α-helix	trans	-64.9	-34.1	178.9	-67.7	-22.8	0	0	0	112	Q92 A93 T94 R100 S226	Q92-N96 WeakPolarHBondContact O-CB 3.45Å; Q92-N96 PolarHBondContact O-N 3.09Å; Q92-N96 PolarHBondContact O-ND2 3.29Å; A93-N96 PolarHBondContact O-N 3.48Å; T94-N96 VanDerWaalsContact C-N 3.35Å; T94-N96 PolarHBondContact O-N 3.03Å; N96-R100 VanDerWaalsContact O-CG 3.27Å; N96-R100 WeakPolarHBondContact O-CG 3.39Å; N96-R100 PolarHBondContact O-N 3.46Å; N96-S226 PolarHBondContact OD1-OG 3.5Å
97	N	97.7	Very high	97.4	Very high	89 Å²	89	46.8 Å²	46.8	48%	0.476	25%	0.249	S	C	.	.	H	α-helix	trans	-70.9	-43.1	175.1	-71.9	-20.2	0	0	0	111.7	A93 T94 F95 H99 R100 S101	A93-N97 WeakPolarHBondContact O-CB 3.34Å; A93-N97 PolarHBondContact O-N 3.16Å; A93-N97 PolarHBondContact O-ND2 3.02Å; T94-N97 PolarHBondContact O-N 2.91Å; T94-N97 VanDerWaalsContact O-N 3.17Å; F95-N97 VanDerWaalsContact C-N 3.29Å; F95-N97 PolarHBondContact O-N 2.98Å; N97-H99 VanDerWaalsContact C-N 3.32Å; N97-H99 PolarHBondContact O-N 3.25Å; N97-R100 PolarHBondContact O-N 2.85Å; N97-R100 PolarHBondContact OD1-NH1 3.05Å; N97-S101 WeakPolarHBondContact O-CB 3.49Å; N97-S101 PolarHBondContact O-N 3.43Å
98	L	97.5	Very high	97.4	Very high	7 Å²	7	48.9 Å²	48.9	4%	0.037	25%	0.253	C	S	.	.	H	α-helix	trans	-58.7	-45.5	173.6	-66.9	-176	0	0	0	111.2	T94 F95 S101 F102 L222 L383 K386 L387 M390	T94-L98 WeakPolarHBondContact O-CG 3.26Å; T94-L98 PolarHBondContact O-N 3.18Å; F95-L98 PolarHBondContact O-N 2.7Å; L98-S101 PolarHBondContact O-N 3.42Å; L98-F102 WeakPolarHBondContact O-CB 3.42Å; L98-F102 PolarHBondContact O-N 3.42Å; L98-L222 HydrophobicContact CB-CD1 4.33Å; L98-L222 HydrophobicContact CB-CD2 4.04Å; L98-L222 HydrophobicContact CD1-CD2 4.26Å; L98-L383 HydrophobicContact CB-CD2 3.94Å; L98-L383 HydrophobicContact CD1-CD2 4.42Å; L98-L383 HydrophobicContact CD2-CD2 3.96Å; L98-L383 HydrophobicContact CG-CD2 4.3Å; L98-K386 HydrophobicContact CD1-CB 3.94Å; L98-K386 HydrophobicContact CD2-CB 3.97Å; L98-K386 HydrophobicContact CD2-CG 4.03Å; L98-K386 HydrophobicContact CG-CB 4.45Å; L98-L387 HydrophobicContact CD1-CD2 4.41Å; L98-L387 HydrophobicContact CD1-CG 4.37Å; L98-M390 HydrophobicContact CD1-CE 3.91Å
99	H	97.7	Very high	97.2	Very high	44 Å²	44	49.3 Å²	49.3	20%	0.204	26%	0.255	C	S	.	.	H	α-helix	trans	-56.2	-54.6	175.7	169	-89.8	0	0	0	111.4	F95 N97 S101 F102 D103 V219 L222 V223	F95-H99 WeakPolarHBondContact O-CB 3.38Å; F95-H99 PolarHBondContact O-N 2.88Å; N97-H99 VanDerWaalsContact C-N 3.32Å; N97-H99 PolarHBondContact O-N 3.25Å; H99-S101 VanDerWaalsContact C-N 3.34Å; H99-S101 PolarHBondContact O-N 3.46Å; H99-F102 PolarHBondContact O-N 2.88Å; H99-D103 WeakPolarHBondContact O-CB 3.24Å; H99-D103 PolarHBondContact O-N 2.96Å; H99-V219 WeakPolarHBondContact CD2-CG1 3.43Å; H99-V219 VanDerWaalsContact NE2-CG1 3.26Å; H99-V219 WeakPolarHBondContact NE2-CG1 3.29Å; H99-L222 HydrophobicContact CB-CB 4.13Å; H99-L222 HydrophobicContact CB-CD1 4.16Å; H99-V223 VanDerWaalsContact CD2-CG2 3.48Å; H99-V223 WeakPolarHBondContact CD2-CG2 3.26Å
100	R	97.8	Very high	97.1	Very high	144 Å²	144	41.2 Å²	41.2	54%	0.543	23%	0.225	S	C	.	.	H	α-helix	trans	-60.9	-41.3	-179.9	-71.8	173.8	-165.4	141.4	-1.1	112.4	N96 N97 T104	N96-R100 VanDerWaalsContact O-CG 3.27Å; N96-R100 WeakPolarHBondContact O-CG 3.39Å; N96-R100 PolarHBondContact O-N 3.46Å; N97-R100 PolarHBondContact O-N 2.85Å; N97-R100 PolarHBondContact OD1-NH1 3.05Å; R100-T104 VanDerWaalsContact O-CB 3.28Å; R100-T104 WeakPolarHBondContact O-CB 3.27Å; R100-T104 PolarHBondContact O-N 2.97Å; R100-T104 PolarHBondContact O-OG1 2.88Å
101	S	96.9	Very high	97.1	Very high	40 Å²	40	38.1 Å²	38.1	28%	0.28	21%	0.206	S	C	.	.	H	α-helix	trans	-61.4	-51.8	179.6	-175.8	0	0	0	0	111	N97 L98 H99 T104 Y105 Q379	N97-S101 WeakPolarHBondContact O-CB 3.49Å; N97-S101 PolarHBondContact O-N 3.43Å; L98-S101 PolarHBondContact O-N 3.42Å; H99-S101 VanDerWaalsContact C-N 3.34Å; H99-S101 PolarHBondContact O-N 3.46Å; S101-T104 PolarHBondContact O-N 3.27Å; S101-Y105 WeakPolarHBondContact O-CB 3.23Å; S101-Y105 PolarHBondContact O-N 3.31Å; S101-Q379 PolarHBondContact OG-NE2 3.06Å; S101-Q379 PolarHBondContact OG-OE1 2.88Å
102	F	97.4	Very high	96.9	Very high	1 Å²	1	41.8 Å²	41.8	0%	0.004	22%	0.223	C	C	.	.	H	α-helix	trans	-68.9	-42	-178.2	-175.8	-100.9	0	0	0	112.5	L98 H99 T104 Y105 F106 A215 F218 V219 F299 M305 L383	L98-F102 WeakPolarHBondContact O-CB 3.42Å; L98-F102 PolarHBondContact O-N 3.42Å; H99-F102 PolarHBondContact O-N 2.88Å; F102-T104 PolarHBondContact O-N 3.45Å; F102-Y105 HydrophobicContact CD2-CD1 4.5Å; F102-Y105 HydrophobicContact CE2-CD1 4.46Å; F102-Y105 PolarHBondContact O-N 3.29Å; F102-F106 WeakPolarHBondContact O-CB 3.38Å; F102-F106 PolarHBondContact O-N 3.03Å; F102-A215 HydrophobicContact CE1-CB 4.18Å; F102-A215 HydrophobicContact CZ-CB 4.33Å; F102-F218 AromaticContact CD1-CD1 3.76Å; F102-F218 HydrophobicContact CD1-CD1 3.76Å; F102-F218 HydrophobicContact CD1-CE1 4.18Å; F102-F218 HydrophobicContact CD2-CE1 4.4Å; F102-F218 AromaticContact CE1-CD1 3.83Å; F102-F218 HydrophobicContact CE1-CD1 3.83Å; F102-F218 HydrophobicContact CG-CD1 4.14Å; F102-F218 HydrophobicContact CG-CE1 4.09Å; F102-F218 HydrophobicContact CZ-CD1 4.28Å; F102-V219 HydrophobicContact CD1-CG2 3.62Å; F102-V219 HydrophobicContact CE1-CG2 3.98Å; F102-F299 HydrophobicContact CD2-CE2 4.3Å; F102-F299 HydrophobicContact CE1-CE2 4.17Å; F102-F299 HydrophobicContact CE1-CZ 4.19Å; F102-F299 AromaticContact CE2-CD2 3.67Å; F102-F299 HydrophobicContact CE2-CD2 3.67Å; F102-F299 AromaticContact CE2-CE2 3.33Å; F102-F299 HydrophobicContact CE2-CE2 3.33Å; F102-F299 HydrophobicContact CE2-CZ 4.07Å; F102-F299 AromaticContact CZ-CD2 3.91Å; F102-F299 HydrophobicContact CZ-CD2 3.91Å; F102-F299 HydrophobicContact CZ-CE1 4.32Å; F102-F299 AromaticContact CZ-CE2 3.25Å; F102-F299 HydrophobicContact CZ-CE2 3.25Å; F102-F299 AromaticContact CZ-CZ 3.48Å; F102-F299 HydrophobicContact CZ-CZ 3.48Å; F102-F299 VanDerWaalsContact CZ-CZ 3.48Å; F102-M305 HydrophobicContact CZ-SD 4.24Å; F102-L383 HydrophobicContact CB-CD1 4.47Å; F102-L383 HydrophobicContact CD2-CD1 3.79Å; F102-L383 HydrophobicContact CE2-CD1 4.47Å; F102-L383 HydrophobicContact CG-CD1 4.38Å
103	D	97.3	Very high	96.8	Very high	52 Å²	52	40.6 Å²	40.6	28%	0.278	22%	0.217	S	C	.	.	H	α-helix	trans	-58.9	-45.3	175.4	176.4	68.2	0	0	0	111.7	H99 Y105 F106 T107 Y146	H99-D103 WeakPolarHBondContact O-CB 3.24Å; H99-D103 PolarHBondContact O-N 2.96Å; D103-Y105 PolarHBondContact O-N 3.21Å; D103-F106 PolarHBondContact O-N 2.95Å; D103-T107 WeakPolarHBondContact O-CB 3.38Å; D103-T107 VanDerWaalsContact O-CG2 3.26Å; D103-T107 WeakPolarHBondContact O-CG2 3.28Å; D103-T107 PolarHBondContact O-N 2.73Å; D103-T107 PolarHBondContact O-OG1 2.96Å; D103-Y146 WeakPolarHBondContact OD1-CE1 3.31Å; D103-Y146 PolarHBondContact OD1-OH 3.48Å
104	T	96.6	Very high	96.7	Very high	65 Å²	65	41 Å²	41	40%	0.399	21%	0.212	S	C	.	.	H	α-helix	trans	-61.5	-46.7	175.6	-56.9	0	0	0	0	110.8	R100 S101 F102 T107 E108	R100-T104 VanDerWaalsContact O-CB 3.28Å; R100-T104 WeakPolarHBondContact O-CB 3.27Å; R100-T104 PolarHBondContact O-N 2.97Å; R100-T104 PolarHBondContact O-OG1 2.88Å; S101-T104 PolarHBondContact O-N 3.27Å; F102-T104 PolarHBondContact O-N 3.45Å; T104-T107 PolarHBondContact O-OG1 3.43Å; T104-E108 HydrophobicContact CG2-CG 4.27Å; T104-E108 VanDerWaalsContact O-CB 3.25Å; T104-E108 WeakPolarHBondContact O-CB 3.36Å; T104-E108 VanDerWaalsContact O-CG 3.27Å; T104-E108 WeakPolarHBondContact O-CG 3.19Å; T104-E108 PolarHBondContact O-N 3.09Å
105	Y	95.9	Very high	96.6	Very high	14 Å²	14	47.4 Å²	47.4	6%	0.055	23%	0.23	C	C	.	.	H	α-helix	trans	-58.6	-50.9	178.2	168.3	-98	0	0	0	112.2	S101 F102 D103 E108 L109 D306 R375 L376 Q379	S101-Y105 WeakPolarHBondContact O-CB 3.23Å; S101-Y105 PolarHBondContact O-N 3.31Å; F102-Y105 HydrophobicContact CD2-CD1 4.5Å; F102-Y105 HydrophobicContact CE2-CD1 4.46Å; F102-Y105 PolarHBondContact O-N 3.29Å; D103-Y105 PolarHBondContact O-N 3.21Å; Y105-E108 PolarHBondContact O-N 3.36Å; Y105-L109 HydrophobicContact CE1-CD2 4.21Å; Y105-L109 VanDerWaalsContact O-CB 3.29Å; Y105-L109 WeakPolarHBondContact O-CB 3.28Å; Y105-L109 PolarHBondContact O-N 2.82Å; Y105-D306 WeakPolarHBondContact OH-CB 3.31Å; Y105-R375 HydrophobicContact CE2-CB 4.31Å; Y105-L376 HydrophobicContact CE1-CD1 3.77Å; Y105-L376 WeakPolarHBondContact OH-CB 3.31Å; Y105-Q379 HydrophobicContact CD2-CG 4.11Å; Y105-Q379 HydrophobicContact CG-CG 4.1Å
106	F	96.9	Very high	96.4	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.009	24%	0.24	C	C	.	.	H	α-helix	trans	-63.5	-46.1	-177.9	-174.9	-85.5	0	0	0	111.6	F102 D103 L109 H110 Y146 F212 A215 M305 L309	F102-F106 WeakPolarHBondContact O-CB 3.38Å; F102-F106 PolarHBondContact O-N 3.03Å; D103-F106 PolarHBondContact O-N 2.95Å; F106-L109 PolarHBondContact O-N 3.02Å; F106-H110 WeakPolarHBondContact O-CB 3.39Å; F106-H110 PolarHBondContact O-N 3.1Å; F106-Y146 HydrophobicContact CD1-CD1 4.01Å; F106-Y146 AromaticContact CD1-CD2 3.75Å; F106-Y146 HydrophobicContact CD1-CD2 3.75Å; F106-Y146 AromaticContact CD1-CE1 3.75Å; F106-Y146 HydrophobicContact CD1-CE1 3.75Å; F106-Y146 AromaticContact CD1-CE2 3.48Å; F106-Y146 HydrophobicContact CD1-CE2 3.48Å; F106-Y146 VanDerWaalsContact CD1-CE2 3.48Å; F106-Y146 AromaticContact CD1-CG 3.99Å; F106-Y146 HydrophobicContact CD1-CG 3.99Å; F106-Y146 AromaticContact CD1-CZ 3.45Å; F106-Y146 VanDerWaalsContact CD1-CZ 3.45Å; F106-Y146 HydrophobicContact CD2-CE2 4.4Å; F106-Y146 HydrophobicContact CE1-CD1 4.1Å; F106-Y146 AromaticContact CE1-CD2 3.4Å; F106-Y146 HydrophobicContact CE1-CD2 3.4Å; F106-Y146 HydrophobicContact CE1-CE1 4.27Å; F106-Y146 AromaticContact CE1-CE2 3.61Å; F106-Y146 HydrophobicContact CE1-CE2 3.61Å; F106-Y146 AromaticContact CE1-CG 3.65Å; F106-Y146 HydrophobicContact CE1-CG 3.65Å; F106-Y146 HydrophobicContact CE2-CE2 4.49Å; F106-Y146 AromaticContact CG-CE2 3.92Å; F106-Y146 HydrophobicContact CG-CE2 3.92Å; F106-Y146 AromaticContact CG-CZ 3.89Å; F106-Y146 AromaticContact CZ-CD2 3.92Å; F106-Y146 HydrophobicContact CZ-CD2 3.92Å; F106-Y146 HydrophobicContact CZ-CE2 4.13Å; F106-F212 HydrophobicContact CE1-CD1 4.17Å; F106-F212 AromaticContact CE1-CE1 3.84Å; F106-F212 HydrophobicContact CE1-CE1 3.84Å; F106-F212 HydrophobicContact CE1-CZ 4.37Å; F106-F212 AromaticContact CZ-CD1 3.85Å; F106-F212 HydrophobicContact CZ-CD1 3.85Å; F106-F212 HydrophobicContact CZ-CD2 4.5Å; F106-F212 AromaticContact CZ-CE1 3.79Å; F106-F212 HydrophobicContact CZ-CE1 3.79Å; F106-F212 HydrophobicContact CZ-CE2 4.48Å; F106-F212 HydrophobicContact CZ-CG 4.22Å; F106-F212 HydrophobicContact CZ-CZ 4.13Å; F106-A215 HydrophobicContact CD2-CB 3.6Å; F106-A215 HydrophobicContact CE2-CB 3.25Å; F106-A215 HydrophobicContact CG-CB 4.43Å; F106-A215 HydrophobicContact CZ-CB 3.88Å; F106-M305 HydrophobicContact CD2-SD 3.8Å; F106-M305 HydrophobicContact CE2-CE 4.33Å; F106-M305 HydrophobicContact CE2-SD 3.91Å; F106-L309 HydrophobicContact CD2-CD1 3.93Å; F106-L309 HydrophobicContact CE2-CD1 3.57Å; F106-L309 HydrophobicContact CZ-CD1 3.98Å; F106-L309 HydrophobicContact CZ-CD2 4.38Å
107	T	96.9	Very high	96.3	Very high	57 Å²	57	46.7 Å²	46.7	35%	0.35	23%	0.229	S	C	.	.	H	α-helix	trans	-69.2	-37.5	-179.1	55.9	0	0	0	0	112.6	D103 T104 G111 Y146	D103-T107 WeakPolarHBondContact O-CB 3.38Å; D103-T107 VanDerWaalsContact O-CG2 3.26Å; D103-T107 WeakPolarHBondContact O-CG2 3.28Å; D103-T107 PolarHBondContact O-N 2.73Å; D103-T107 PolarHBondContact O-OG1 2.96Å; T104-T107 PolarHBondContact O-OG1 3.43Å; T107-G111 PolarHBondContact O-N 3.28Å; T107-Y146 HydrophobicContact CG2-CD1 4.24Å; T107-Y146 HydrophobicContact CG2-CE1 3.78Å
108	E	95.3	Very high	96	Very high	75 Å²	75	49.1 Å²	49.1	35%	0.35	24%	0.238	S	C	.	.	H	α-helix	trans	-60.7	-46.4	172	-82.2	-175.7	-176.9	0	0	111.5	T104 Y105 G111 Q112 R375	T104-E108 HydrophobicContact CG2-CG 4.27Å; T104-E108 VanDerWaalsContact O-CB 3.25Å; T104-E108 WeakPolarHBondContact O-CB 3.36Å; T104-E108 VanDerWaalsContact O-CG 3.27Å; T104-E108 WeakPolarHBondContact O-CG 3.19Å; T104-E108 PolarHBondContact O-N 3.09Å; Y105-E108 PolarHBondContact O-N 3.36Å; E108-G111 PolarHBondContact O-N 2.87Å; E108-Q112 WeakPolarHBondContact O-CB 3.33Å; E108-Q112 VanDerWaalsContact O-CG 3.24Å; E108-Q112 WeakPolarHBondContact O-CG 3.37Å; E108-Q112 PolarHBondContact O-N 3.21Å; E108-R375 IonicContact OE2-CZ 2.71Å; E108-R375 IonicContact OE2-NH1 3.69Å; E108-R375 PolarHBondContact OE2-NH1 2.96Å; E108-R375 IonicContact OE2-NH2 2.74Å
109	L	94.4	Very high	95.8	Very high	9 Å²	9	56.1 Å²	56.1	5%	0.047	27%	0.27	C	S	.	.	H	α-helix	trans	-63.7	-48.5	-178.9	178.6	65.2	0	0	0	111.4	Y105 F106 G111 Q112 S113 D306 L309 S310	Y105-L109 HydrophobicContact CE1-CD2 4.21Å; Y105-L109 VanDerWaalsContact O-CB 3.29Å; Y105-L109 WeakPolarHBondContact O-CB 3.28Å; Y105-L109 PolarHBondContact O-N 2.82Å; F106-L109 PolarHBondContact O-N 3.02Å; L109-G111 VanDerWaalsContact C-N 3.34Å; L109-G111 PolarHBondContact O-N 3.11Å; L109-Q112 PolarHBondContact O-N 3.35Å; L109-S113 PolarHBondContact O-N 3.48Å; L109-D306 HydrophobicContact CD1-CB 4.44Å; L109-D306 HydrophobicContact CD2-CB 4Å; L109-L309 HydrophobicContact CD2-CB 4.11Å; L109-L309 HydrophobicContact CD2-CD1 3.6Å; L109-L309 HydrophobicContact CD2-CG 4.42Å; L109-L309 HydrophobicContact CG-CB 4.17Å; L109-L309 HydrophobicContact CG-CD1 4.15Å; L109-S310 WeakPolarHBondContact CD1-OG 3.27Å
110	H	95.8	Very high	95.6	Very high	7 Å²	7	55.9 Å²	55.9	3%	0.032	27%	0.272	C	S	.	.	H	α-helix	trans	-60	-43.5	175	-179.3	-107.5	0	0	0	111.9	F106 Q112 S113 E114 Y139 F212	F106-H110 WeakPolarHBondContact O-CB 3.39Å; F106-H110 PolarHBondContact O-N 3.1Å; H110-Q112 VanDerWaalsContact C-N 3.31Å; H110-Q112 PolarHBondContact O-N 3.12Å; H110-S113 WeakPolarHBondContact O-CB 3.32Å; H110-S113 PolarHBondContact O-N 3.02Å; H110-E114 PolarHBondContact O-N 3.36Å; H110-Y139 AromaticContact CD2-CD1 3.97Å; H110-Y139 AromaticContact CE1-CD1 3.6Å; H110-Y139 PolarHBondContact CE1-O 2.94Å; H110-Y139 AromaticContact NE2-CD1 3.33Å; H110-Y139 VanDerWaalsContact NE2-CD1 3.33Å; H110-Y139 WeakPolarHBondContact NE2-CD1 3.47Å; H110-Y139 AromaticContact NE2-CE1 3.9Å; H110-F212 AromaticContact CD2-CZ 3.54Å; H110-F212 AromaticContact NE2-CZ 3.74Å
111	G	96.4	Very high	95.5	Very high	14 Å²	14	49 Å²	49	14%	0.144	25%	0.246	C	C	.	.	H	α-helix	trans	-70	-22.6	176.6	0	0	0	0	0	114.4	T107 E108 L109 R115	T107-G111 PolarHBondContact O-N 3.28Å; E108-G111 PolarHBondContact O-N 2.87Å; L109-G111 VanDerWaalsContact C-N 3.34Å; L109-G111 PolarHBondContact O-N 3.11Å; G111-R115 WeakPolarHBondContact O-CG 3.32Å; G111-R115 PolarHBondContact O-N 3.34Å; G111-R115 PolarHBondContact O-NE 2.94Å
112	Q	94.5	Very high	95.3	Very high	89 Å²	89	50.4 Å²	50.4	42%	0.416	26%	0.255	S	S	.	.	H	α-helix	trans	-73.9	-42.6	170.1	-76.7	170.5	49.4	0	0	111	E108 L109 H110 E114 R115 S116	E108-Q112 WeakPolarHBondContact O-CB 3.33Å; E108-Q112 VanDerWaalsContact O-CG 3.24Å; E108-Q112 WeakPolarHBondContact O-CG 3.37Å; E108-Q112 PolarHBondContact O-N 3.21Å; L109-Q112 PolarHBondContact O-N 3.35Å; H110-Q112 VanDerWaalsContact C-N 3.31Å; H110-Q112 PolarHBondContact O-N 3.12Å; Q112-E114 VanDerWaalsContact C-N 3.32Å; Q112-E114 PolarHBondContact O-N 2.87Å; Q112-R115 VanDerWaalsContact CG-NH2 3.28Å; Q112-R115 PolarHBondContact O-N 2.59Å; Q112-S116 PolarHBondContact O-N 3.44Å
113	S	95.6	Very high	95.1	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.014	28%	0.282	C	S	.	.	H	α-helix	trans	-58.4	-42	173.3	-178.6	0	0	0	0	112	L109 H110 R115 S116 Y139 L309 P313	L109-S113 PolarHBondContact O-N 3.48Å; H110-S113 WeakPolarHBondContact O-CB 3.32Å; H110-S113 PolarHBondContact O-N 3.02Å; S113-R115 PolarHBondContact O-N 3.38Å; S113-S116 PolarHBondContact O-N 3.37Å; S113-S116 PolarHBondContact O-OG 2.99Å; S113-Y139 PolarHBondContact O-OH 3.28Å; S113-Y139 PolarHBondContact OG-OH 3.31Å; S113-L309 VanDerWaalsContact CB-O 3.26Å; S113-L309 WeakPolarHBondContact CB-O 3.39Å; S113-L309 PolarHBondContact OG-O 3.35Å; S113-P313 WeakPolarHBondContact O-CG 3.36Å; S113-P313 WeakPolarHBondContact OG-CD 3.26Å
114	E	96.9	Very high	94.9	Very high	54 Å²	54	52.6 Å²	52.6	25%	0.252	27%	0.272	S	S	.	.	H	α-helix	trans	-62.3	-43	175	-170.7	179.2	-139.5	0	0	112	H110 Q112 S116 L117 Y139 R143	H110-E114 PolarHBondContact O-N 3.36Å; Q112-E114 VanDerWaalsContact C-N 3.32Å; Q112-E114 PolarHBondContact O-N 2.87Å; E114-S116 VanDerWaalsContact C-N 3.29Å; E114-S116 PolarHBondContact O-N 3.17Å; E114-L117 HydrophobicContact CG-CD1 4.29Å; E114-L117 VanDerWaalsContact O-CB 3.27Å; E114-L117 WeakPolarHBondContact O-CB 3.42Å; E114-L117 WeakPolarHBondContact O-CD1 3.43Å; E114-L117 WeakPolarHBondContact O-CG 3.22Å; E114-L117 PolarHBondContact O-N 3.49Å; E114-Y139 VanDerWaalsContact CA-CE1 3.44Å; E114-Y139 HydrophobicContact CB-CD1 3.45Å; E114-Y139 VanDerWaalsContact CB-CD1 3.45Å; E114-Y139 HydrophobicContact CB-CE1 3.69Å; E114-Y139 HydrophobicContact CB-CG 4.01Å; E114-Y139 HydrophobicContact CG-CD1 3.85Å; E114-Y139 HydrophobicContact CG-CE1 4.43Å; E114-Y139 HydrophobicContact CG-CG 3.88Å; E114-Y139 VanDerWaalsContact N-CE1 3.26Å; E114-Y139 WeakPolarHBondContact OE1-CB 3.4Å; E114-R143 IonicContact OE1-NH2 3.25Å; E114-R143 PolarHBondContact OE1-NH2 3.35Å; E114-R143 IonicContact OE2-CZ 3.89Å; E114-R143 IonicContact OE2-NH2 2.87Å; E114-R143 PolarHBondContact OE2-NH2 3.15Å
115	R	95.2	Very high	94.7	Very high	178 Å²	178	50.9 Å²	50.9	67%	0.672	27%	0.267	S	S	*	.	H	α-helix	trans	-67.6	-27.5	-180	-77.6	179.8	-77.1	153.8	-11	113.2	G111 Q112 S113 L117	G111-R115 WeakPolarHBondContact O-CG 3.32Å; G111-R115 PolarHBondContact O-N 3.34Å; G111-R115 PolarHBondContact O-NE 2.94Å; Q112-R115 VanDerWaalsContact CG-NH2 3.28Å; Q112-R115 PolarHBondContact O-N 2.59Å; S113-R115 PolarHBondContact O-N 3.38Å; R115-L117 VanDerWaalsContact C-N 3.28Å
116	S	94.3	Very high	94.5	Very high	30 Å²	30	54.1 Å²	54.1	21%	0.21	29%	0.29	C	S	.	.	H	α-helix	trans	-79.1	-9.3	177.3	67.5	0	0	0	0	113.5	Q112 S113 E114 Q118 E119 V120	Q112-S116 PolarHBondContact O-N 3.44Å; S113-S116 PolarHBondContact O-N 3.37Å; S113-S116 PolarHBondContact O-OG 2.99Å; E114-S116 VanDerWaalsContact C-N 3.29Å; E114-S116 PolarHBondContact O-N 3.17Å; S116-Q118 VanDerWaalsContact C-N 3.27Å; S116-Q118 PolarHBondContact O-N 3.07Å; S116-E119 PolarHBondContact O-N 3.26Å; S116-E119 VanDerWaalsContact O-N 3.17Å; S116-V120 WeakPolarHBondContact O-CB 3.29Å; S116-V120 WeakPolarHBondContact O-CG2 3.2Å; S116-V120 PolarHBondContact O-N 3.49Å
117	L	94.3	Very high	94.3	Very high	8 Å²	8	54.5 Å²	54.5	4%	0.042	29%	0.292	C	S	.	.	H	α-helix	trans	-50.8	-46.6	175.7	-77.5	169.5	0	0	0	112.2	E114 R115 E119 V120 L121 F135 Y139 P313	E114-L117 HydrophobicContact CG-CD1 4.29Å; E114-L117 VanDerWaalsContact O-CB 3.27Å; E114-L117 WeakPolarHBondContact O-CB 3.42Å; E114-L117 WeakPolarHBondContact O-CD1 3.43Å; E114-L117 WeakPolarHBondContact O-CG 3.22Å; E114-L117 PolarHBondContact O-N 3.49Å; R115-L117 VanDerWaalsContact C-N 3.28Å; L117-E119 PolarHBondContact O-N 2.84Å; L117-V120 PolarHBondContact O-N 3.27Å; L117-L121 HydrophobicContact CB-CD1 4.49Å; L117-L121 HydrophobicContact CD2-CD1 3.56Å; L117-L121 HydrophobicContact CD2-CG 4.32Å; L117-L121 WeakPolarHBondContact O-CB 3.41Å; L117-L121 WeakPolarHBondContact O-CG 3.33Å; L117-L121 PolarHBondContact O-N 3.45Å; L117-F135 HydrophobicContact CD1-CB 4.09Å; L117-F135 HydrophobicContact CD2-CB 4.46Å; L117-Y139 HydrophobicContact CD1-CD2 3.8Å; L117-Y139 HydrophobicContact CD1-CE2 3.62Å; L117-Y139 HydrophobicContact CD2-CE2 3.9Å; L117-Y139 HydrophobicContact CG-CE2 3.96Å; L117-P313 HydrophobicContact CD2-CB 3.95Å; L117-P313 HydrophobicContact CD2-CG 3.95Å; L117-P313 HydrophobicContact CG-CG 4.27Å
118	Q	92.8	Very high	94.1	Very high	140 Å²	140	53.6 Å²	53.6	65%	0.654	28%	0.282	S	S	*	.	H	α-helix	trans	-63.7	-43.4	-177.8	179.3	172	-9	0	0	112.3	S116 S122 Y128	S116-Q118 VanDerWaalsContact C-N 3.27Å; S116-Q118 PolarHBondContact O-N 3.07Å; Q118-S122 WeakPolarHBondContact O-CB 3.26Å; Q118-S122 PolarHBondContact O-N 2.97Å; Q118-S122 VanDerWaalsContact O-N 3.15Å; Q118-Y128 VanDerWaalsContact CA-OH 3.22Å; Q118-Y128 WeakPolarHBondContact CA-OH 3.31Å; Q118-Y128 HydrophobicContact CB-CE1 4.34Å; Q118-Y128 HydrophobicContact CG-CE1 4.3Å; Q118-Y128 PolarHBondContact N-OH 3.36Å
119	E	92.8	Very high	94	Very high	154 Å²	154	53.9 Å²	53.9	72%	0.72	29%	0.293	S	S	*	.	H	α-helix	trans	-64.2	-52	178.7	-176	-179.6	176.3	0	0	110.4	S116 L117 S122	S116-E119 PolarHBondContact O-N 3.26Å; S116-E119 VanDerWaalsContact O-N 3.17Å; L117-E119 PolarHBondContact O-N 2.84Å; E119-S122 PolarHBondContact O-OG 3.49Å
120	V	94	Very high	94	Very high	39 Å²	39	60.9 Å²	60.9	24%	0.236	33%	0.325	C	S	.	.	H	α-helix	trans	-72.2	-38.6	-172.5	178	0	0	0	0	112.8	S116 L117 P123 P313 I314	S116-V120 WeakPolarHBondContact O-CB 3.29Å; S116-V120 WeakPolarHBondContact O-CG2 3.2Å; S116-V120 PolarHBondContact O-N 3.49Å; L117-V120 PolarHBondContact O-N 3.27Å; V120-P123 VanDerWaalsContact O-CD 3.26Å; V120-P123 WeakPolarHBondContact O-CD 3.36Å; V120-P313 HydrophobicContact CB-CB 3.91Å; V120-P313 HydrophobicContact CG1-CB 3.92Å; V120-P313 HydrophobicContact CG2-CB 4.2Å; V120-I314 HydrophobicContact CG1-CB 4.11Å; V120-I314 HydrophobicContact CG1-CD1 4.16Å
121	L	94.9	Very high	93.9	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-93	-8.7	-176	-58.1	-177.5	0	0	0	113.6	L117 P123 L124 Y128 F135 P313 I316	L117-L121 HydrophobicContact CB-CD1 4.49Å; L117-L121 HydrophobicContact CD2-CD1 3.56Å; L117-L121 HydrophobicContact CD2-CG 4.32Å; L117-L121 WeakPolarHBondContact O-CB 3.41Å; L117-L121 WeakPolarHBondContact O-CG 3.33Å; L117-L121 PolarHBondContact O-N 3.45Å; L121-P123 VanDerWaalsContact C-N 3.28Å; L121-L124 HydrophobicContact CB-CD1 4.33Å; L121-L124 HydrophobicContact CD2-CD1 3.97Å; L121-L124 VanDerWaalsContact O-CB 3.29Å; L121-L124 WeakPolarHBondContact O-CB 3.28Å; L121-L124 PolarHBondContact O-N 3.41Å; L121-Y128 HydrophobicContact CB-CD1 4.36Å; L121-Y128 HydrophobicContact CB-CD2 3.4Å; L121-Y128 HydrophobicContact CB-CE2 3.8Å; L121-Y128 HydrophobicContact CB-CG 3.72Å; L121-Y128 HydrophobicContact CD1-CD2 3.72Å; L121-Y128 HydrophobicContact CD1-CE2 3.81Å; L121-Y128 HydrophobicContact CG-CD2 4.2Å; L121-Y128 HydrophobicContact CG-CE2 4.38Å; L121-Y128 WeakPolarHBondContact O-CB 3.42Å; L121-F135 HydrophobicContact CD1-CD1 3.9Å; L121-F135 HydrophobicContact CD1-CD2 4.45Å; L121-F135 HydrophobicContact CD1-CE1 3.96Å; L121-F135 HydrophobicContact CD1-CE2 4.49Å; L121-F135 HydrophobicContact CD1-CG 4.17Å; L121-F135 HydrophobicContact CD1-CZ 4.25Å; L121-P313 WeakPolarHBondContact CD2-O 3.39Å; L121-I316 HydrophobicContact CD1-CG2 4.21Å; L121-I316 HydrophobicContact CD2-CB 4.28Å; L121-I316 HydrophobicContact CD2-CG2 3.98Å
122	S	93.2	Very high	93.8	Very high	68 Å²	68	63.3 Å²	63.3	48%	0.476	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-52.2	-34.5	176.6	62.1	0	0	0	0	115.3	Q118 E119 L124 G125	Q118-S122 WeakPolarHBondContact O-CB 3.26Å; Q118-S122 PolarHBondContact O-N 2.97Å; Q118-S122 VanDerWaalsContact O-N 3.15Å; E119-S122 PolarHBondContact O-OG 3.49Å; S122-L124 PolarHBondContact O-N 3.41Å; S122-L124 VanDerWaalsContact O-N 3.16Å; S122-G125 PolarHBondContact O-N 3.44Å
123	P	93.9	Very high	93.9	Very high	88 Å²	88	68.1 Å²	68.1	57%	0.571	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-66.6	-15.2	178.1	-17.8	32.6	0	0	0	113.7	V120 L121 G125 Y317	V120-P123 VanDerWaalsContact O-CD 3.26Å; V120-P123 WeakPolarHBondContact O-CD 3.36Å; L121-P123 VanDerWaalsContact C-N 3.28Å; P123-G125 PolarHBondContact O-N 2.84Å; P123-Y317 HydrophobicContact CB-CE2 3.95Å; P123-Y317 HydrophobicContact CG-CE2 4.25Å
124	L	92.8	Very high	93.9	Very high	12 Å²	12	68.3 Å²	68.3	6%	0.063	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-73.3	-9.2	171.9	-56.4	180	0	0	0	112.9	L121 S122 L127 Y317 V320	L121-L124 HydrophobicContact CB-CD1 4.33Å; L121-L124 HydrophobicContact CD2-CD1 3.97Å; L121-L124 VanDerWaalsContact O-CB 3.29Å; L121-L124 WeakPolarHBondContact O-CB 3.28Å; L121-L124 PolarHBondContact O-N 3.41Å; S122-L124 PolarHBondContact O-N 3.41Å; S122-L124 VanDerWaalsContact O-N 3.16Å; L124-L127 HydrophobicContact CB-CB 4.41Å; L124-L127 PolarHBondContact O-N 2.96Å; L124-Y317 HydrophobicContact CD1-CD2 4.36Å; L124-Y317 HydrophobicContact CD2-CD2 3.72Å; L124-Y317 HydrophobicContact CD2-CE2 3.71Å; L124-Y317 HydrophobicContact CG-CD2 3.86Å; L124-Y317 HydrophobicContact CG-CE2 4.13Å; L124-V320 HydrophobicContact CD1-CB 4.16Å; L124-V320 HydrophobicContact CD1-CG1 4.04Å; L124-V320 HydrophobicContact CD1-CG2 4.29Å; L124-V320 HydrophobicContact CD2-CB 4.15Å; L124-V320 HydrophobicContact CD2-CG1 3.64Å; L124-V320 HydrophobicContact CG-CG1 4.44Å
125	G	92.3	Very high	93.9	Very high	29 Å²	29	65.9 Å²	65.9	30%	0.299	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	-128.6	173.4	0	0	0	0	0	113.2	S122 P123 L127 Y128 S129	S122-G125 PolarHBondContact O-N 3.44Å; P123-G125 PolarHBondContact O-N 2.84Å; G125-L127 PolarHBondContact O-N 3.31Å; G125-Y128 PolarHBondContact O-N 3.07Å; G125-Y128 VanDerWaalsContact O-N 3.11Å; G125-S129 PolarHBondContact O-N 2.98Å; G125-S129 VanDerWaalsContact O-N 3.09Å
126	P	91.8	Very high	94	Very high	81 Å²	81	59.8 Å²	59.8	53%	0.526	33%	0.333	S	S	.	.	H	α-helix	trans	-56.8	-31.4	-179	-26	35.2	0	0	0	114.5	Y128 S129 Q130	P126-Y128 PolarHBondContact O-N 3.26Å; P126-S129 WeakPolarHBondContact CA-OG 3.38Å; P126-S129 PolarHBondContact O-N 3.2Å; P126-Q130 VanDerWaalsContact O-CB 3.26Å; P126-Q130 WeakPolarHBondContact O-CB 3.3Å; P126-Q130 WeakPolarHBondContact O-CG 3.17Å; P126-Q130 PolarHBondContact O-N 3.2Å
127	L	91.8	Very high	94.1	Very high	11 Å²	11	61.7 Å²	61.7	6%	0.058	34%	0.339	C	S	.	.	H	α-helix	trans	-62.7	-35.5	179.1	-177.7	62.8	0	0	0	111.3	L124 G125 N131 R167 T168 A171 V320	L124-L127 HydrophobicContact CB-CB 4.41Å; L124-L127 PolarHBondContact O-N 2.96Å; G125-L127 PolarHBondContact O-N 3.31Å; L127-N131 WeakPolarHBondContact O-CB 3.38Å; L127-N131 PolarHBondContact O-ND2 3.41Å; L127-R167 HydrophobicContact CD1-CB 4.47Å; L127-T168 HydrophobicContact CD2-CG2 3.91Å; L127-A171 HydrophobicContact CD1-CB 4.36Å; L127-V320 HydrophobicContact CD2-CG1 3.45Å; L127-V320 VanDerWaalsContact CD2-CG1 3.45Å
128	Y	93.4	Very high	94.2	Very high	38 Å²	38	61.7 Å²	61.7	15%	0.149	34%	0.338	C	S	.	.	H	α-helix	trans	-78.4	-53.3	172.5	173.7	-112.5	0	0	0	111.7	Q118 L121 G125 P126 Q130 N131 A132 F135	Q118-Y128 VanDerWaalsContact CA-OH 3.22Å; Q118-Y128 WeakPolarHBondContact CA-OH 3.31Å; Q118-Y128 HydrophobicContact CB-CE1 4.34Å; Q118-Y128 HydrophobicContact CG-CE1 4.3Å; Q118-Y128 PolarHBondContact N-OH 3.36Å; L121-Y128 HydrophobicContact CB-CD1 4.36Å; L121-Y128 HydrophobicContact CB-CD2 3.4Å; L121-Y128 HydrophobicContact CB-CE2 3.8Å; L121-Y128 HydrophobicContact CB-CG 3.72Å; L121-Y128 HydrophobicContact CD1-CD2 3.72Å; L121-Y128 HydrophobicContact CD1-CE2 3.81Å; L121-Y128 HydrophobicContact CG-CD2 4.2Å; L121-Y128 HydrophobicContact CG-CE2 4.38Å; L121-Y128 WeakPolarHBondContact O-CB 3.42Å; G125-Y128 PolarHBondContact O-N 3.07Å; G125-Y128 VanDerWaalsContact O-N 3.11Å; P126-Y128 PolarHBondContact O-N 3.26Å; Y128-Q130 VanDerWaalsContact C-N 3.33Å; Y128-Q130 PolarHBondContact O-N 2.85Å; Y128-N131 CarbonylContact O-C 3.55Å; Y128-N131 PolarHBondContact O-N 2.88Å; Y128-N131 VanDerWaalsContact O-N 3.1Å; Y128-A132 PolarHBondContact O-N 3.25Å; Y128-F135 AromaticContact CD2-CD2 3.84Å; Y128-F135 HydrophobicContact CD2-CD2 3.84Å; Y128-F135 AromaticContact CD2-CE2 3.71Å; Y128-F135 HydrophobicContact CD2-CE2 3.71Å; Y128-F135 HydrophobicContact CD2-CZ 4.46Å; Y128-F135 AromaticContact CE2-CD2 3.97Å; Y128-F135 HydrophobicContact CE2-CD2 3.97Å; Y128-F135 HydrophobicContact CE2-CE2 4.32Å
129	S	93.5	Very high	94.5	Very high	81 Å²	81	55 Å²	55	57%	0.566	31%	0.307	S	S	*	.	H	α-helix	trans	-65.3	-32.1	-170.6	64.5	0	0	0	0	114	G125 P126	G125-S129 PolarHBondContact O-N 2.98Å; G125-S129 VanDerWaalsContact O-N 3.09Å; P126-S129 WeakPolarHBondContact CA-OG 3.38Å; P126-S129 PolarHBondContact O-N 3.2Å
130	Q	93.6	Very high	94.7	Very high	155 Å²	155	48.6 Å²	48.6	72%	0.724	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-17.9	177.4	-61.8	179.1	12.6	0	0	113.2	P126 Y128	P126-Q130 VanDerWaalsContact O-CB 3.26Å; P126-Q130 WeakPolarHBondContact O-CB 3.3Å; P126-Q130 WeakPolarHBondContact O-CG 3.17Å; P126-Q130 PolarHBondContact O-N 3.2Å; Y128-Q130 VanDerWaalsContact C-N 3.33Å; Y128-Q130 PolarHBondContact O-N 2.85Å
131	N	94.6	Very high	94.9	Very high	28 Å²	28	48.9 Å²	48.9	15%	0.15	28%	0.283	C	S	.	.	S	Bend	trans	-117.8	19	-176.3	-56.1	-71.4	0	0	0	113	L127 Y128 R133 L134 F135 R167	L127-N131 WeakPolarHBondContact O-CB 3.38Å; L127-N131 PolarHBondContact O-ND2 3.41Å; Y128-N131 CarbonylContact O-C 3.55Å; Y128-N131 PolarHBondContact O-N 2.88Å; Y128-N131 VanDerWaalsContact O-N 3.1Å; N131-R133 PolarHBondContact O-N 3.2Å; N131-L134 WeakPolarHBondContact O-CB 3.3Å; N131-L134 PolarHBondContact O-N 3.39Å; N131-F135 HydrophobicContact CB-CE2 4.23Å; N131-F135 VanDerWaalsContact O-CD2 3.26Å; N131-F135 WeakPolarHBondContact O-CD2 3.34Å; N131-F135 WeakPolarHBondContact O-CE2 3.02Å; N131-R167 WeakPolarHBondContact OD1-CD 3.44Å; N131-R167 PolarHBondContact OD1-NE 3.26Å
132	A	94.1	Very high	95	Very high	44 Å²	44	49 Å²	49	36%	0.364	28%	0.283	S	S	.	.	H	α-helix	trans	-50.4	-34.3	-179.9	0	0	0	0	0	113.3	Y128 L134 F135 A136	Y128-A132 PolarHBondContact O-N 3.25Å; A132-L134 PolarHBondContact O-N 2.91Å; A132-F135 PolarHBondContact O-N 3.46Å; A132-A136 PolarHBondContact O-N 3.01Å; A132-A136 VanDerWaalsContact O-N 3.1Å
133	R	95.6	Very high	95.2	Very high	190 Å²	190	49.4 Å²	49.4	72%	0.717	27%	0.274	S	S	*	.	H	α-helix	trans	-62.2	-39.3	178.3	-174.9	175.4	171.1	-174.6	-6.6	113.2	N131 F135 A136 E137	N131-R133 PolarHBondContact O-N 3.2Å; R133-F135 VanDerWaalsContact C-N 3.34Å; R133-F135 PolarHBondContact O-N 2.82Å; R133-A136 PolarHBondContact O-N 3.4Å; R133-E137 HydrophobicContact CG-CG 4.32Å; R133-E137 IonicContact CZ-OE1 3.58Å; R133-E137 VanDerWaalsContact CZ-OE1 3.26Å; R133-E137 IonicContact NE-OE1 3.29Å; R133-E137 PolarHBondContact NE-OE1 3.41Å; R133-E137 IonicContact NH2-OE1 3.42Å; R133-E137 PolarHBondContact NH2-OE1 3.1Å; R133-E137 WeakPolarHBondContact O-CB 3.28Å; R133-E137 WeakPolarHBondContact O-CG 3.44Å; R133-E137 PolarHBondContact O-N 2.89Å
134	L	96.6	Very high	95.3	Very high	7 Å²	7	49.6 Å²	49.6	4%	0.037	27%	0.268	C	S	.	.	H	α-helix	trans	-60.3	-45.4	178.3	175.1	59.1	0	0	0	111.3	N131 A132 E137 L138 F160 Q163 L164 R167	N131-L134 WeakPolarHBondContact O-CB 3.3Å; N131-L134 PolarHBondContact O-N 3.39Å; A132-L134 PolarHBondContact O-N 2.91Å; L134-E137 PolarHBondContact O-N 3.2Å; L134-L138 PolarHBondContact O-N 3.32Å; L134-L138 VanDerWaalsContact O-N 3.12Å; L134-F160 HydrophobicContact CD1-CD2 3.81Å; L134-F160 HydrophobicContact CD1-CE2 4.4Å; L134-F160 HydrophobicContact CD2-CD2 4.23Å; L134-F160 HydrophobicContact CD2-CE2 4.12Å; L134-F160 HydrophobicContact CG-CD2 3.82Å; L134-F160 HydrophobicContact CG-CE2 3.89Å; L134-Q163 HydrophobicContact CD1-CB 4.21Å; L134-Q163 HydrophobicContact CD2-CB 4.44Å; L134-L164 HydrophobicContact CD2-CB 3.98Å; L134-L164 HydrophobicContact CD2-CD1 4.16Å; L134-R167 VanDerWaalsContact CG-NH1 3.3Å
135	F	96.4	Very high	95.4	Very high	2 Å²	2	49 Å²	49	1%	0.009	27%	0.265	C	S	.	.	H	α-helix	trans	-67.8	-38.3	179.3	-53	-72.6	0	0	0	111.4	L117 L121 Y128 N131 A132 R133 L138 Y139 F160 L164 I316	L117-F135 HydrophobicContact CD1-CB 4.09Å; L117-F135 HydrophobicContact CD2-CB 4.46Å; L121-F135 HydrophobicContact CD1-CD1 3.9Å; L121-F135 HydrophobicContact CD1-CD2 4.45Å; L121-F135 HydrophobicContact CD1-CE1 3.96Å; L121-F135 HydrophobicContact CD1-CE2 4.49Å; L121-F135 HydrophobicContact CD1-CG 4.17Å; L121-F135 HydrophobicContact CD1-CZ 4.25Å; Y128-F135 AromaticContact CD2-CD2 3.84Å; Y128-F135 HydrophobicContact CD2-CD2 3.84Å; Y128-F135 AromaticContact CD2-CE2 3.71Å; Y128-F135 HydrophobicContact CD2-CE2 3.71Å; Y128-F135 HydrophobicContact CD2-CZ 4.46Å; Y128-F135 AromaticContact CE2-CD2 3.97Å; Y128-F135 HydrophobicContact CE2-CD2 3.97Å; Y128-F135 HydrophobicContact CE2-CE2 4.32Å; N131-F135 HydrophobicContact CB-CE2 4.23Å; N131-F135 VanDerWaalsContact O-CD2 3.26Å; N131-F135 WeakPolarHBondContact O-CD2 3.34Å; N131-F135 WeakPolarHBondContact O-CE2 3.02Å; A132-F135 PolarHBondContact O-N 3.46Å; R133-F135 VanDerWaalsContact C-N 3.34Å; R133-F135 PolarHBondContact O-N 2.82Å; F135-L138 PolarHBondContact O-N 3.42Å; F135-Y139 WeakPolarHBondContact O-CD2 3.29Å; F135-Y139 PolarHBondContact O-N 3.15Å; F135-F160 AromaticContact CD1-CE2 3.88Å; F135-F160 HydrophobicContact CD1-CE2 3.88Å; F135-F160 HydrophobicContact CD1-CZ 4.07Å; F135-F160 HydrophobicContact CE1-CE2 4.18Å; F135-F160 HydrophobicContact CE1-CZ 4.15Å; F135-L164 HydrophobicContact CE1-CD1 4.15Å; F135-L164 HydrophobicContact CZ-CD1 3.96Å; F135-I316 HydrophobicContact CD1-CD1 4.37Å; F135-I316 HydrophobicContact CD1-CG2 4.22Å; F135-I316 HydrophobicContact CE1-CG2 3.64Å
136	A	96.5	Very high	95.6	Very high	51 Å²	51	48.5 Å²	48.5	42%	0.421	25%	0.254	S	S	.	.	H	α-helix	trans	-65.9	-38.5	175.3	0	0	0	0	0	112.6	A132 R133 Y139 G140	A132-A136 PolarHBondContact O-N 3.01Å; A132-A136 VanDerWaalsContact O-N 3.1Å; R133-A136 PolarHBondContact O-N 3.4Å; A136-Y139 PolarHBondContact O-N 3.45Å; A136-G140 PolarHBondContact O-N 3.06Å
137	E	97.1	Very high	95.7	Very high	70 Å²	70	53.2 Å²	53.2	33%	0.327	26%	0.261	S	S	.	.	H	α-helix	trans	-63.5	-43.9	175.9	-76.8	172.3	173	0	0	111.2	R133 L134 Y139 G140 D141	R133-E137 HydrophobicContact CG-CG 4.32Å; R133-E137 IonicContact CZ-OE1 3.58Å; R133-E137 VanDerWaalsContact CZ-OE1 3.26Å; R133-E137 IonicContact NE-OE1 3.29Å; R133-E137 PolarHBondContact NE-OE1 3.41Å; R133-E137 IonicContact NH2-OE1 3.42Å; R133-E137 PolarHBondContact NH2-OE1 3.1Å; R133-E137 WeakPolarHBondContact O-CB 3.28Å; R133-E137 WeakPolarHBondContact O-CG 3.44Å; R133-E137 PolarHBondContact O-N 2.89Å; L134-E137 PolarHBondContact O-N 3.2Å; E137-Y139 PolarHBondContact O-N 2.97Å; E137-G140 CarbonylContact O-C 3.41Å; E137-G140 WeakPolarHBondContact O-CA 3.33Å; E137-G140 PolarHBondContact O-N 2.85Å; E137-D141 PolarHBondContact O-N 2.84Å
138	L	97.4	Very high	95.6	Very high	7 Å²	7	54.5 Å²	54.5	4%	0.037	28%	0.277	C	S	.	.	H	α-helix	trans	-53.2	-50.3	173.3	171.3	64.6	0	0	0	112.3	L134 F135 G140 D141 L142 L157 F160 M204 I316	L134-L138 PolarHBondContact O-N 3.32Å; L134-L138 VanDerWaalsContact O-N 3.12Å; F135-L138 PolarHBondContact O-N 3.42Å; L138-G140 VanDerWaalsContact C-N 3.29Å; L138-G140 PolarHBondContact O-N 3.15Å; L138-D141 PolarHBondContact O-N 3.07Å; L138-L142 HydrophobicContact CD1-CD1 4.3Å; L138-L142 HydrophobicContact CD1-CG 4.38Å; L138-L142 HydrophobicContact CG-CD1 4.35Å; L138-L142 WeakPolarHBondContact O-CG 3.26Å; L138-L142 PolarHBondContact O-N 3.34Å; L138-L142 VanDerWaalsContact O-N 3.07Å; L138-L157 HydrophobicContact CD1-CD2 3.64Å; L138-F160 HydrophobicContact CB-CD2 3.9Å; L138-F160 HydrophobicContact CB-CE2 4.26Å; L138-F160 HydrophobicContact CB-CG 4.45Å; L138-F160 HydrophobicContact CD1-CB 4.39Å; L138-F160 HydrophobicContact CD1-CG 4.27Å; L138-F160 HydrophobicContact CD2-CD1 4.09Å; L138-F160 HydrophobicContact CD2-CD2 3.89Å; L138-F160 HydrophobicContact CD2-CE1 3.97Å; L138-F160 HydrophobicContact CD2-CE2 3.76Å; L138-F160 HydrophobicContact CD2-CG 4.05Å; L138-F160 HydrophobicContact CD2-CZ 3.81Å; L138-F160 HydrophobicContact CG-CD2 4.32Å; L138-F160 HydrophobicContact CG-CG 4.48Å; L138-M204 HydrophobicContact CD2-CE 4.46Å; L138-I316 HydrophobicContact CD2-CD1 4.06Å
139	Y	97.8	Very high	95.4	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-69.7	-27.8	178	-83.7	-100.6	0	0	0	112.7	H110 S113 E114 L117 F135 A136 E137 R143 I312 P313	H110-Y139 AromaticContact CD2-CD1 3.97Å; H110-Y139 AromaticContact CE1-CD1 3.6Å; H110-Y139 PolarHBondContact CE1-O 2.94Å; H110-Y139 AromaticContact NE2-CD1 3.33Å; H110-Y139 VanDerWaalsContact NE2-CD1 3.33Å; H110-Y139 WeakPolarHBondContact NE2-CD1 3.47Å; H110-Y139 AromaticContact NE2-CE1 3.9Å; S113-Y139 PolarHBondContact O-OH 3.28Å; S113-Y139 PolarHBondContact OG-OH 3.31Å; E114-Y139 VanDerWaalsContact CA-CE1 3.44Å; E114-Y139 HydrophobicContact CB-CD1 3.45Å; E114-Y139 VanDerWaalsContact CB-CD1 3.45Å; E114-Y139 HydrophobicContact CB-CE1 3.69Å; E114-Y139 HydrophobicContact CB-CG 4.01Å; E114-Y139 HydrophobicContact CG-CD1 3.85Å; E114-Y139 HydrophobicContact CG-CE1 4.43Å; E114-Y139 HydrophobicContact CG-CG 3.88Å; E114-Y139 VanDerWaalsContact N-CE1 3.26Å; E114-Y139 WeakPolarHBondContact OE1-CB 3.4Å; L117-Y139 HydrophobicContact CD1-CD2 3.8Å; L117-Y139 HydrophobicContact CD1-CE2 3.62Å; L117-Y139 HydrophobicContact CD2-CE2 3.9Å; L117-Y139 HydrophobicContact CG-CE2 3.96Å; F135-Y139 WeakPolarHBondContact O-CD2 3.29Å; F135-Y139 PolarHBondContact O-N 3.15Å; A136-Y139 PolarHBondContact O-N 3.45Å; E137-Y139 PolarHBondContact O-N 2.97Å; Y139-R143 VanDerWaalsContact O-CB 3.32Å; Y139-R143 WeakPolarHBondContact O-CB 3.47Å; Y139-R143 PolarHBondContact O-N 3.37Å; Y139-R143 VanDerWaalsContact O-N 3.15Å; Y139-I312 HydrophobicContact CE2-CG2 3.91Å; Y139-I312 WeakPolarHBondContact OH-CB 3.19Å; Y139-I312 VanDerWaalsContact OH-CG2 3.28Å; Y139-I312 WeakPolarHBondContact OH-CG2 3.27Å; Y139-P313 WeakPolarHBondContact OH-CD 3.4Å; Y139-P313 WeakPolarHBondContact OH-CG 3.44Å
140	G	97.6	Very high	95	Very high	20 Å²	20	54.1 Å²	54.1	21%	0.206	28%	0.284	C	S	.	.	H	α-helix	trans	-61.7	-48.9	170.6	0	0	0	0	0	111.8	A136 E137 L138 R143 Q144	A136-G140 PolarHBondContact O-N 3.06Å; E137-G140 CarbonylContact O-C 3.41Å; E137-G140 WeakPolarHBondContact O-CA 3.33Å; E137-G140 PolarHBondContact O-N 2.85Å; L138-G140 VanDerWaalsContact C-N 3.29Å; L138-G140 PolarHBondContact O-N 3.15Å; G140-R143 PolarHBondContact O-N 3.45Å; G140-Q144 WeakPolarHBondContact O-CG 3.27Å; G140-Q144 PolarHBondContact O-N 2.99Å
141	D	97	Very high	94.7	Very high	44 Å²	44	48.6 Å²	48.6	24%	0.235	26%	0.259	C	S	.	.	H	α-helix	trans	-64.8	-46.9	-179.7	-69.8	-10.5	0	0	0	111.6	E137 L138 R143 Q144 Y145 L151 N156	E137-D141 PolarHBondContact O-N 2.84Å; L138-D141 PolarHBondContact O-N 3.07Å; D141-R143 VanDerWaalsContact C-N 3.26Å; D141-R143 PolarHBondContact O-N 3.3Å; D141-Q144 PolarHBondContact O-N 3.16Å; D141-Q144 VanDerWaalsContact O-N 3.15Å; D141-Y145 WeakPolarHBondContact O-CB 3.33Å; D141-Y145 PolarHBondContact O-N 2.76Å; D141-L151 HydrophobicContact CB-CD1 4.39Å; D141-N156 VanDerWaalsContact CG-ND2 3.31Å; D141-N156 PolarHBondContact OD2-ND2 3.44Å
142	L	97.5	Very high	94.5	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-56.3	-40.8	175.4	-71.4	177.6	0	0	0	112.1	L138 Y146 L153 V208 F212 I312	L138-L142 HydrophobicContact CD1-CD1 4.3Å; L138-L142 HydrophobicContact CD1-CG 4.38Å; L138-L142 HydrophobicContact CG-CD1 4.35Å; L138-L142 WeakPolarHBondContact O-CG 3.26Å; L138-L142 PolarHBondContact O-N 3.34Å; L138-L142 VanDerWaalsContact O-N 3.07Å; L142-Y146 PolarHBondContact O-N 3.49Å; L142-L153 HydrophobicContact CD2-CD2 3.89Å; L142-V208 HydrophobicContact CD1-CG1 4.43Å; L142-V208 HydrophobicContact CD2-CG1 3.73Å; L142-F212 HydrophobicContact CB-CE1 3.77Å; L142-F212 HydrophobicContact CB-CE2 4.36Å; L142-F212 HydrophobicContact CB-CZ 3.64Å; L142-F212 HydrophobicContact CD1-CE2 4.17Å; L142-F212 HydrophobicContact CD1-CZ 4.07Å; L142-F212 HydrophobicContact CD2-CD2 4.14Å; L142-F212 HydrophobicContact CD2-CE1 4.37Å; L142-F212 HydrophobicContact CD2-CE2 3.89Å; L142-F212 HydrophobicContact CD2-CG 4.46Å; L142-F212 HydrophobicContact CD2-CZ 4.02Å; L142-F212 HydrophobicContact CG-CE2 4.37Å; L142-F212 HydrophobicContact CG-CZ 4.12Å; L142-F212 VanDerWaalsContact O-CE1 3.27Å; L142-F212 WeakPolarHBondContact O-CE1 3.33Å; L142-I312 HydrophobicContact CD1-CD1 4.21Å
143	R	97.4	Very high	94.4	Very high	77 Å²	77	46.7 Å²	46.7	29%	0.291	24%	0.243	S	C	.	.	H	α-helix	trans	-70.4	-40.2	177.5	-169.5	-175.6	-43.3	-157.1	-0	112.6	E114 Y139 G140 D141 R147	E114-R143 IonicContact OE1-NH2 3.25Å; E114-R143 PolarHBondContact OE1-NH2 3.35Å; E114-R143 IonicContact OE2-CZ 3.89Å; E114-R143 IonicContact OE2-NH2 2.87Å; E114-R143 PolarHBondContact OE2-NH2 3.15Å; Y139-R143 VanDerWaalsContact O-CB 3.32Å; Y139-R143 WeakPolarHBondContact O-CB 3.47Å; Y139-R143 PolarHBondContact O-N 3.37Å; Y139-R143 VanDerWaalsContact O-N 3.15Å; G140-R143 PolarHBondContact O-N 3.45Å; D141-R143 VanDerWaalsContact C-N 3.26Å; D141-R143 PolarHBondContact O-N 3.3Å; R143-R147 WeakPolarHBondContact O-CG 3.19Å; R143-R147 PolarHBondContact O-N 3.27Å
144	Q	95.6	Very high	94.3	Very high	92 Å²	92	41.3 Å²	41.3	43%	0.43	23%	0.228	S	C	.	.	H	α-helix	trans	-65.3	-42	176.8	-76.4	178	53.9	0	0	111.2	G140 D141 R147 G148 S149 L151	G140-Q144 WeakPolarHBondContact O-CG 3.27Å; G140-Q144 PolarHBondContact O-N 2.99Å; D141-Q144 PolarHBondContact O-N 3.16Å; D141-Q144 VanDerWaalsContact O-N 3.15Å; Q144-R147 PolarHBondContact O-N 3.45Å; Q144-G148 PolarHBondContact O-N 2.77Å; Q144-S149 WeakPolarHBondContact O-CB 3.16Å; Q144-S149 PolarHBondContact O-N 2.96Å; Q144-S149 PolarHBondContact O-OG 2.87Å; Q144-L151 HydrophobicContact CB-CD1 3.72Å
145	Y	95.4	Very high	94.1	Very high	1 Å²	1	46.6 Å²	46.6	0%	0.004	25%	0.253	C	S	.	.	H	α-helix	trans	-58.7	-51.9	174.4	176.2	-90.5	0	0	0	111.4	D141 R147 G148 L151 L153 F212 V213 R216 D475	D141-Y145 WeakPolarHBondContact O-CB 3.33Å; D141-Y145 PolarHBondContact O-N 2.76Å; Y145-R147 PolarHBondContact O-N 2.97Å; Y145-G148 PolarHBondContact O-N 3.4Å; Y145-L151 HydrophobicContact CD2-CB 4.32Å; Y145-L151 WeakPolarHBondContact CD2-O 3.47Å; Y145-L153 HydrophobicContact CD1-CD1 3.48Å; Y145-L153 VanDerWaalsContact CD1-CD1 3.48Å; Y145-L153 HydrophobicContact CD1-CD2 4.25Å; Y145-L153 HydrophobicContact CD1-CG 3.96Å; Y145-L153 HydrophobicContact CD2-CD1 3.98Å; Y145-L153 HydrophobicContact CD2-CD2 3.96Å; Y145-L153 HydrophobicContact CD2-CG 3.55Å; Y145-L153 HydrophobicContact CE1-CD1 3.55Å; Y145-L153 HydrophobicContact CE1-CG 4.24Å; Y145-L153 HydrophobicContact CE2-CD1 4.03Å; Y145-L153 HydrophobicContact CE2-CG 3.84Å; Y145-L153 HydrophobicContact CG-CD1 3.7Å; Y145-L153 HydrophobicContact CG-CD2 3.68Å; Y145-L153 HydrophobicContact CG-CG 3.6Å; Y145-F212 HydrophobicContact CD1-CB 3.97Å; Y145-F212 HydrophobicContact CD1-CD1 4.23Å; Y145-F212 HydrophobicContact CE1-CB 3.88Å; Y145-V213 WeakPolarHBondContact OH-CG2 3.4Å; Y145-R216 PolarHBondContact O-NH1 3.37Å; Y145-D475 WeakPolarHBondContact CE2-OD2 3.47Å; Y145-D475 VanDerWaalsContact CZ-OD2 3.24Å; Y145-D475 PolarHBondContact OH-OD1 2.94Å; Y145-D475 PolarHBondContact OH-OD2 3.43Å
146	Y	96.1	Very high	94	Very high	17 Å²	17	47.8 Å²	47.8	7%	0.067	26%	0.259	C	S	.	.	H	α-helix	trans	-57.4	-36.3	179.4	178.4	-107.7	0	0	0	112.7	D103 F106 T107 L142 G148 A215 R216 V219	D103-Y146 WeakPolarHBondContact OD1-CE1 3.31Å; D103-Y146 PolarHBondContact OD1-OH 3.48Å; F106-Y146 HydrophobicContact CD1-CD1 4.01Å; F106-Y146 AromaticContact CD1-CD2 3.75Å; F106-Y146 HydrophobicContact CD1-CD2 3.75Å; F106-Y146 AromaticContact CD1-CE1 3.75Å; F106-Y146 HydrophobicContact CD1-CE1 3.75Å; F106-Y146 AromaticContact CD1-CE2 3.48Å; F106-Y146 HydrophobicContact CD1-CE2 3.48Å; F106-Y146 VanDerWaalsContact CD1-CE2 3.48Å; F106-Y146 AromaticContact CD1-CG 3.99Å; F106-Y146 HydrophobicContact CD1-CG 3.99Å; F106-Y146 AromaticContact CD1-CZ 3.45Å; F106-Y146 VanDerWaalsContact CD1-CZ 3.45Å; F106-Y146 HydrophobicContact CD2-CE2 4.4Å; F106-Y146 HydrophobicContact CE1-CD1 4.1Å; F106-Y146 AromaticContact CE1-CD2 3.4Å; F106-Y146 HydrophobicContact CE1-CD2 3.4Å; F106-Y146 HydrophobicContact CE1-CE1 4.27Å; F106-Y146 AromaticContact CE1-CE2 3.61Å; F106-Y146 HydrophobicContact CE1-CE2 3.61Å; F106-Y146 AromaticContact CE1-CG 3.65Å; F106-Y146 HydrophobicContact CE1-CG 3.65Å; F106-Y146 HydrophobicContact CE2-CE2 4.49Å; F106-Y146 AromaticContact CG-CE2 3.92Å; F106-Y146 HydrophobicContact CG-CE2 3.92Å; F106-Y146 AromaticContact CG-CZ 3.89Å; F106-Y146 AromaticContact CZ-CD2 3.92Å; F106-Y146 HydrophobicContact CZ-CD2 3.92Å; F106-Y146 HydrophobicContact CZ-CE2 4.13Å; T107-Y146 HydrophobicContact CG2-CD1 4.24Å; T107-Y146 HydrophobicContact CG2-CE1 3.78Å; L142-Y146 PolarHBondContact O-N 3.49Å; Y146-G148 PolarHBondContact O-N 2.94Å; Y146-A215 HydrophobicContact CD2-CB 4.42Å; Y146-A215 HydrophobicContact CE2-CB 3.95Å; Y146-R216 HydrophobicContact CD2-CB 4.39Å; Y146-V219 HydrophobicContact CE2-CG2 4.43Å; Y146-V219 WeakPolarHBondContact OH-CG2 3.17Å
147	R	93.9	Very high	94	Very high	181 Å²	181	45.5 Å²	45.5	68%	0.683	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-4.4	177.7	-73.5	175.4	177	163	-2.4	114.8	R143 Q144 Y145	R143-R147 WeakPolarHBondContact O-CG 3.19Å; R143-R147 PolarHBondContact O-N 3.27Å; Q144-R147 PolarHBondContact O-N 3.45Å; Y145-R147 PolarHBondContact O-N 2.97Å
148	G	89.9	Confident	93.9	Very high	37 Å²	37	43.7 Å²	43.7	38%	0.381	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	108.2	9.2	177	0	0	0	0	0	115.4	Q144 Y145 Y146 R216	Q144-G148 PolarHBondContact O-N 2.77Å; Y145-G148 PolarHBondContact O-N 3.4Å; Y146-G148 PolarHBondContact O-N 2.94Å; G148-R216 PolarHBondContact O-NH2 2.81Å
149	S	88.8	Confident	93.8	Very high	42 Å²	42	48.7 Å²	48.7	29%	0.294	26%	0.258	S	S	.	.			trans	-67.4	143.2	175.3	-51.1	0	0	0	0	110.4	Q144 L151 R216	Q144-S149 WeakPolarHBondContact O-CB 3.16Å; Q144-S149 PolarHBondContact O-N 2.96Å; Q144-S149 PolarHBondContact O-OG 2.87Å; S149-L151 PolarHBondContact O-N 3.46Å; S149-R216 PolarHBondContact O-NH1 2.95Å
150	A	84.9	Confident	93.8	Very high	69 Å²	69	49 Å²	49	57%	0.57	26%	0.26	S	S	*	.			trans	-80.3	64.3	176.7	0	0	0	0	0	110.7	A481	A150-A481 HydrophobicContact CB-CB 4.24Å
151	L	87.4	Confident	93.7	Very high	39 Å²	39	48.2 Å²	48.2	20%	0.204	25%	0.25	C	S	.	.			trans	-99.2	141.9	176.8	-66.1	174.2	0	0	0	110	D141 Q144 Y145 S149 L153	D141-L151 HydrophobicContact CB-CD1 4.39Å; Q144-L151 HydrophobicContact CB-CD1 3.72Å; Y145-L151 HydrophobicContact CD2-CB 4.32Å; Y145-L151 WeakPolarHBondContact CD2-O 3.47Å; S149-L151 PolarHBondContact O-N 3.46Å; L151-L153 PolarHBondContact O-N 2.99Å
152	N	90.4	Very high	93.7	Very high	29 Å²	29	47.6 Å²	47.6	16%	0.155	25%	0.249	C	C	.	.			trans	-88.7	95.1	171.4	-171.6	-15	0	0	0	109.7	D154 E155 N156 F478	N152-D154 PolarHBondContact O-N 3.38Å; N152-D154 VanDerWaalsContact O-N 3.09Å; N152-D154 WeakPolarHBondContact OD1-CB 3.37Å; N152-D154 PolarHBondContact OD1-N 3.19Å; N152-E155 HydrophobicContact CB-CB 4.1Å; N152-E155 HydrophobicContact CB-CG 4.23Å; N152-E155 WeakPolarHBondContact ND2-CG 3.41Å; N152-E155 PolarHBondContact ND2-OE1 2.99Å; N152-E155 PolarHBondContact O-N 3.22Å; N152-E155 VanDerWaalsContact O-N 3.09Å; N152-N156 PolarHBondContact O-N 3.33Å; N152-N156 PolarHBondContact O-OD1 3.34Å; N152-F478 HydrophobicContact CB-CD2 4.12Å; N152-F478 HydrophobicContact CB-CE1 4.2Å; N152-F478 HydrophobicContact CB-CE2 3.65Å; N152-F478 HydrophobicContact CB-CZ 3.69Å
153	L	92.7	Very high	93.6	Very high	4 Å²	4	49.7 Å²	49.7	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-56.5	-29	179.4	-71.7	-174.1	0	0	0	113.3	L142 Y145 L151 L157 I209 F212	L142-L153 HydrophobicContact CD2-CD2 3.89Å; Y145-L153 HydrophobicContact CD1-CD1 3.48Å; Y145-L153 VanDerWaalsContact CD1-CD1 3.48Å; Y145-L153 HydrophobicContact CD1-CD2 4.25Å; Y145-L153 HydrophobicContact CD1-CG 3.96Å; Y145-L153 HydrophobicContact CD2-CD1 3.98Å; Y145-L153 HydrophobicContact CD2-CD2 3.96Å; Y145-L153 HydrophobicContact CD2-CG 3.55Å; Y145-L153 HydrophobicContact CE1-CD1 3.55Å; Y145-L153 HydrophobicContact CE1-CG 4.24Å; Y145-L153 HydrophobicContact CE2-CD1 4.03Å; Y145-L153 HydrophobicContact CE2-CG 3.84Å; Y145-L153 HydrophobicContact CG-CD1 3.7Å; Y145-L153 HydrophobicContact CG-CD2 3.68Å; Y145-L153 HydrophobicContact CG-CG 3.6Å; L151-L153 PolarHBondContact O-N 2.99Å; L153-L157 VanDerWaalsContact O-CB 3.26Å; L153-L157 WeakPolarHBondContact O-CB 3.36Å; L153-L157 WeakPolarHBondContact O-CD1 3.22Å; L153-L157 VanDerWaalsContact O-CG 3.23Å; L153-L157 WeakPolarHBondContact O-CG 3.35Å; L153-L157 PolarHBondContact O-N 3.47Å; L153-I209 HydrophobicContact CB-CD1 4.47Å; L153-I209 HydrophobicContact CB-CG1 3.87Å; L153-F212 HydrophobicContact CD1-CB 3.79Å; L153-F212 HydrophobicContact CD1-CG 4.41Å
154	D	92.7	Very high	93.6	Very high	77 Å²	77	46 Å²	46	41%	0.412	25%	0.245	S	C	.	.	H	α-helix	trans	-62.3	-49	177.5	-168.9	-79.3	0	0	0	111.1	N152 S158 K205 I209	N152-D154 PolarHBondContact O-N 3.38Å; N152-D154 VanDerWaalsContact O-N 3.09Å; N152-D154 WeakPolarHBondContact OD1-CB 3.37Å; N152-D154 PolarHBondContact OD1-N 3.19Å; D154-S158 WeakPolarHBondContact O-CB 3.46Å; D154-S158 PolarHBondContact O-N 3.36Å; D154-S158 VanDerWaalsContact O-N 3.09Å; D154-S158 PolarHBondContact O-OG 3.31Å; D154-S158 VanDerWaalsContact O-OG 3.09Å; D154-K205 WeakPolarHBondContact O-CE 3.43Å; D154-K205 PolarHBondContact O-NZ 3.39Å; D154-K205 WeakPolarHBondContact OD1-CE 3.42Å; D154-K205 IonicContact OD1-NZ 2.7Å; D154-K205 PolarHBondContact OD1-NZ 2.85Å; D154-K205 WeakPolarHBondContact OD2-CE 3.49Å; D154-K205 IonicContact OD2-NZ 2.98Å; D154-K205 PolarHBondContact OD2-NZ 2.95Å; D154-I209 HydrophobicContact CB-CD1 4.13Å
155	E	93	Very high	93.6	Very high	117 Å²	117	41.6 Å²	41.6	55%	0.547	23%	0.225	S	C	.	.	H	α-helix	trans	-69.3	-48.1	178.5	-71.9	169.5	-164.1	0	0	111.7	N152 L157 S158 E159	N152-E155 HydrophobicContact CB-CB 4.1Å; N152-E155 HydrophobicContact CB-CG 4.23Å; N152-E155 WeakPolarHBondContact ND2-CG 3.41Å; N152-E155 PolarHBondContact ND2-OE1 2.99Å; N152-E155 PolarHBondContact O-N 3.22Å; N152-E155 VanDerWaalsContact O-N 3.09Å; E155-L157 VanDerWaalsContact C-N 3.3Å; E155-L157 PolarHBondContact O-N 2.9Å; E155-S158 WeakPolarHBondContact O-CB 3.33Å; E155-S158 PolarHBondContact O-N 2.93Å; E155-S158 VanDerWaalsContact O-N 3.12Å; E155-E159 WeakPolarHBondContact O-CB 3.34Å; E155-E159 PolarHBondContact O-N 3.22Å
156	N	94.5	Very high	93.6	Very high	28 Å²	28	44.2 Å²	44.2	15%	0.15	24%	0.237	C	C	.	.	H	α-helix	trans	-57.9	-42.2	179.4	-72.9	65	0	0	0	112	D141 N152 F160	D141-N156 VanDerWaalsContact CG-ND2 3.31Å; D141-N156 PolarHBondContact OD2-ND2 3.44Å; N152-N156 PolarHBondContact O-N 3.33Å; N152-N156 PolarHBondContact O-OD1 3.34Å; N156-F160 WeakPolarHBondContact O-CB 3.49Å; N156-F160 PolarHBondContact O-N 3.14Å
157	L	95.8	Very high	93.5	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-69.1	-41.2	176.8	-72.9	165.4	0	0	0	111.5	L138 L153 E155 E159 F160 W161 K205 V208 I209	L138-L157 HydrophobicContact CD1-CD2 3.64Å; L153-L157 VanDerWaalsContact O-CB 3.26Å; L153-L157 WeakPolarHBondContact O-CB 3.36Å; L153-L157 WeakPolarHBondContact O-CD1 3.22Å; L153-L157 VanDerWaalsContact O-CG 3.23Å; L153-L157 WeakPolarHBondContact O-CG 3.35Å; L153-L157 PolarHBondContact O-N 3.47Å; E155-L157 VanDerWaalsContact C-N 3.3Å; E155-L157 PolarHBondContact O-N 2.9Å; L157-E159 VanDerWaalsContact C-N 3.34Å; L157-F160 PolarHBondContact O-N 3.48Å; L157-W161 PolarHBondContact O-N 2.96Å; L157-K205 HydrophobicContact CB-CD 4.39Å; L157-K205 HydrophobicContact CB-CG 4.15Å; L157-K205 HydrophobicContact CD1-CB 4.38Å; L157-K205 HydrophobicContact CD1-CG 4Å; L157-V208 HydrophobicContact CD1-CB 4.43Å; L157-V208 HydrophobicContact CD1-CG1 4.21Å; L157-I209 HydrophobicContact CD1-CD1 4.18Å; L157-I209 HydrophobicContact CD1-CG1 3.76Å
158	S	95.3	Very high	93.5	Very high	32 Å²	32	38.4 Å²	38.4	22%	0.224	22%	0.215	C	C	.	.	H	α-helix	trans	-59.1	-45.6	174.2	-72.8	0	0	0	0	111.8	D154 E155 W161 S162 K205	D154-S158 WeakPolarHBondContact O-CB 3.46Å; D154-S158 PolarHBondContact O-N 3.36Å; D154-S158 VanDerWaalsContact O-N 3.09Å; D154-S158 PolarHBondContact O-OG 3.31Å; D154-S158 VanDerWaalsContact O-OG 3.09Å; E155-S158 WeakPolarHBondContact O-CB 3.33Å; E155-S158 PolarHBondContact O-N 2.93Å; E155-S158 VanDerWaalsContact O-N 3.12Å; S158-W161 PolarHBondContact O-N 3.12Å; S158-S162 PolarHBondContact O-N 2.94Å; S158-S162 PolarHBondContact O-OG 2.81Å; S158-K205 PolarHBondContact OG-NZ 3.35Å
159	E	95.7	Very high	93.6	Very high	112 Å²	112	36.7 Å²	36.7	52%	0.523	20%	0.197	S	C	.	.	H	α-helix	trans	-63.1	-44.5	179	-174.2	178.8	175.3	0	0	111.5	E155 L157 W161 S162 Q163	E155-E159 WeakPolarHBondContact O-CB 3.34Å; E155-E159 PolarHBondContact O-N 3.22Å; L157-E159 VanDerWaalsContact C-N 3.34Å; E159-W161 VanDerWaalsContact C-N 3.31Å; E159-W161 PolarHBondContact O-N 3.24Å; E159-S162 PolarHBondContact O-N 3.31Å; E159-S162 VanDerWaalsContact O-N 3.16Å; E159-Q163 HydrophobicContact CG-CG 4.33Å; E159-Q163 WeakPolarHBondContact O-CG 3.39Å; E159-Q163 PolarHBondContact O-N 3.49Å; E159-Q163 PolarHBondContact OE1-NE2 2.81Å
160	F	97.4	Very high	93.8	Very high	8 Å²	8	40.9 Å²	40.9	4%	0.035	21%	0.21	C	C	.	.	H	α-helix	trans	-52.9	-48.5	174.2	163.8	-98	0	0	0	111.9	L134 F135 L138 N156 L157 L164 I316	L134-F160 HydrophobicContact CD1-CD2 3.81Å; L134-F160 HydrophobicContact CD1-CE2 4.4Å; L134-F160 HydrophobicContact CD2-CD2 4.23Å; L134-F160 HydrophobicContact CD2-CE2 4.12Å; L134-F160 HydrophobicContact CG-CD2 3.82Å; L134-F160 HydrophobicContact CG-CE2 3.89Å; F135-F160 AromaticContact CD1-CE2 3.88Å; F135-F160 HydrophobicContact CD1-CE2 3.88Å; F135-F160 HydrophobicContact CD1-CZ 4.07Å; F135-F160 HydrophobicContact CE1-CE2 4.18Å; F135-F160 HydrophobicContact CE1-CZ 4.15Å; L138-F160 HydrophobicContact CB-CD2 3.9Å; L138-F160 HydrophobicContact CB-CE2 4.26Å; L138-F160 HydrophobicContact CB-CG 4.45Å; L138-F160 HydrophobicContact CD1-CB 4.39Å; L138-F160 HydrophobicContact CD1-CG 4.27Å; L138-F160 HydrophobicContact CD2-CD1 4.09Å; L138-F160 HydrophobicContact CD2-CD2 3.89Å; L138-F160 HydrophobicContact CD2-CE1 3.97Å; L138-F160 HydrophobicContact CD2-CE2 3.76Å; L138-F160 HydrophobicContact CD2-CG 4.05Å; L138-F160 HydrophobicContact CD2-CZ 3.81Å; L138-F160 HydrophobicContact CG-CD2 4.32Å; L138-F160 HydrophobicContact CG-CG 4.48Å; N156-F160 WeakPolarHBondContact O-CB 3.49Å; N156-F160 PolarHBondContact O-N 3.14Å; L157-F160 PolarHBondContact O-N 3.48Å; F160-L164 HydrophobicContact CE1-CD2 4.22Å; F160-L164 HydrophobicContact CZ-CD2 3.98Å; F160-L164 VanDerWaalsContact O-CB 3.32Å; F160-L164 WeakPolarHBondContact O-CB 3.47Å; F160-L164 PolarHBondContact O-N 3.01Å; F160-I316 HydrophobicContact CE1-CD1 4.26Å; F160-I316 HydrophobicContact CE1-CG1 4.13Å; F160-I316 HydrophobicContact CZ-CD1 3.76Å; F160-I316 HydrophobicContact CZ-CG1 3.96Å; F160-I316 HydrophobicContact CZ-CG2 4.34Å
161	W	97.1	Very high	94	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.008	21%	0.21	C	C	.	.	H	α-helix	trans	-66	-38.5	179.4	-70.2	118	0	0	0	112.5	L157 S158 E159 L164 L165 Q191 F197 P201 M204 I316 A319	L157-W161 PolarHBondContact O-N 2.96Å; S158-W161 PolarHBondContact O-N 3.12Å; E159-W161 VanDerWaalsContact C-N 3.31Å; E159-W161 PolarHBondContact O-N 3.24Å; W161-L164 HydrophobicContact CE3-CD2 3.97Å; W161-L164 HydrophobicContact CZ3-CD2 3.89Å; W161-L164 PolarHBondContact O-N 2.86Å; W161-L165 WeakPolarHBondContact O-CB 3.46Å; W161-L165 PolarHBondContact O-N 3.43Å; W161-Q191 VanDerWaalsContact C-OE1 3.25Å; W161-F197 AromaticContact CE3-CD2 3.98Å; W161-F197 HydrophobicContact CE3-CD2 3.98Å; W161-F197 HydrophobicContact CE3-CE2 4.08Å; W161-P201 HydrophobicContact CD2-CB 3.74Å; W161-P201 HydrophobicContact CD2-CG 3.86Å; W161-P201 HydrophobicContact CE3-CB 4.4Å; W161-P201 HydrophobicContact CE3-CG 4.01Å; W161-P201 HydrophobicContact CG-CB 3.8Å; W161-P201 HydrophobicContact CG-CG 4.25Å; W161-P201 HydrophobicContact CZ2-CB 4.25Å; W161-P201 HydrophobicContact CZ2-CG 4.4Å; W161-P201 HydrophobicContact CZ3-CG 4.35Å; W161-M204 HydrophobicContact CH2-SD 4.21Å; W161-M204 HydrophobicContact CZ2-CB 4.38Å; W161-M204 HydrophobicContact CZ2-CE 4.27Å; W161-M204 HydrophobicContact CZ2-CG 4.47Å; W161-M204 HydrophobicContact CZ2-SD 3.62Å; W161-I316 HydrophobicContact CH2-CG1 4.15Å; W161-A319 HydrophobicContact CH2-CB 3.82Å; W161-A319 HydrophobicContact CZ3-CB 3.59Å
162	S	96.1	Very high	94.1	Very high	31 Å²	31	41.6 Å²	41.6	22%	0.217	22%	0.218	C	C	.	.	H	α-helix	trans	-64.4	-48.3	177.9	-70.3	0	0	0	0	111.4	S158 E159 L164 L165 E166 Q191	S158-S162 PolarHBondContact O-N 2.94Å; S158-S162 PolarHBondContact O-OG 2.81Å; E159-S162 PolarHBondContact O-N 3.31Å; E159-S162 VanDerWaalsContact O-N 3.16Å; S162-L164 VanDerWaalsContact C-N 3.3Å; S162-L164 PolarHBondContact O-N 3.36Å; S162-L165 WeakPolarHBondContact O-CB 3.26Å; S162-L165 PolarHBondContact O-N 3.09Å; S162-E166 PolarHBondContact O-N 3.12Å; S162-E166 VanDerWaalsContact O-N 3.11Å; S162-Q191 PolarHBondContact OG-OE1 3.38Å
163	Q	96.2	Very high	93.9	Very high	46 Å²	46	41 Å²	41	22%	0.215	22%	0.216	C	C	.	.	H	α-helix	trans	-65.5	-34.2	176.9	-62.5	-173.4	23.6	0	0	112.4	L134 E159 L165 R167	L134-Q163 HydrophobicContact CD1-CB 4.21Å; L134-Q163 HydrophobicContact CD2-CB 4.44Å; E159-Q163 HydrophobicContact CG-CG 4.33Å; E159-Q163 WeakPolarHBondContact O-CG 3.39Å; E159-Q163 PolarHBondContact O-N 3.49Å; E159-Q163 PolarHBondContact OE1-NE2 2.81Å; Q163-L165 VanDerWaalsContact C-N 3.34Å; Q163-R167 VanDerWaalsContact CB-NH1 3.34Å; Q163-R167 WeakPolarHBondContact O-CD 3.5Å; Q163-R167 VanDerWaalsContact O-CG 3.31Å; Q163-R167 WeakPolarHBondContact O-CG 3.36Å; Q163-R167 PolarHBondContact O-N 3.12Å; Q163-R167 VanDerWaalsContact O-N 3.17Å
164	L	96.3	Very high	93.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.6	-37.7	175.3	-175.6	60.1	0	0	0	111.4	L134 F135 F160 W161 S162 R167 T168 F197 I316 V320	L134-L164 HydrophobicContact CD2-CB 3.98Å; L134-L164 HydrophobicContact CD2-CD1 4.16Å; F135-L164 HydrophobicContact CE1-CD1 4.15Å; F135-L164 HydrophobicContact CZ-CD1 3.96Å; F160-L164 HydrophobicContact CE1-CD2 4.22Å; F160-L164 HydrophobicContact CZ-CD2 3.98Å; F160-L164 VanDerWaalsContact O-CB 3.32Å; F160-L164 WeakPolarHBondContact O-CB 3.47Å; F160-L164 PolarHBondContact O-N 3.01Å; W161-L164 HydrophobicContact CE3-CD2 3.97Å; W161-L164 HydrophobicContact CZ3-CD2 3.89Å; W161-L164 PolarHBondContact O-N 2.86Å; S162-L164 VanDerWaalsContact C-N 3.3Å; S162-L164 PolarHBondContact O-N 3.36Å; L164-R167 PolarHBondContact O-N 3.38Å; L164-T168 VanDerWaalsContact O-CB 3.31Å; L164-T168 WeakPolarHBondContact O-CB 3.47Å; L164-T168 PolarHBondContact O-N 3.19Å; L164-T168 PolarHBondContact O-OG1 2.72Å; L164-F197 HydrophobicContact CB-CZ 4.39Å; L164-F197 HydrophobicContact CD2-CZ 4.35Å; L164-F197 HydrophobicContact CG-CZ 4.09Å; L164-I316 HydrophobicContact CD2-CG2 4.24Å; L164-V320 HydrophobicContact CD1-CG2 4.38Å; L164-V320 HydrophobicContact CD2-CG2 3.88Å; L164-V320 HydrophobicContact CG-CG2 4.3Å
165	L	96.3	Very high	92.7	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.2	-49.1	176	-179.9	57.4	0	0	0	111.4	W161 S162 Q163 R167 T168 F169 V187 Q191 P196 F197 L323 F330	W161-L165 WeakPolarHBondContact O-CB 3.46Å; W161-L165 PolarHBondContact O-N 3.43Å; S162-L165 WeakPolarHBondContact O-CB 3.26Å; S162-L165 PolarHBondContact O-N 3.09Å; Q163-L165 VanDerWaalsContact C-N 3.34Å; L165-R167 VanDerWaalsContact C-N 3.34Å; L165-R167 PolarHBondContact O-N 2.83Å; L165-T168 PolarHBondContact O-N 2.64Å; L165-F169 VanDerWaalsContact O-CB 3.31Å; L165-F169 WeakPolarHBondContact O-CB 3.36Å; L165-F169 PolarHBondContact O-N 3.32Å; L165-V187 HydrophobicContact CD2-CG1 4.32Å; L165-V187 HydrophobicContact CG-CG1 4.14Å; L165-Q191 HydrophobicContact CD2-CB 4.11Å; L165-P196 HydrophobicContact CD1-CB 3.73Å; L165-P196 HydrophobicContact CD1-CG 3.58Å; L165-P196 HydrophobicContact CD2-CG 3.61Å; L165-P196 HydrophobicContact CG-CG 4.23Å; L165-F197 HydrophobicContact CB-CE2 3.79Å; L165-F197 HydrophobicContact CB-CZ 3.97Å; L165-F197 HydrophobicContact CD1-CE2 4.28Å; L165-F197 HydrophobicContact CD1-CZ 4.17Å; L165-L323 HydrophobicContact CD1-CD2 3.65Å; L165-F330 HydrophobicContact CD1-CE1 3.89Å; L165-F330 HydrophobicContact CD1-CZ 3.85Å; L165-F330 HydrophobicContact CD2-CZ 4.27Å; L165-F330 HydrophobicContact CG-CZ 4.46Å
166	E	94.9	Very high	91.9	Very high	55 Å²	55	51.5 Å²	51.5	26%	0.257	28%	0.28	S	S	.	.	H	α-helix	trans	-56.8	-47.9	177.7	-68.2	177.3	-171.2	0	0	111.8	S162 F169 K170 L184 A188	S162-E166 PolarHBondContact O-N 3.12Å; S162-E166 VanDerWaalsContact O-N 3.11Å; E166-F169 PolarHBondContact O-N 3.35Å; E166-K170 VanDerWaalsContact O-CB 3.23Å; E166-K170 WeakPolarHBondContact O-CB 3.34Å; E166-K170 PolarHBondContact O-N 2.89Å; E166-L184 HydrophobicContact CB-CB 4.38Å; E166-L184 HydrophobicContact CB-CD2 4.41Å; E166-L184 HydrophobicContact CG-CB 4.02Å; E166-A188 HydrophobicContact CG-CB 3.99Å; E166-A188 WeakPolarHBondContact OE1-CB 3.2Å
167	R	94.1	Very high	91.3	Very high	74 Å²	74	52.6 Å²	52.6	28%	0.279	29%	0.288	S	S	.	.	H	α-helix	trans	-64.5	-40.9	179.5	-72.5	164.6	170.4	128.9	8.7	112.1	L127 N131 L134 Q163 L164 L165 A171	L127-R167 HydrophobicContact CD1-CB 4.47Å; N131-R167 WeakPolarHBondContact OD1-CD 3.44Å; N131-R167 PolarHBondContact OD1-NE 3.26Å; L134-R167 VanDerWaalsContact CG-NH1 3.3Å; Q163-R167 VanDerWaalsContact CB-NH1 3.34Å; Q163-R167 WeakPolarHBondContact O-CD 3.5Å; Q163-R167 VanDerWaalsContact O-CG 3.31Å; Q163-R167 WeakPolarHBondContact O-CG 3.36Å; Q163-R167 PolarHBondContact O-N 3.12Å; Q163-R167 VanDerWaalsContact O-N 3.17Å; L164-R167 PolarHBondContact O-N 3.38Å; L165-R167 VanDerWaalsContact C-N 3.34Å; L165-R167 PolarHBondContact O-N 2.83Å; R167-A171 WeakPolarHBondContact O-CB 3.31Å; R167-A171 PolarHBondContact O-N 3.25Å
168	T	93.4	Very high	90.6	Very high	3 Å²	3	59.7 Å²	59.7	2%	0.018	33%	0.326	C	S	.	.	H	α-helix	trans	-68.8	-42.8	179.5	-53.4	0	0	0	0	111.2	L127 L164 L165 A171 S172 V320 L323 M327	L127-T168 HydrophobicContact CD2-CG2 3.91Å; L164-T168 VanDerWaalsContact O-CB 3.31Å; L164-T168 WeakPolarHBondContact O-CB 3.47Å; L164-T168 PolarHBondContact O-N 3.19Å; L164-T168 PolarHBondContact O-OG1 2.72Å; L165-T168 PolarHBondContact O-N 2.64Å; T168-A171 PolarHBondContact O-N 3.47Å; T168-S172 PolarHBondContact O-N 3.06Å; T168-V320 HydrophobicContact CG2-CG1 4.41Å; T168-L323 HydrophobicContact CG2-CD2 3.7Å; T168-L323 HydrophobicContact CG2-CG 4.33Å; T168-M327 HydrophobicContact CG2-CE 4.09Å
169	F	93.4	Very high	90.2	Very high	0 Å²	0	59 Å²	59	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-67.1	-41.6	177.2	-173.9	-95.7	0	0	0	112.2	L165 E166 A171 S172 T173 L179 Y183 L184 V187 M327 F330 T331 V334 Y335	L165-F169 VanDerWaalsContact O-CB 3.31Å; L165-F169 WeakPolarHBondContact O-CB 3.36Å; L165-F169 PolarHBondContact O-N 3.32Å; E166-F169 PolarHBondContact O-N 3.35Å; F169-A171 VanDerWaalsContact C-N 3.28Å; F169-A171 PolarHBondContact O-N 2.83Å; F169-S172 PolarHBondContact O-N 3.19Å; F169-S172 PolarHBondContact O-OG 3.46Å; F169-T173 PolarHBondContact O-N 3.38Å; F169-T173 PolarHBondContact O-OG1 3.47Å; F169-L179 HydrophobicContact CD1-CD1 3.99Å; F169-L179 HydrophobicContact CE1-CD1 3.97Å; F169-L179 HydrophobicContact CE1-CD2 4.48Å; F169-Y183 AromaticContact CE1-CE1 3.92Å; F169-Y183 HydrophobicContact CE1-CE1 3.92Å; F169-Y183 HydrophobicContact CZ-CE1 4.47Å; F169-L184 HydrophobicContact CD1-CD2 4.37Å; F169-V187 HydrophobicContact CB-CG1 4.3Å; F169-V187 HydrophobicContact CD1-CG1 4.38Å; F169-V187 HydrophobicContact CD1-CG2 4.21Å; F169-V187 HydrophobicContact CD2-CG1 4.48Å; F169-V187 HydrophobicContact CE1-CG2 4.22Å; F169-V187 HydrophobicContact CG-CG1 4.12Å; F169-M327 HydrophobicContact CD2-SD 4.41Å; F169-F330 HydrophobicContact CD2-CD1 4.01Å; F169-F330 AromaticContact CD2-CE1 3.7Å; F169-F330 HydrophobicContact CD2-CE1 3.7Å; F169-F330 HydrophobicContact CE2-CD1 4.33Å; F169-F330 HydrophobicContact CE2-CE1 4.21Å; F169-T331 HydrophobicContact CE2-CG2 4.18Å; F169-T331 HydrophobicContact CZ-CG2 4.33Å; F169-V334 HydrophobicContact CE2-CG1 4.43Å; F169-V334 HydrophobicContact CZ-CG1 4.14Å; F169-Y335 HydrophobicContact CZ-CE1 4.39Å
170	K	91.4	Very high	89.9	Confident	130 Å²	130	56.6 Å²	56.6	57%	0.565	32%	0.315	S	S	*	.	H	α-helix	trans	-62	-37.3	174.8	-174.2	174.7	-177	171.1	0	112	E166 T173 L179 L184	E166-K170 VanDerWaalsContact O-CB 3.23Å; E166-K170 WeakPolarHBondContact O-CB 3.34Å; E166-K170 PolarHBondContact O-N 2.89Å; K170-T173 PolarHBondContact O-N 3.23Å; K170-L179 HydrophobicContact CB-CD1 4.47Å; K170-L184 HydrophobicContact CB-CD2 4.47Å; K170-L184 HydrophobicContact CD-CD1 4.33Å
171	A	90.2	Very high	89.4	Confident	70 Å²	70	64.4 Å²	64.4	58%	0.579	35%	0.351	S	S	*	.	H	α-helix	trans	-72.6	-26.3	178.9	0	0	0	0	0	113.8	L127 R167 T168 F169	L127-A171 HydrophobicContact CD1-CB 4.36Å; R167-A171 WeakPolarHBondContact O-CB 3.31Å; R167-A171 PolarHBondContact O-N 3.25Å; T168-A171 PolarHBondContact O-N 3.47Å; F169-A171 VanDerWaalsContact C-N 3.28Å; F169-A171 PolarHBondContact O-N 2.83Å
172	S	88.6	Confident	89.1	Confident	53 Å²	53	70.2 Å²	70.2	37%	0.371	38%	0.383	S	S	.	.	H	α-helix	trans	-84.5	-18.8	175.4	63.4	0	0	0	0	113.4	T168 F169 M327	T168-S172 PolarHBondContact O-N 3.06Å; F169-S172 PolarHBondContact O-N 3.19Å; F169-S172 PolarHBondContact O-OG 3.46Å; S172-M327 PolarHBondContact OG-SD 3.5Å
173	T	86.3	Confident	88.9	Confident	17 Å²	17	69.9 Å²	69.9	10%	0.104	38%	0.377	C	S	.	.	S	Bend	trans	-79.5	136.7	-179.6	-57.1	0	0	0	0	110.5	F169 K170 T175 V177 L179	F169-T173 PolarHBondContact O-N 3.38Å; F169-T173 PolarHBondContact O-OG1 3.47Å; K170-T173 PolarHBondContact O-N 3.23Å; T173-T175 PolarHBondContact O-N 3.17Å; T173-V177 HydrophobicContact CG2-CB 3.68Å; T173-V177 HydrophobicContact CG2-CG1 3.87Å; T173-V177 HydrophobicContact CG2-CG2 4.21Å; T173-L179 HydrophobicContact CG2-CD1 4.09Å; T173-L179 HydrophobicContact CG2-CD2 4.45Å; T173-L179 HydrophobicContact CG2-CG 4.34Å
174	P	84.4	Confident	88.7	Confident	81 Å²	81	68.5 Å²	68.5	53%	0.526	37%	0.371	S	S	.	.			trans	-55.7	139.6	175.5	-24.6	33.7	0	0	0	112.2	E176 V177	P174-E176 PolarHBondContact O-N 2.93Å; P174-V177 PolarHBondContact O-N 3.2Å
175	T	76.9	Confident	88.5	Confident	150 Å²	150	73 Å²	73	92%	0.92	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-19.1	-176.8	-32.7	0	0	0	0	114.1	T173 V177	T173-T175 PolarHBondContact O-N 3.17Å; T175-V177 VanDerWaalsContact C-N 3.3Å
176	E	76.2	Confident	88.4	Confident	188 Å²	188	74.6 Å²	74.6	88%	0.879	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-20	178.3	-64.7	165.9	-173.2	0	0	112.7	P174	P174-E176 PolarHBondContact O-N 2.93Å
177	V	81.3	Confident	88.4	Confident	51 Å²	51	72 Å²	72	31%	0.309	39%	0.391	S	S	.	.	S	Bend	trans	-91.2	113.7	179.3	179.7	0	0	0	0	109.3	T173 P174 T175 L179 P341	T173-V177 HydrophobicContact CG2-CB 3.68Å; T173-V177 HydrophobicContact CG2-CG1 3.87Å; T173-V177 HydrophobicContact CG2-CG2 4.21Å; P174-V177 PolarHBondContact O-N 3.2Å; T175-V177 VanDerWaalsContact C-N 3.3Å; V177-L179 HydrophobicContact CG1-CD2 3.97Å; V177-L179 HydrophobicContact CG1-CG 4.45Å; V177-L179 PolarHBondContact O-N 3.32Å; V177-P341 HydrophobicContact CG1-CB 3.35Å; V177-P341 HydrophobicContact CG1-CG 4.12Å
178	N	80.9	Confident	88.4	Confident	151 Å²	151	68.9 Å²	68.9	81%	0.807	38%	0.381	S	S	*	.			trans	-82.4	109.4	174.9	-168.4	21	0	0	0	110.4
179	L	87.3	Confident	88.4	Confident	16 Å²	16	75 Å²	75	8%	0.084	41%	0.407	C	S	.	.			trans	-89.9	116.8	173.7	-59.9	176.2	0	0	0	109.3	F169 K170 T173 V177 Y183 L184 P341	F169-L179 HydrophobicContact CD1-CD1 3.99Å; F169-L179 HydrophobicContact CE1-CD1 3.97Å; F169-L179 HydrophobicContact CE1-CD2 4.48Å; K170-L179 HydrophobicContact CB-CD1 4.47Å; T173-L179 HydrophobicContact CG2-CD1 4.09Å; T173-L179 HydrophobicContact CG2-CD2 4.45Å; T173-L179 HydrophobicContact CG2-CG 4.34Å; V177-L179 HydrophobicContact CG1-CD2 3.97Å; V177-L179 HydrophobicContact CG1-CG 4.45Å; V177-L179 PolarHBondContact O-N 3.32Å; L179-Y183 HydrophobicContact CD2-CD1 3.77Å; L179-Y183 HydrophobicContact CD2-CE1 3.84Å; L179-L184 HydrophobicContact CB-CD2 4.39Å; L179-L184 HydrophobicContact CB-CG 4.35Å; L179-L184 HydrophobicContact CD1-CD2 4.05Å; L179-P341 HydrophobicContact CD2-CB 3.92Å; L179-P341 HydrophobicContact CD2-CG 3.87Å
180	S	88.4	Confident	88.3	Confident	63 Å²	63	76.6 Å²	76.6	44%	0.441	41%	0.414	S	S	.	.			trans	-68.6	160.5	172.9	63.4	0	0	0	0	111.4	Y183 L184	S180-Y183 WeakPolarHBondContact O-CB 3.37Å; S180-Y183 PolarHBondContact O-N 2.91Å; S180-Y183 WeakPolarHBondContact OG-CB 3.42Å; S180-Y183 PolarHBondContact OG-N 3.36Å; S180-L184 PolarHBondContact O-N 3.25Å; S180-L184 VanDerWaalsContact O-N 3.14Å
181	E	88.5	Confident	88.2	Confident	171 Å²	171	71 Å²	71	80%	0.799	39%	0.391	S	S	*	.	H	α-helix	trans	-60.3	-45.3	174.9	-167.3	169	-172.2	0	0	111.3	Y183 L184 E185	E181-Y183 PolarHBondContact O-N 2.96Å; E181-L184 PolarHBondContact O-N 3.42Å; E181-L184 VanDerWaalsContact O-N 3.07Å; E181-E185 PolarHBondContact O-N 3.28Å
182	D	89.6	Confident	88.1	Confident	124 Å²	124	73.7 Å²	73.7	66%	0.663	39%	0.391	S	S	*	.	H	α-helix	trans	-56.8	-35.2	175.1	-58.2	-14.9	0	0	0	113	C186	D182-C186 PolarHBondContact O-N 2.95Å; D182-C186 VanDerWaalsContact O-N 3.07Å
183	Y	92	Very high	88.2	Confident	24 Å²	24	76.5 Å²	76.5	9%	0.094	41%	0.406	C	S	.	.	H	α-helix	trans	-70.4	-43.7	177.9	-172.6	-86.2	0	0	0	110.9	F169 L179 S180 E181 E185 C186 V187 V334 Y335 C338 G339 P341	F169-Y183 AromaticContact CE1-CE1 3.92Å; F169-Y183 HydrophobicContact CE1-CE1 3.92Å; F169-Y183 HydrophobicContact CZ-CE1 4.47Å; L179-Y183 HydrophobicContact CD2-CD1 3.77Å; L179-Y183 HydrophobicContact CD2-CE1 3.84Å; S180-Y183 WeakPolarHBondContact O-CB 3.37Å; S180-Y183 PolarHBondContact O-N 2.91Å; S180-Y183 WeakPolarHBondContact OG-CB 3.42Å; S180-Y183 PolarHBondContact OG-N 3.36Å; E181-Y183 PolarHBondContact O-N 2.96Å; Y183-E185 VanDerWaalsContact C-N 3.33Å; Y183-E185 PolarHBondContact O-N 3.01Å; Y183-C186 WeakPolarHBondContact O-CB 3.35Å; Y183-C186 PolarHBondContact O-N 3.07Å; Y183-V187 HydrophobicContact CD1-CG2 4.01Å; Y183-V187 HydrophobicContact CE1-CG2 3.73Å; Y183-V187 WeakPolarHBondContact O-CG2 3.18Å; Y183-V187 PolarHBondContact O-N 2.75Å; Y183-V334 HydrophobicContact CE1-CG1 4.39Å; Y183-V334 WeakPolarHBondContact OH-CG1 3.5Å; Y183-Y335 VanDerWaalsContact OH-CD1 3.27Å; Y183-Y335 WeakPolarHBondContact OH-CD1 3.17Å; Y183-Y335 WeakPolarHBondContact OH-CE1 3.48Å; Y183-C338 HydrophobicContact CD2-CB 4.49Å; Y183-C338 HydrophobicContact CE2-CB 3.94Å; Y183-G339 VanDerWaalsContact CE2-O 3.32Å; Y183-G339 WeakPolarHBondContact CE2-O 3.36Å; Y183-G339 PolarHBondContact OH-O 2.91Å; Y183-G339 VanDerWaalsContact OH-O 3.08Å; Y183-P341 HydrophobicContact CE1-CG 4.31Å; Y183-P341 HydrophobicContact CE2-CG 4.36Å
184	L	92.8	Very high	88.6	Confident	17 Å²	17	77.6 Å²	77.6	9%	0.089	41%	0.411	C	S	.	.	H	α-helix	trans	-63.9	-38.1	175.7	-69.2	174.4	0	0	0	111.7	E166 F169 K170 L179 S180 E181 C186 V187 A188	E166-L184 HydrophobicContact CB-CB 4.38Å; E166-L184 HydrophobicContact CB-CD2 4.41Å; E166-L184 HydrophobicContact CG-CB 4.02Å; F169-L184 HydrophobicContact CD1-CD2 4.37Å; K170-L184 HydrophobicContact CB-CD2 4.47Å; K170-L184 HydrophobicContact CD-CD1 4.33Å; L179-L184 HydrophobicContact CB-CD2 4.39Å; L179-L184 HydrophobicContact CB-CG 4.35Å; L179-L184 HydrophobicContact CD1-CD2 4.05Å; S180-L184 PolarHBondContact O-N 3.25Å; S180-L184 VanDerWaalsContact O-N 3.14Å; E181-L184 PolarHBondContact O-N 3.42Å; E181-L184 VanDerWaalsContact O-N 3.07Å; L184-C186 VanDerWaalsContact C-N 3.31Å; L184-C186 PolarHBondContact O-N 3.12Å; L184-V187 WeakPolarHBondContact O-CB 3.39Å; L184-V187 PolarHBondContact O-N 3.37Å; L184-V187 VanDerWaalsContact O-N 3.11Å; L184-A188 PolarHBondContact O-N 3.45Å
185	E	92.7	Very high	89.1	Confident	94 Å²	94	79.3 Å²	79.3	44%	0.439	41%	0.407	S	S	.	.	H	α-helix	trans	-61.8	-39.3	173.3	-164.7	-164.2	159	0	0	111.3	E181 Y183 A188 K189	E181-E185 PolarHBondContact O-N 3.28Å; Y183-E185 VanDerWaalsContact C-N 3.33Å; Y183-E185 PolarHBondContact O-N 3.01Å; E185-A188 PolarHBondContact O-N 2.67Å; E185-K189 WeakPolarHBondContact O-CG 3.39Å; E185-K189 PolarHBondContact O-N 2.93Å; E185-K189 WeakPolarHBondContact OE1-CE 3.5Å; E185-K189 IonicContact OE1-NZ 2.66Å; E185-K189 PolarHBondContact OE1-NZ 3.4Å
186	C	93.7	Very high	89.9	Confident	35 Å²	35	72.5 Å²	72.5	24%	0.236	37%	0.365	C	S	.	.	H	α-helix	trans	-61.1	-44.7	172.4	-176.5	0	0	0	0	111.8	D182 Y183 L184 K189 Q190 C338	D182-C186 PolarHBondContact O-N 2.95Å; D182-C186 VanDerWaalsContact O-N 3.07Å; Y183-C186 WeakPolarHBondContact O-CB 3.35Å; Y183-C186 PolarHBondContact O-N 3.07Å; L184-C186 VanDerWaalsContact C-N 3.31Å; L184-C186 PolarHBondContact O-N 3.12Å; C186-K189 PolarHBondContact O-N 3.44Å; C186-Q190 WeakPolarHBondContact O-CG 3.38Å; C186-Q190 PolarHBondContact O-N 3.01Å; C186-C338 HydrophobicContact CB-CB 3.93Å; C186-C338 WeakPolarHBondContact CB-SG 3.33Å; C186-C338 VanDerWaalsContact SG-CA 3.5Å; C186-C338 WeakPolarHBondContact SG-CB 3.46Å; C186-C338 CovalentContact SG-SG 2.05Å; C186-C338 PolarHBondContact SG-SG 3.4Å
187	V	94.4	Very high	90.9	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-59.5	-46.9	176.7	176	0	0	0	0	110.7	L165 F169 Y183 L184 K189 Q190 F330 V334	L165-V187 HydrophobicContact CD2-CG1 4.32Å; L165-V187 HydrophobicContact CG-CG1 4.14Å; F169-V187 HydrophobicContact CB-CG1 4.3Å; F169-V187 HydrophobicContact CD1-CG1 4.38Å; F169-V187 HydrophobicContact CD1-CG2 4.21Å; F169-V187 HydrophobicContact CD2-CG1 4.48Å; F169-V187 HydrophobicContact CE1-CG2 4.22Å; F169-V187 HydrophobicContact CG-CG1 4.12Å; Y183-V187 HydrophobicContact CD1-CG2 4.01Å; Y183-V187 HydrophobicContact CE1-CG2 3.73Å; Y183-V187 WeakPolarHBondContact O-CG2 3.18Å; Y183-V187 PolarHBondContact O-N 2.75Å; L184-V187 WeakPolarHBondContact O-CB 3.39Å; L184-V187 PolarHBondContact O-N 3.37Å; L184-V187 VanDerWaalsContact O-N 3.11Å; V187-K189 VanDerWaalsContact C-N 3.32Å; V187-K189 PolarHBondContact O-N 3.32Å; V187-Q190 WeakPolarHBondContact O-CB 3.36Å; V187-Q190 PolarHBondContact O-N 3.02Å; V187-F330 HydrophobicContact CG1-CE1 4.17Å; V187-F330 HydrophobicContact CG1-CZ 4.03Å; V187-V334 HydrophobicContact CG2-CG1 3.71Å
188	A	93.9	Very high	91.6	Very high	9 Å²	9	61.9 Å²	61.9	7%	0.074	32%	0.316	C	S	.	.	H	α-helix	trans	-56.9	-44.1	176.7	0	0	0	0	0	112.1	E166 L184 E185 Q190 Q191	E166-A188 HydrophobicContact CG-CB 3.99Å; E166-A188 WeakPolarHBondContact OE1-CB 3.2Å; L184-A188 PolarHBondContact O-N 3.45Å; E185-A188 PolarHBondContact O-N 2.67Å; A188-Q190 PolarHBondContact O-N 3.46Å; A188-Q190 VanDerWaalsContact O-N 3.11Å; A188-Q191 WeakPolarHBondContact O-CB 3.31Å; A188-Q191 PolarHBondContact O-N 3.01Å
189	K	93.1	Very high	92.2	Very high	132 Å²	132	58.8 Å²	58.8	57%	0.574	30%	0.3	S	S	*	.	H	α-helix	trans	-60.8	-21.4	176.4	-74.4	171	-176.4	163.5	0	113.8	E185 C186 V187 Q191	E185-K189 WeakPolarHBondContact O-CG 3.39Å; E185-K189 PolarHBondContact O-N 2.93Å; E185-K189 WeakPolarHBondContact OE1-CE 3.5Å; E185-K189 IonicContact OE1-NZ 2.66Å; E185-K189 PolarHBondContact OE1-NZ 3.4Å; C186-K189 PolarHBondContact O-N 3.44Å; V187-K189 VanDerWaalsContact C-N 3.32Å; V187-K189 PolarHBondContact O-N 3.32Å; K189-Q191 VanDerWaalsContact C-N 3.26Å; K189-Q191 PolarHBondContact O-N 3.31Å
190	Q	91.6	Very high	92.6	Very high	32 Å²	32	59.4 Å²	59.4	15%	0.15	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-5.9	176.1	-57.2	-46.8	-54.7	0	0	113.9	C186 V187 A188 E192 T193 L194	C186-Q190 WeakPolarHBondContact O-CG 3.38Å; C186-Q190 PolarHBondContact O-N 3.01Å; V187-Q190 WeakPolarHBondContact O-CB 3.36Å; V187-Q190 PolarHBondContact O-N 3.02Å; A188-Q190 PolarHBondContact O-N 3.46Å; A188-Q190 VanDerWaalsContact O-N 3.11Å; Q190-E192 PolarHBondContact O-N 3.12Å; Q190-T193 PolarHBondContact O-N 3.45Å; Q190-L194 HydrophobicContact CB-CB 4.48Å; Q190-L194 HydrophobicContact CB-CD1 3.78Å; Q190-L194 HydrophobicContact CB-CG 3.99Å; Q190-L194 HydrophobicContact CG-CD1 4.18Å; Q190-L194 WeakPolarHBondContact O-CB 3.39Å; Q190-L194 PolarHBondContact O-N 3.02Å
191	Q	89.6	Confident	93	Very high	14 Å²	14	57.1 Å²	57.1	7%	0.065	29%	0.288	C	S	.	.	H	α-helix	trans	-50.1	-51.5	-177.3	178.9	-176.1	-55.6	0	0	112.7	W161 S162 L165 A188 K189 R195 P196	W161-Q191 VanDerWaalsContact C-OE1 3.25Å; S162-Q191 PolarHBondContact OG-OE1 3.38Å; L165-Q191 HydrophobicContact CD2-CB 4.11Å; A188-Q191 WeakPolarHBondContact O-CB 3.31Å; A188-Q191 PolarHBondContact O-N 3.01Å; K189-Q191 VanDerWaalsContact C-N 3.26Å; K189-Q191 PolarHBondContact O-N 3.31Å; Q191-R195 VanDerWaalsContact O-CA 3.28Å; Q191-R195 WeakPolarHBondContact O-CA 3.49Å; Q191-R195 PolarHBondContact O-N 3.31Å; Q191-P196 WeakPolarHBondContact O-CD 3.12Å
192	E	87.9	Confident	93.3	Very high	126 Å²	126	56.2 Å²	56.2	59%	0.589	28%	0.277	S	S	*	.	H	α-helix	trans	-71.3	-35.9	-176.3	-67.3	-57.2	139.2	0	0	113	Q190	Q190-E192 PolarHBondContact O-N 3.12Å
193	T	91.5	Very high	93.5	Very high	112 Å²	112	53.6 Å²	53.6	69%	0.687	26%	0.263	S	S	*	.	H	α-helix	trans	-81.1	-43.4	-174.1	-55.9	0	0	0	0	111.8	Q190	Q190-T193 PolarHBondContact O-N 3.45Å
194	L	93.2	Very high	93.7	Very high	39 Å²	39	52.9 Å²	52.9	20%	0.204	26%	0.261	C	S	.	.	H	α-helix	trans	-95.1	-16.8	-174.9	-61	-172.5	0	0	0	113.5	Q190 F330 K333 V334	Q190-L194 HydrophobicContact CB-CB 4.48Å; Q190-L194 HydrophobicContact CB-CD1 3.78Å; Q190-L194 HydrophobicContact CB-CG 3.99Å; Q190-L194 HydrophobicContact CG-CD1 4.18Å; Q190-L194 WeakPolarHBondContact O-CB 3.39Å; Q190-L194 PolarHBondContact O-N 3.02Å; L194-F330 HydrophobicContact CB-CD2 4.33Å; L194-F330 HydrophobicContact CB-CE2 4.09Å; L194-F330 HydrophobicContact CD1-CD2 4.23Å; L194-F330 HydrophobicContact CD1-CE2 3.92Å; L194-K333 HydrophobicContact CD1-CB 3.89Å; L194-K333 HydrophobicContact CD2-CB 4.34Å; L194-K333 HydrophobicContact CD2-CD 4Å; L194-V334 HydrophobicContact CD1-CG2 4.32Å
195	R	94.8	Very high	93.8	Very high	118 Å²	118	53.5 Å²	53.5	45%	0.445	26%	0.263	S	S	.	.			trans	45.5	60	-177.4	-60.3	-169.8	-174.9	174.5	8	113	Q191 F197 G198 D199	Q191-R195 VanDerWaalsContact O-CA 3.28Å; Q191-R195 WeakPolarHBondContact O-CA 3.49Å; Q191-R195 PolarHBondContact O-N 3.31Å; R195-F197 PolarHBondContact O-N 2.86Å; R195-F197 VanDerWaalsContact O-N 3.16Å; R195-G198 PolarHBondContact O-N 3.37Å; R195-D199 IonicContact CZ-OD1 3.79Å; R195-D199 IonicContact NH1-OD1 2.79Å; R195-D199 PolarHBondContact NH1-OD1 3.48Å
196	P	95.4	Very high	93.8	Very high	7 Å²	7	53.2 Å²	53.2	5%	0.045	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-32.2	-176.6	17.1	-26.2	0	0	0	113.5	L165 Q191 Y322 L323 F330	L165-P196 HydrophobicContact CD1-CB 3.73Å; L165-P196 HydrophobicContact CD1-CG 3.58Å; L165-P196 HydrophobicContact CD2-CG 3.61Å; L165-P196 HydrophobicContact CG-CG 4.23Å; Q191-P196 WeakPolarHBondContact O-CD 3.12Å; P196-Y322 WeakPolarHBondContact O-CD1 3.26Å; P196-L323 HydrophobicContact CB-CD1 3.66Å; P196-L323 HydrophobicContact CB-CD2 4.31Å; P196-L323 HydrophobicContact CB-CG 4.49Å; P196-L323 WeakPolarHBondContact O-CA 3.35Å; P196-L323 WeakPolarHBondContact O-CB 3.26Å; P196-F330 HydrophobicContact CB-CD2 3.77Å; P196-F330 HydrophobicContact CB-CE1 4.34Å; P196-F330 HydrophobicContact CB-CE2 3.6Å; P196-F330 HydrophobicContact CB-CG 4.23Å; P196-F330 HydrophobicContact CB-CZ 3.9Å; P196-F330 HydrophobicContact CG-CE2 3.9Å; P196-F330 HydrophobicContact CG-CZ 4.12Å
197	F	97.1	Very high	93.9	Very high	1 Å²	1	55 Å²	55	0%	0.004	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	11.6	178.5	-62.1	-54.6	0	0	0	113.6	W161 L164 L165 R195 P201 A319 V320 L323	W161-F197 AromaticContact CE3-CD2 3.98Å; W161-F197 HydrophobicContact CE3-CD2 3.98Å; W161-F197 HydrophobicContact CE3-CE2 4.08Å; L164-F197 HydrophobicContact CB-CZ 4.39Å; L164-F197 HydrophobicContact CD2-CZ 4.35Å; L164-F197 HydrophobicContact CG-CZ 4.09Å; L165-F197 HydrophobicContact CB-CE2 3.79Å; L165-F197 HydrophobicContact CB-CZ 3.97Å; L165-F197 HydrophobicContact CD1-CE2 4.28Å; L165-F197 HydrophobicContact CD1-CZ 4.17Å; R195-F197 PolarHBondContact O-N 2.86Å; R195-F197 VanDerWaalsContact O-N 3.16Å; F197-P201 HydrophobicContact CB-CG 3.51Å; F197-P201 HydrophobicContact CD2-CG 4Å; F197-P201 HydrophobicContact CG-CG 4.18Å; F197-A319 HydrophobicContact CB-CB 3.97Å; F197-A319 HydrophobicContact CD1-CB 4.07Å; F197-A319 WeakPolarHBondContact CD1-O 3.48Å; F197-A319 HydrophobicContact CG-CB 4.2Å; F197-V320 HydrophobicContact CE1-CG2 4.45Å; F197-L323 HydrophobicContact CD1-CB 3.75Å; F197-L323 HydrophobicContact CD1-CD2 3.92Å; F197-L323 HydrophobicContact CD1-CG 4.47Å; F197-L323 HydrophobicContact CE1-CB 3.93Å; F197-L323 HydrophobicContact CE1-CD2 3.37Å; F197-L323 HydrophobicContact CE1-CG 4.29Å; F197-L323 HydrophobicContact CZ-CD2 3.93Å
198	G	95	Very high	93.9	Very high	15 Å²	15	55 Å²	55	16%	0.155	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	-147.6	-171.7	0	0	0	0	0	112	R195 V200	R195-G198 PolarHBondContact O-N 3.37Å; G198-V200 VanDerWaalsContact C-N 3.32Å
199	D	94.7	Very high	94	Very high	85 Å²	85	55.9 Å²	55.9	46%	0.455	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-4.5	-179.9	-66	-45.1	0	0	0	113.3	R195 R202 D203	R195-D199 IonicContact CZ-OD1 3.79Å; R195-D199 IonicContact NH1-OD1 2.79Å; R195-D199 PolarHBondContact NH1-OD1 3.48Å; D199-R202 PolarHBondContact O-N 3.12Å; D199-D203 WeakPolarHBondContact O-CB 3.23Å; D199-D203 PolarHBondContact O-N 3.4Å
200	V	96	Very high	94	Very high	30 Å²	30	55.6 Å²	55.6	18%	0.182	27%	0.27	C	S	.	.	H	α-helix	trans	-56.8	-46.4	-174.2	-178	0	0	0	0	113.2	G198 R202 D203 M204 R315 A319	G198-V200 VanDerWaalsContact C-N 3.32Å; V200-R202 PolarHBondContact O-N 2.89Å; V200-D203 PolarHBondContact O-N 3.01Å; V200-M204 VanDerWaalsContact O-CB 3.27Å; V200-M204 WeakPolarHBondContact O-CB 3.36Å; V200-M204 PolarHBondContact O-N 2.96Å; V200-R315 HydrophobicContact CG1-CB 4Å; V200-R315 VanDerWaalsContact CG1-O 3.31Å; V200-R315 WeakPolarHBondContact CG1-O 3.21Å; V200-A319 HydrophobicContact CB-CB 4.04Å; V200-A319 HydrophobicContact CG1-CB 3.9Å
201	P	95.9	Very high	94.2	Very high	15 Å²	15	54.5 Å²	54.5	10%	0.097	27%	0.266	C	S	.	.	H	α-helix	trans	-58	-46.7	179.3	-28.7	37.8	0	0	0	113.7	W161 F197 K205	W161-P201 HydrophobicContact CD2-CB 3.74Å; W161-P201 HydrophobicContact CD2-CG 3.86Å; W161-P201 HydrophobicContact CE3-CB 4.4Å; W161-P201 HydrophobicContact CE3-CG 4.01Å; W161-P201 HydrophobicContact CG-CB 3.8Å; W161-P201 HydrophobicContact CG-CG 4.25Å; W161-P201 HydrophobicContact CZ2-CB 4.25Å; W161-P201 HydrophobicContact CZ2-CG 4.4Å; W161-P201 HydrophobicContact CZ3-CG 4.35Å; F197-P201 HydrophobicContact CB-CG 3.51Å; F197-P201 HydrophobicContact CD2-CG 4Å; F197-P201 HydrophobicContact CG-CG 4.18Å; P201-K205 WeakPolarHBondContact O-CB 3.33Å; P201-K205 PolarHBondContact O-N 3Å
202	R	94.6	Very high	94.5	Very high	152 Å²	152	53.8 Å²	53.8	57%	0.574	26%	0.263	S	S	*	.	H	α-helix	trans	-66.7	-43.9	-178.4	178.3	-176.4	151	-151.4	-7.3	111.4	D199 V200 K205 T206	D199-R202 PolarHBondContact O-N 3.12Å; V200-R202 PolarHBondContact O-N 2.89Å; R202-K205 PolarHBondContact O-N 2.58Å; R202-T206 PolarHBondContact O-N 3.43Å; R202-T206 PolarHBondContact O-OG1 3.04Å
203	D	94.4	Very high	94.9	Very high	69 Å²	69	47.9 Å²	47.9	37%	0.369	24%	0.235	S	C	.	.	H	α-helix	trans	-64.6	-47.8	178.6	-95.1	30.4	0	0	0	111.9	D199 V200 K207	D199-D203 WeakPolarHBondContact O-CB 3.23Å; D199-D203 PolarHBondContact O-N 3.4Å; V200-D203 PolarHBondContact O-N 3.01Å; D203-K207 WeakPolarHBondContact O-CD 3.26Å; D203-K207 VanDerWaalsContact O-CG 3.28Å; D203-K207 WeakPolarHBondContact O-CG 3.33Å; D203-K207 PolarHBondContact O-N 3.33Å; D203-K207 IonicContact OD2-NZ 3.7Å; D203-K207 PolarHBondContact OD2-NZ 3.48Å
204	M	95.2	Very high	95.1	Very high	8 Å²	8	42.7 Å²	42.7	4%	0.039	20%	0.203	C	C	.	.	H	α-helix	trans	-61.9	-46.2	176.9	177.8	172.7	148.2	0	0	110.3	L138 W161 V200 T206 K207 V208 I312 R315 I316	L138-M204 HydrophobicContact CD2-CE 4.46Å; W161-M204 HydrophobicContact CH2-SD 4.21Å; W161-M204 HydrophobicContact CZ2-CB 4.38Å; W161-M204 HydrophobicContact CZ2-CE 4.27Å; W161-M204 HydrophobicContact CZ2-CG 4.47Å; W161-M204 HydrophobicContact CZ2-SD 3.62Å; V200-M204 VanDerWaalsContact O-CB 3.27Å; V200-M204 WeakPolarHBondContact O-CB 3.36Å; V200-M204 PolarHBondContact O-N 2.96Å; M204-T206 PolarHBondContact O-N 3.13Å; M204-K207 PolarHBondContact O-N 3.4Å; M204-V208 HydrophobicContact CE-CG2 4.44Å; M204-V208 HydrophobicContact CG-CG2 3.85Å; M204-V208 VanDerWaalsContact O-CB 3.31Å; M204-V208 WeakPolarHBondContact O-CB 3.37Å; M204-V208 VanDerWaalsContact O-CG2 3.23Å; M204-V208 WeakPolarHBondContact O-CG2 3.41Å; M204-V208 PolarHBondContact O-N 2.96Å; M204-I312 HydrophobicContact CE-CB 4.32Å; M204-I312 HydrophobicContact CE-CG1 4.25Å; M204-I312 HydrophobicContact CE-CG2 3.61Å; M204-R315 HydrophobicContact SD-CB 3.77Å; M204-I316 HydrophobicContact CE-CD1 4.48Å; M204-I316 HydrophobicContact CE-CG1 4.35Å; M204-I316 HydrophobicContact SD-CG1 4.35Å
205	K	94.6	Very high	95.3	Very high	30 Å²	30	40.8 Å²	40.8	13%	0.13	19%	0.194	C	C	.	.	H	α-helix	trans	-56.3	-51.7	180	179.8	176.1	179	-178.8	0	112.3	D154 L157 S158 P201 R202 K207 V208 I209	D154-K205 WeakPolarHBondContact O-CE 3.43Å; D154-K205 PolarHBondContact O-NZ 3.39Å; D154-K205 WeakPolarHBondContact OD1-CE 3.42Å; D154-K205 IonicContact OD1-NZ 2.7Å; D154-K205 PolarHBondContact OD1-NZ 2.85Å; D154-K205 WeakPolarHBondContact OD2-CE 3.49Å; D154-K205 IonicContact OD2-NZ 2.98Å; D154-K205 PolarHBondContact OD2-NZ 2.95Å; L157-K205 HydrophobicContact CB-CD 4.39Å; L157-K205 HydrophobicContact CB-CG 4.15Å; L157-K205 HydrophobicContact CD1-CB 4.38Å; L157-K205 HydrophobicContact CD1-CG 4Å; S158-K205 PolarHBondContact OG-NZ 3.35Å; P201-K205 WeakPolarHBondContact O-CB 3.33Å; P201-K205 PolarHBondContact O-N 3Å; R202-K205 PolarHBondContact O-N 2.58Å; K205-K207 VanDerWaalsContact C-N 3.33Å; K205-K207 PolarHBondContact O-N 3.06Å; K205-V208 PolarHBondContact O-N 3.08Å; K205-I209 HydrophobicContact CG-CD1 3.65Å; K205-I209 HydrophobicContact CG-CG1 4.47Å; K205-I209 WeakPolarHBondContact O-CB 3.48Å; K205-I209 VanDerWaalsContact O-CG1 3.24Å; K205-I209 WeakPolarHBondContact O-CG1 3.48Å; K205-I209 PolarHBondContact O-N 3.43Å
206	T	93.8	Very high	95.3	Very high	88 Å²	88	35.9 Å²	35.9	54%	0.54	18%	0.175	S	C	.	.	H	α-helix	trans	-58.5	-45.1	179.1	-52.4	0	0	0	0	111.8	R202 M204 R210	R202-T206 PolarHBondContact O-N 3.43Å; R202-T206 PolarHBondContact O-OG1 3.04Å; M204-T206 PolarHBondContact O-N 3.13Å; T206-R210 WeakPolarHBondContact O-CB 3.39Å; T206-R210 PolarHBondContact O-N 2.83Å
207	K	94.4	Very high	95.3	Very high	72 Å²	72	36.1 Å²	36.1	31%	0.313	18%	0.177	S	C	.	.	H	α-helix	trans	-70.8	-43.8	-177	-68.8	165.4	-172.4	157.8	0	111.9	D203 M204 K205 A211 P303 V308	D203-K207 WeakPolarHBondContact O-CD 3.26Å; D203-K207 VanDerWaalsContact O-CG 3.28Å; D203-K207 WeakPolarHBondContact O-CG 3.33Å; D203-K207 PolarHBondContact O-N 3.33Å; D203-K207 IonicContact OD2-NZ 3.7Å; D203-K207 PolarHBondContact OD2-NZ 3.48Å; M204-K207 PolarHBondContact O-N 3.4Å; K205-K207 VanDerWaalsContact C-N 3.33Å; K205-K207 PolarHBondContact O-N 3.06Å; K207-A211 WeakPolarHBondContact O-CB 3.45Å; K207-A211 PolarHBondContact O-N 3.22Å; K207-P303 HydrophobicContact CD-CG 4.14Å; K207-P303 HydrophobicContact CG-CG 4.46Å; K207-V308 HydrophobicContact CB-CG1 3.91Å; K207-V308 HydrophobicContact CB-CG2 4.16Å
208	V	95.9	Very high	95.3	Very high	2 Å²	2	36 Å²	36	1%	0.012	18%	0.177	C	C	.	.	H	α-helix	trans	-65.6	-50.2	179.4	171.3	0	0	0	0	110.4	L142 L157 M204 K205 R210 A211 F212 V308 I312	L142-V208 HydrophobicContact CD1-CG1 4.43Å; L142-V208 HydrophobicContact CD2-CG1 3.73Å; L157-V208 HydrophobicContact CD1-CB 4.43Å; L157-V208 HydrophobicContact CD1-CG1 4.21Å; M204-V208 HydrophobicContact CE-CG2 4.44Å; M204-V208 HydrophobicContact CG-CG2 3.85Å; M204-V208 VanDerWaalsContact O-CB 3.31Å; M204-V208 WeakPolarHBondContact O-CB 3.37Å; M204-V208 VanDerWaalsContact O-CG2 3.23Å; M204-V208 WeakPolarHBondContact O-CG2 3.41Å; M204-V208 PolarHBondContact O-N 2.96Å; K205-V208 PolarHBondContact O-N 3.08Å; V208-R210 VanDerWaalsContact C-N 3.33Å; V208-R210 PolarHBondContact O-N 2.92Å; V208-A211 PolarHBondContact O-N 3.48Å; V208-F212 HydrophobicContact CG1-CD2 3.75Å; V208-F212 HydrophobicContact CG1-CE2 3.87Å; V208-F212 VanDerWaalsContact O-CD2 3.3Å; V208-F212 WeakPolarHBondContact O-CD2 3.34Å; V208-F212 PolarHBondContact O-N 2.79Å; V208-V308 HydrophobicContact CG2-CG1 4.31Å; V208-I312 HydrophobicContact CG2-CD1 4.1Å; V208-I312 HydrophobicContact CG2-CG1 3.99Å
209	I	95	Very high	95.5	Very high	26 Å²	26	36.1 Å²	36.1	13%	0.133	17%	0.174	C	C	.	.	H	α-helix	trans	-54.7	-51.9	178.3	-69.5	171.1	0	0	0	110.1	L153 D154 L157 K205 A211 F212 V213	L153-I209 HydrophobicContact CB-CD1 4.47Å; L153-I209 HydrophobicContact CB-CG1 3.87Å; D154-I209 HydrophobicContact CB-CD1 4.13Å; L157-I209 HydrophobicContact CD1-CD1 4.18Å; L157-I209 HydrophobicContact CD1-CG1 3.76Å; K205-I209 HydrophobicContact CG-CD1 3.65Å; K205-I209 HydrophobicContact CG-CG1 4.47Å; K205-I209 WeakPolarHBondContact O-CB 3.48Å; K205-I209 VanDerWaalsContact O-CG1 3.24Å; K205-I209 WeakPolarHBondContact O-CG1 3.48Å; K205-I209 PolarHBondContact O-N 3.43Å; I209-A211 PolarHBondContact O-N 3.02Å; I209-F212 PolarHBondContact O-N 2.91Å; I209-V213 HydrophobicContact CG2-CG2 3.84Å; I209-V213 WeakPolarHBondContact O-CB 3.44Å; I209-V213 WeakPolarHBondContact O-CG2 3.26Å; I209-V213 PolarHBondContact O-N 2.72Å
210	R	94.4	Very high	95.5	Very high	126 Å²	126	34.4 Å²	34.4	48%	0.475	16%	0.163	S	C	.	.	H	α-helix	trans	-55.8	-50.7	178.8	-170.6	177.8	-172	-175.8	3.5	111.6	T206 V208 F212 V213 T214 L471	T206-R210 WeakPolarHBondContact O-CB 3.39Å; T206-R210 PolarHBondContact O-N 2.83Å; V208-R210 VanDerWaalsContact C-N 3.33Å; V208-R210 PolarHBondContact O-N 2.92Å; R210-F212 VanDerWaalsContact C-N 3.32Å; R210-F212 PolarHBondContact O-N 2.64Å; R210-V213 PolarHBondContact O-N 3.33Å; R210-T214 VanDerWaalsContact O-CB 3.29Å; R210-T214 WeakPolarHBondContact O-CB 3.35Å; R210-T214 PolarHBondContact O-N 3.27Å; R210-T214 PolarHBondContact O-OG1 3.08Å; R210-L471 PolarHBondContact NE-O 3.06Å; R210-L471 PolarHBondContact NH2-O 2.78Å
211	A	95.7	Very high	95.6	Very high	9 Å²	9	33 Å²	33	7%	0.074	15%	0.154	C	C	.	.	H	α-helix	trans	-57.4	-43.7	-179.9	0	0	0	0	0	112.7	K207 V208 I209 A215 M305 V308	K207-A211 WeakPolarHBondContact O-CB 3.45Å; K207-A211 PolarHBondContact O-N 3.22Å; V208-A211 PolarHBondContact O-N 3.48Å; I209-A211 PolarHBondContact O-N 3.02Å; A211-A215 WeakPolarHBondContact O-CB 3.48Å; A211-A215 PolarHBondContact O-N 2.92Å; A211-M305 HydrophobicContact CB-CE 4.35Å; A211-M305 VanDerWaalsContact O-CE 3.31Å; A211-M305 WeakPolarHBondContact O-CE 3.26Å; A211-V308 HydrophobicContact CB-CG1 4.06Å
212	F	96.1	Very high	95.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-72.7	-45	-179	-85.9	-95.1	0	0	0	113.2	F106 H110 L142 Y145 L153 V208 I209 R210 A215 R216 L309	F106-F212 HydrophobicContact CE1-CD1 4.17Å; F106-F212 AromaticContact CE1-CE1 3.84Å; F106-F212 HydrophobicContact CE1-CE1 3.84Å; F106-F212 HydrophobicContact CE1-CZ 4.37Å; F106-F212 AromaticContact CZ-CD1 3.85Å; F106-F212 HydrophobicContact CZ-CD1 3.85Å; F106-F212 HydrophobicContact CZ-CD2 4.5Å; F106-F212 AromaticContact CZ-CE1 3.79Å; F106-F212 HydrophobicContact CZ-CE1 3.79Å; F106-F212 HydrophobicContact CZ-CE2 4.48Å; F106-F212 HydrophobicContact CZ-CG 4.22Å; F106-F212 HydrophobicContact CZ-CZ 4.13Å; H110-F212 AromaticContact CD2-CZ 3.54Å; H110-F212 AromaticContact NE2-CZ 3.74Å; L142-F212 HydrophobicContact CB-CE1 3.77Å; L142-F212 HydrophobicContact CB-CE2 4.36Å; L142-F212 HydrophobicContact CB-CZ 3.64Å; L142-F212 HydrophobicContact CD1-CE2 4.17Å; L142-F212 HydrophobicContact CD1-CZ 4.07Å; L142-F212 HydrophobicContact CD2-CD2 4.14Å; L142-F212 HydrophobicContact CD2-CE1 4.37Å; L142-F212 HydrophobicContact CD2-CE2 3.89Å; L142-F212 HydrophobicContact CD2-CG 4.46Å; L142-F212 HydrophobicContact CD2-CZ 4.02Å; L142-F212 HydrophobicContact CG-CE2 4.37Å; L142-F212 HydrophobicContact CG-CZ 4.12Å; L142-F212 VanDerWaalsContact O-CE1 3.27Å; L142-F212 WeakPolarHBondContact O-CE1 3.33Å; Y145-F212 HydrophobicContact CD1-CB 3.97Å; Y145-F212 HydrophobicContact CD1-CD1 4.23Å; Y145-F212 HydrophobicContact CE1-CB 3.88Å; L153-F212 HydrophobicContact CD1-CB 3.79Å; L153-F212 HydrophobicContact CD1-CG 4.41Å; V208-F212 HydrophobicContact CG1-CD2 3.75Å; V208-F212 HydrophobicContact CG1-CE2 3.87Å; V208-F212 VanDerWaalsContact O-CD2 3.3Å; V208-F212 WeakPolarHBondContact O-CD2 3.34Å; V208-F212 PolarHBondContact O-N 2.79Å; I209-F212 PolarHBondContact O-N 2.91Å; R210-F212 VanDerWaalsContact C-N 3.32Å; R210-F212 PolarHBondContact O-N 2.64Å; F212-A215 PolarHBondContact O-N 3.45Å; F212-R216 WeakPolarHBondContact O-CB 3.3Å; F212-R216 PolarHBondContact O-N 2.73Å; F212-L309 HydrophobicContact CD2-CD2 4Å; F212-L309 HydrophobicContact CE2-CD2 3.29Å; F212-L309 HydrophobicContact CZ-CD2 3.84Å
213	V	95	Very high	95.9	Very high	1 Å²	1	28 Å²	28	1%	0.006	14%	0.14	C	C	.	.	H	α-helix	trans	-59.4	-48.7	176.9	172.6	0	0	0	0	110.2	Y145 I209 R210 S217 A470 N474 D475	Y145-V213 WeakPolarHBondContact OH-CG2 3.4Å; I209-V213 HydrophobicContact CG2-CG2 3.84Å; I209-V213 WeakPolarHBondContact O-CB 3.44Å; I209-V213 WeakPolarHBondContact O-CG2 3.26Å; I209-V213 PolarHBondContact O-N 2.72Å; R210-V213 PolarHBondContact O-N 3.33Å; V213-S217 VanDerWaalsContact O-CB 3.3Å; V213-S217 WeakPolarHBondContact O-CB 3.24Å; V213-S217 PolarHBondContact O-N 3.03Å; V213-S217 PolarHBondContact O-OG 3.23Å; V213-A470 HydrophobicContact CG1-CB 3.9Å; V213-N474 WeakPolarHBondContact CG1-O 3.48Å; V213-D475 HydrophobicContact CG1-CB 4.45Å; V213-D475 HydrophobicContact CG2-CB 3.88Å
214	T	95.9	Very high	96.1	Very high	3 Å²	3	26.6 Å²	26.6	2%	0.018	13%	0.134	C	C	.	.	H	α-helix	trans	-65.1	-44	-179.6	-49.8	0	0	0	0	111.3	R210 F218 V295 F299 A470	R210-T214 VanDerWaalsContact O-CB 3.29Å; R210-T214 WeakPolarHBondContact O-CB 3.35Å; R210-T214 PolarHBondContact O-N 3.27Å; R210-T214 PolarHBondContact O-OG1 3.08Å; T214-F218 WeakPolarHBondContact O-CB 3.29Å; T214-F218 PolarHBondContact O-N 3.37Å; T214-V295 HydrophobicContact CG2-CG1 3.66Å; T214-F299 HydrophobicContact CG2-CD1 4.35Å; T214-F299 HydrophobicContact CG2-CE1 3.61Å; T214-F299 HydrophobicContact CG2-CZ 4.45Å; T214-A470 PolarHBondContact OG1-O 2.7Å
215	A	96.8	Very high	96.2	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64.7	-44.8	178	0	0	0	0	0	112.8	F102 F106 Y146 A211 F212 F218 V219 M305	F102-A215 HydrophobicContact CE1-CB 4.18Å; F102-A215 HydrophobicContact CZ-CB 4.33Å; F106-A215 HydrophobicContact CD2-CB 3.6Å; F106-A215 HydrophobicContact CE2-CB 3.25Å; F106-A215 HydrophobicContact CG-CB 4.43Å; F106-A215 HydrophobicContact CZ-CB 3.88Å; Y146-A215 HydrophobicContact CD2-CB 4.42Å; Y146-A215 HydrophobicContact CE2-CB 3.95Å; A211-A215 WeakPolarHBondContact O-CB 3.48Å; A211-A215 PolarHBondContact O-N 2.92Å; F212-A215 PolarHBondContact O-N 3.45Å; A215-F218 PolarHBondContact O-N 3.33Å; A215-V219 WeakPolarHBondContact O-CG2 3.35Å; A215-V219 PolarHBondContact O-N 3.2Å; A215-V219 VanDerWaalsContact O-N 3.12Å; A215-M305 HydrophobicContact CB-CE 3.84Å; A215-M305 HydrophobicContact CB-SD 4.42Å
216	R	95.7	Very high	96.4	Very high	15 Å²	15	25 Å²	25	6%	0.057	13%	0.128	C	C	.	.	H	α-helix	trans	-60.1	-50.5	177	174.2	179.6	168.3	156.8	-3.6	110.9	Y145 Y146 G148 S149 F212 F218 V219 Q220 D477	Y145-R216 PolarHBondContact O-NH1 3.37Å; Y146-R216 HydrophobicContact CD2-CB 4.39Å; G148-R216 PolarHBondContact O-NH2 2.81Å; S149-R216 PolarHBondContact O-NH1 2.95Å; F212-R216 WeakPolarHBondContact O-CB 3.3Å; F212-R216 PolarHBondContact O-N 2.73Å; R216-F218 VanDerWaalsContact C-N 3.29Å; R216-F218 PolarHBondContact O-N 2.92Å; R216-V219 PolarHBondContact O-N 2.97Å; R216-Q220 WeakPolarHBondContact O-CG 3.04Å; R216-Q220 PolarHBondContact O-N 3.05Å; R216-D477 IonicContact CZ-OD2 3.03Å; R216-D477 VanDerWaalsContact CZ-OD2 3.22Å; R216-D477 IonicContact NE-OD2 3.74Å; R216-D477 PolarHBondContact NE-OD2 3.42Å; R216-D477 IonicContact NH2-OD2 3.81Å; R216-D477 PolarHBondContact NH2-OD2 2.96Å
217	S	95.9	Very high	96.6	Very high	11 Å²	11	24.2 Å²	24.2	8%	0.077	12%	0.118	C	C	.	.	H	α-helix	trans	-61.1	-39.7	-179.8	-59.2	0	0	0	0	111.7	V213 Q220 G221 M463 L467 A470	V213-S217 VanDerWaalsContact O-CB 3.3Å; V213-S217 WeakPolarHBondContact O-CB 3.24Å; V213-S217 PolarHBondContact O-N 3.03Å; V213-S217 PolarHBondContact O-OG 3.23Å; S217-Q220 PolarHBondContact O-N 3.28Å; S217-G221 PolarHBondContact O-N 3.33Å; S217-M463 WeakPolarHBondContact O-CE 3.48Å; S217-L467 WeakPolarHBondContact O-CD2 3.37Å; S217-A470 VanDerWaalsContact OG-CB 3.31Å; S217-A470 WeakPolarHBondContact OG-CB 3.39Å
218	F	97.5	Very high	96.8	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.3	-47.3	176.6	-175.5	-108.4	0	0	0	112.7	F102 T214 A215 R216 G221 L222 M292 V295 A296 F299 L383 L387	F102-F218 AromaticContact CD1-CD1 3.76Å; F102-F218 HydrophobicContact CD1-CD1 3.76Å; F102-F218 HydrophobicContact CD1-CE1 4.18Å; F102-F218 HydrophobicContact CD2-CE1 4.4Å; F102-F218 AromaticContact CE1-CD1 3.83Å; F102-F218 HydrophobicContact CE1-CD1 3.83Å; F102-F218 HydrophobicContact CG-CD1 4.14Å; F102-F218 HydrophobicContact CG-CE1 4.09Å; F102-F218 HydrophobicContact CZ-CD1 4.28Å; T214-F218 WeakPolarHBondContact O-CB 3.29Å; T214-F218 PolarHBondContact O-N 3.37Å; A215-F218 PolarHBondContact O-N 3.33Å; R216-F218 VanDerWaalsContact C-N 3.29Å; R216-F218 PolarHBondContact O-N 2.92Å; F218-G221 PolarHBondContact O-N 2.83Å; F218-L222 HydrophobicContact CD1-CD1 4.11Å; F218-L222 HydrophobicContact CE1-CD1 3.74Å; F218-L222 HydrophobicContact CE1-CG 4.46Å; F218-L222 HydrophobicContact CZ-CD1 4.26Å; F218-L222 PolarHBondContact O-N 2.99Å; F218-L222 VanDerWaalsContact O-N 3.08Å; F218-M292 HydrophobicContact CD2-CE 4.4Å; F218-M292 HydrophobicContact CE2-CB 4.12Å; F218-M292 HydrophobicContact CE2-CE 4.13Å; F218-M292 WeakPolarHBondContact CE2-O 3.45Å; F218-V295 HydrophobicContact CB-CG1 3.77Å; F218-V295 HydrophobicContact CD2-CB 4.09Å; F218-V295 HydrophobicContact CD2-CG1 3.58Å; F218-V295 HydrophobicContact CG-CG1 4Å; F218-A296 HydrophobicContact CE2-CB 4.13Å; F218-A296 HydrophobicContact CZ-CB 4.21Å; F218-F299 HydrophobicContact CB-CZ 3.96Å; F218-F299 HydrophobicContact CD1-CE2 4.06Å; F218-F299 HydrophobicContact CD1-CZ 4.17Å; F218-F299 HydrophobicContact CE1-CE2 4.37Å; F218-F299 HydrophobicContact CG-CE2 4.22Å; F218-F299 AromaticContact CG-CZ 3.99Å; F218-F299 HydrophobicContact CG-CZ 3.99Å; F218-L383 HydrophobicContact CE1-CD1 3.81Å; F218-L383 HydrophobicContact CE1-CD2 3.92Å; F218-L383 HydrophobicContact CE1-CG 4.47Å; F218-L383 HydrophobicContact CZ-CB 4.5Å; F218-L383 HydrophobicContact CZ-CD1 3.96Å; F218-L383 HydrophobicContact CZ-CD2 3.91Å; F218-L383 HydrophobicContact CZ-CG 4.36Å; F218-L387 HydrophobicContact CE2-CD1 4.36Å; F218-L387 HydrophobicContact CZ-CD1 4.41Å
219	V	97.3	Very high	96.9	Very high	17 Å²	17	20.8 Å²	20.8	10%	0.103	10%	0.103	C	C	.	.	H	α-helix	trans	-61.5	-45.2	177.1	168.8	0	0	0	0	111	H99 F102 Y146 A215 R216 G221 L222 V223	H99-V219 WeakPolarHBondContact CD2-CG1 3.43Å; H99-V219 VanDerWaalsContact NE2-CG1 3.26Å; H99-V219 WeakPolarHBondContact NE2-CG1 3.29Å; F102-V219 HydrophobicContact CD1-CG2 3.62Å; F102-V219 HydrophobicContact CE1-CG2 3.98Å; Y146-V219 HydrophobicContact CE2-CG2 4.43Å; Y146-V219 WeakPolarHBondContact OH-CG2 3.17Å; A215-V219 WeakPolarHBondContact O-CG2 3.35Å; A215-V219 PolarHBondContact O-N 3.2Å; A215-V219 VanDerWaalsContact O-N 3.12Å; R216-V219 PolarHBondContact O-N 2.97Å; V219-G221 VanDerWaalsContact C-N 3.31Å; V219-G221 PolarHBondContact O-N 3.35Å; V219-L222 PolarHBondContact O-N 2.89Å; V219-V223 WeakPolarHBondContact O-CG2 3.26Å; V219-V223 PolarHBondContact O-N 3.2Å; V219-V223 VanDerWaalsContact O-N 3.14Å
220	Q	96.5	Very high	97	Very high	48 Å²	48	23 Å²	23	22%	0.224	11%	0.112	C	C	.	.	H	α-helix	trans	-59.8	-41.9	173.9	-71.4	171.6	-26.8	0	0	111.6	R216 S217 L222 V223 V224 M463 D477	R216-Q220 WeakPolarHBondContact O-CG 3.04Å; R216-Q220 PolarHBondContact O-N 3.05Å; S217-Q220 PolarHBondContact O-N 3.28Å; Q220-L222 VanDerWaalsContact C-N 3.31Å; Q220-L222 PolarHBondContact O-N 3.42Å; Q220-V223 PolarHBondContact O-N 3.44Å; Q220-V223 VanDerWaalsContact O-N 3.13Å; Q220-V224 WeakPolarHBondContact O-CB 3.49Å; Q220-V224 WeakPolarHBondContact O-CG2 3.48Å; Q220-V224 PolarHBondContact O-N 3.41Å; Q220-M463 HydrophobicContact CB-CE 4.31Å; Q220-M463 HydrophobicContact CB-SD 4.3Å; Q220-D477 PolarHBondContact NE2-OD2 3.45Å; Q220-D477 PolarHBondContact OE1-OD2 3.33Å
221	G	97.6	Very high	97.2	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-57.3	-41.1	175.7	0	0	0	0	0	113.2	S217 F218 V219 S225	S217-G221 PolarHBondContact O-N 3.33Å; F218-G221 PolarHBondContact O-N 2.83Å; V219-G221 VanDerWaalsContact C-N 3.31Å; V219-G221 PolarHBondContact O-N 3.35Å; G221-S225 VanDerWaalsContact O-CB 3.29Å; G221-S225 WeakPolarHBondContact O-CB 3.39Å; G221-S225 PolarHBondContact O-N 3.48Å; G221-S225 PolarHBondContact O-OG 2.94Å
222	L	98.3	Very high	97.3	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-64.9	-42.6	175.1	-67.4	166.5	0	0	0	111.9	F95 L98 H99 F218 V219 Q220 S226 M292 L387	F95-L222 HydrophobicContact CD1-CB 4.43Å; F95-L222 HydrophobicContact CD1-CD2 3.7Å; F95-L222 HydrophobicContact CE1-CD2 4.08Å; L98-L222 HydrophobicContact CB-CD1 4.33Å; L98-L222 HydrophobicContact CB-CD2 4.04Å; L98-L222 HydrophobicContact CD1-CD2 4.26Å; H99-L222 HydrophobicContact CB-CB 4.13Å; H99-L222 HydrophobicContact CB-CD1 4.16Å; F218-L222 HydrophobicContact CD1-CD1 4.11Å; F218-L222 HydrophobicContact CE1-CD1 3.74Å; F218-L222 HydrophobicContact CE1-CG 4.46Å; F218-L222 HydrophobicContact CZ-CD1 4.26Å; F218-L222 PolarHBondContact O-N 2.99Å; F218-L222 VanDerWaalsContact O-N 3.08Å; V219-L222 PolarHBondContact O-N 2.89Å; Q220-L222 VanDerWaalsContact C-N 3.31Å; Q220-L222 PolarHBondContact O-N 3.42Å; L222-S226 PolarHBondContact O-N 3.44Å; L222-S226 VanDerWaalsContact O-N 3.11Å; L222-M292 HydrophobicContact CB-CE 4.31Å; L222-M292 HydrophobicContact CD2-CE 3.39Å; L222-M292 HydrophobicContact CG-CE 3.52Å; L222-L387 HydrophobicContact CD2-CD2 4.47Å
223	V	97.7	Very high	97.3	Very high	62 Å²	62	21.5 Å²	21.5	38%	0.376	11%	0.108	S	C	.	.	H	α-helix	trans	-67.2	-47.5	179.1	174.5	0	0	0	0	111.5	H99 V219 Q220 S225 S226 E227	H99-V223 VanDerWaalsContact CD2-CG2 3.48Å; H99-V223 WeakPolarHBondContact CD2-CG2 3.26Å; V219-V223 WeakPolarHBondContact O-CG2 3.26Å; V219-V223 PolarHBondContact O-N 3.2Å; V219-V223 VanDerWaalsContact O-N 3.14Å; Q220-V223 PolarHBondContact O-N 3.44Å; Q220-V223 VanDerWaalsContact O-N 3.13Å; V223-S225 VanDerWaalsContact C-N 3.32Å; V223-S225 PolarHBondContact O-N 3.13Å; V223-S226 WeakPolarHBondContact O-CB 3.37Å; V223-S226 PolarHBondContact O-N 3.14Å; V223-E227 PolarHBondContact O-N 3.36Å
224	V	97.9	Very high	97.3	Very high	40 Å²	40	27.4 Å²	27.4	24%	0.242	14%	0.136	C	C	.	.	H	α-helix	trans	-60.4	-43.7	178	170.4	0	0	0	0	110.5	Q220 S226 E227 V228 M463	Q220-V224 WeakPolarHBondContact O-CB 3.49Å; Q220-V224 WeakPolarHBondContact O-CG2 3.48Å; Q220-V224 PolarHBondContact O-N 3.41Å; V224-S226 VanDerWaalsContact C-N 3.34Å; V224-S226 PolarHBondContact O-N 3.23Å; V224-E227 PolarHBondContact O-N 3.43Å; V224-V228 HydrophobicContact CG1-CG2 4.38Å; V224-V228 WeakPolarHBondContact O-CG2 3.28Å; V224-V228 PolarHBondContact O-N 3.36Å; V224-M463 HydrophobicContact CB-CG 4.18Å; V224-M463 HydrophobicContact CB-SD 4.3Å; V224-M463 HydrophobicContact CG1-CB 4.13Å; V224-M463 HydrophobicContact CG1-CG 4.21Å; V224-M463 HydrophobicContact CG2-CG 4.45Å; V224-M463 HydrophobicContact CG2-SD 3.96Å
225	S	98.3	Very high	97.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-56.7	-47.6	175.4	-61.7	0	0	0	0	111.6	F95 G221 V223 E227 V228 I229 L288	F95-S225 VanDerWaalsContact CE1-CB 3.42Å; G221-S225 VanDerWaalsContact O-CB 3.29Å; G221-S225 WeakPolarHBondContact O-CB 3.39Å; G221-S225 PolarHBondContact O-N 3.48Å; G221-S225 PolarHBondContact O-OG 2.94Å; V223-S225 VanDerWaalsContact C-N 3.32Å; V223-S225 PolarHBondContact O-N 3.13Å; S225-E227 PolarHBondContact O-N 2.92Å; S225-V228 PolarHBondContact O-N 2.88Å; S225-I229 WeakPolarHBondContact O-CD1 3.26Å; S225-I229 VanDerWaalsContact O-CG1 3.23Å; S225-I229 WeakPolarHBondContact O-CG1 3.48Å; S225-I229 PolarHBondContact O-N 3.18Å; S225-L288 WeakPolarHBondContact OG-CD2 3.42Å
226	S	98.4	Very high	97.1	Very high	5 Å²	5	32.1 Å²	32.1	4%	0.035	17%	0.168	C	C	.	.	H	α-helix	trans	-59.2	-46.2	177.6	-166.7	0	0	0	0	112.3	Q92 N96 L222 V223 V224 I229 K230	Q92-S226 WeakPolarHBondContact CG-O 3.41Å; N96-S226 PolarHBondContact OD1-OG 3.5Å; L222-S226 PolarHBondContact O-N 3.44Å; L222-S226 VanDerWaalsContact O-N 3.11Å; V223-S226 WeakPolarHBondContact O-CB 3.37Å; V223-S226 PolarHBondContact O-N 3.14Å; V224-S226 VanDerWaalsContact C-N 3.34Å; V224-S226 PolarHBondContact O-N 3.23Å; S226-I229 PolarHBondContact O-N 2.86Å; S226-K230 PolarHBondContact O-N 3.37Å; S226-K230 VanDerWaalsContact O-N 3.07Å
227	E	98.1	Very high	97.1	Very high	72 Å²	72	32.4 Å²	32.4	34%	0.336	17%	0.17	S	C	.	.	H	α-helix	trans	-69.5	-35.1	178.6	-76.8	-62.2	141.3	0	0	113.2	V223 V224 S225 K230 K231	V223-E227 PolarHBondContact O-N 3.36Å; V224-E227 PolarHBondContact O-N 3.43Å; S225-E227 PolarHBondContact O-N 2.92Å; E227-K230 WeakPolarHBondContact O-CB 3.43Å; E227-K230 PolarHBondContact O-N 3.02Å; E227-K230 IonicContact OE1-NZ 3.62Å; E227-K230 PolarHBondContact OE1-NZ 3.18Å; E227-K230 IonicContact OE2-NZ 2.69Å; E227-K230 PolarHBondContact OE2-NZ 2.95Å; E227-K231 WeakPolarHBondContact O-CG 3.34Å; E227-K231 PolarHBondContact O-N 2.97Å
228	V	98.4	Very high	97	Very high	2 Å²	2	34 Å²	34	1%	0.012	18%	0.184	C	C	.	.	H	α-helix	trans	-62.4	-47.8	173	164.2	0	0	0	0	110.5	V224 S225 K230 K231 V232 L281 Q456 E459 L460	V224-V228 HydrophobicContact CG1-CG2 4.38Å; V224-V228 WeakPolarHBondContact O-CG2 3.28Å; V224-V228 PolarHBondContact O-N 3.36Å; S225-V228 PolarHBondContact O-N 2.88Å; V228-K230 VanDerWaalsContact C-N 3.29Å; V228-K230 PolarHBondContact O-N 3.03Å; V228-K231 PolarHBondContact O-N 3.12Å; V228-V232 HydrophobicContact CG1-CG2 4.07Å; V228-V232 WeakPolarHBondContact O-CB 3.37Å; V228-V232 VanDerWaalsContact O-CG2 3.25Å; V228-V232 WeakPolarHBondContact O-CG2 3.42Å; V228-V232 PolarHBondContact O-N 2.7Å; V228-L281 HydrophobicContact CG1-CD2 3.85Å; V228-Q456 HydrophobicContact CG1-CB 3.89Å; V228-Q456 HydrophobicContact CG1-CG 4.41Å; V228-Q456 HydrophobicContact CG2-CB 4.29Å; V228-E459 HydrophobicContact CG2-CB 4.25Å; V228-L460 HydrophobicContact CB-CD2 3.98Å; V228-L460 HydrophobicContact CB-CG 4.49Å; V228-L460 HydrophobicContact CG1-CD1 4.05Å; V228-L460 HydrophobicContact CG1-CD2 3.95Å; V228-L460 HydrophobicContact CG1-CG 4.04Å; V228-L460 HydrophobicContact CG2-CD2 3.77Å; V228-L460 HydrophobicContact CG2-CG 4.13Å
229	I	98.4	Very high	96.8	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-55.1	-48.9	176.8	-65.8	156.6	0	0	0	110.2	G88 L91 Q92 F95 S225 S226 K231 V232 S233 W285 W394	G88-I229 VanDerWaalsContact O-CG2 3.31Å; G88-I229 WeakPolarHBondContact O-CG2 3.41Å; L91-I229 HydrophobicContact CB-CD1 4.31Å; L91-I229 HydrophobicContact CB-CG2 4.37Å; L91-I229 HydrophobicContact CD2-CD1 3.34Å; L91-I229 HydrophobicContact CD2-CG1 3.72Å; L91-I229 HydrophobicContact CD2-CG2 4.15Å; L91-I229 HydrophobicContact CG-CD1 3.54Å; L91-I229 HydrophobicContact CG-CG1 4.39Å; Q92-I229 HydrophobicContact CG-CB 4.06Å; Q92-I229 HydrophobicContact CG-CG2 3.91Å; F95-I229 HydrophobicContact CD2-CD1 3.65Å; F95-I229 HydrophobicContact CE2-CD1 3.74Å; S225-I229 WeakPolarHBondContact O-CD1 3.26Å; S225-I229 VanDerWaalsContact O-CG1 3.23Å; S225-I229 WeakPolarHBondContact O-CG1 3.48Å; S225-I229 PolarHBondContact O-N 3.18Å; S226-I229 PolarHBondContact O-N 2.86Å; I229-K231 PolarHBondContact O-N 2.99Å; I229-V232 PolarHBondContact O-N 3Å; I229-S233 WeakPolarHBondContact O-CB 3.37Å; I229-S233 PolarHBondContact O-N 3.19Å; I229-S233 PolarHBondContact O-OG 3.44Å; I229-W285 HydrophobicContact CD1-CH2 3.72Å; I229-W285 HydrophobicContact CD1-CZ2 4.48Å; I229-W285 HydrophobicContact CD1-CZ3 4.41Å; I229-W285 HydrophobicContact CG1-CH2 4.02Å; I229-W285 HydrophobicContact CG1-CZ3 4.3Å; I229-W394 HydrophobicContact CG1-CZ2 4.37Å
230	K	97.6	Very high	96.7	Very high	72 Å²	72	43 Å²	43	31%	0.313	23%	0.225	S	C	.	.	H	α-helix	trans	-56.1	-48.8	178.8	-176.2	175.4	154.9	-153.5	0	112.8	S226 E227 V228 Q234	S226-K230 PolarHBondContact O-N 3.37Å; S226-K230 VanDerWaalsContact O-N 3.07Å; E227-K230 WeakPolarHBondContact O-CB 3.43Å; E227-K230 PolarHBondContact O-N 3.02Å; E227-K230 IonicContact OE1-NZ 3.62Å; E227-K230 PolarHBondContact OE1-NZ 3.18Å; E227-K230 IonicContact OE2-NZ 2.69Å; E227-K230 PolarHBondContact OE2-NZ 2.95Å; V228-K230 VanDerWaalsContact C-N 3.29Å; V228-K230 PolarHBondContact O-N 3.03Å; K230-Q234 VanDerWaalsContact O-CG 3.24Å; K230-Q234 WeakPolarHBondContact O-CG 3.38Å; K230-Q234 PolarHBondContact O-N 2.73Å
231	K	97.8	Very high	96.7	Very high	96 Å²	96	40.8 Å²	40.8	42%	0.417	22%	0.215	S	C	.	.	H	α-helix	trans	-67.3	-42	-178.5	-72.2	169.9	-178.8	174	0	111.5	E227 V228 I229 Q234 Q456	E227-K231 WeakPolarHBondContact O-CG 3.34Å; E227-K231 PolarHBondContact O-N 2.97Å; V228-K231 PolarHBondContact O-N 3.12Å; I229-K231 PolarHBondContact O-N 2.99Å; K231-Q234 PolarHBondContact O-N 2.99Å; K231-Q456 HydrophobicContact CB-CG 4.31Å
232	V	97.9	Very high	96.7	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.006	22%	0.224	C	C	.	.	H	α-helix	trans	-68.1	-43.2	179.9	173.4	0	0	0	0	111.5	V228 I229 Q234 V235 Q278 L281 W394 I453 Q456	V228-V232 HydrophobicContact CG1-CG2 4.07Å; V228-V232 WeakPolarHBondContact O-CB 3.37Å; V228-V232 VanDerWaalsContact O-CG2 3.25Å; V228-V232 WeakPolarHBondContact O-CG2 3.42Å; V228-V232 PolarHBondContact O-N 2.7Å; I229-V232 PolarHBondContact O-N 3Å; V232-Q234 PolarHBondContact O-N 3.08Å; V232-Q234 VanDerWaalsContact O-N 3.16Å; V232-V235 WeakPolarHBondContact O-CB 3.18Å; V232-V235 PolarHBondContact O-N 3Å; V232-V235 VanDerWaalsContact O-N 3.16Å; V232-Q278 HydrophobicContact CG1-CB 4.28Å; V232-Q278 HydrophobicContact CG1-CG 3.62Å; V232-L281 HydrophobicContact CG1-CD1 4.15Å; V232-L281 HydrophobicContact CG2-CD1 4.17Å; V232-L281 HydrophobicContact CG2-CD2 3.8Å; V232-W394 HydrophobicContact CB-CH2 3.66Å; V232-W394 HydrophobicContact CB-CZ2 4.33Å; V232-W394 HydrophobicContact CB-CZ3 4.29Å; V232-W394 HydrophobicContact CG1-CE3 4.37Å; V232-W394 HydrophobicContact CG1-CH2 3.3Å; V232-W394 HydrophobicContact CG1-CZ2 4.15Å; V232-W394 HydrophobicContact CG1-CZ3 3.43Å; V232-W394 VanDerWaalsContact CG1-CZ3 3.43Å; V232-W394 HydrophobicContact CG2-CH2 4.36Å; V232-I453 HydrophobicContact CB-CD1 4.18Å; V232-I453 HydrophobicContact CG1-CD1 3.68Å; V232-I453 HydrophobicContact CG2-CD1 3.95Å; V232-Q456 HydrophobicContact CG2-CB 4.01Å; V232-Q456 HydrophobicContact CG2-CG 3.81Å
233	S	96.4	Very high	96.6	Very high	7 Å²	7	46 Å²	46	5%	0.049	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-10.5	178.3	-60.1	0	0	0	0	114.1	R85 I229	R85-S233 VanDerWaalsContact CG-O 3.3Å; R85-S233 WeakPolarHBondContact CG-O 3.28Å; I229-S233 WeakPolarHBondContact O-CB 3.37Å; I229-S233 PolarHBondContact O-N 3.19Å; I229-S233 PolarHBondContact O-OG 3.44Å
234	Q	94.8	Very high	96.6	Very high	124 Å²	124	43.3 Å²	43.3	58%	0.579	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-1.4	176.4	-71.9	175.5	1.9	0	0	113.4	K230 K231 V232 S236	K230-Q234 VanDerWaalsContact O-CG 3.24Å; K230-Q234 WeakPolarHBondContact O-CG 3.38Å; K230-Q234 PolarHBondContact O-N 2.73Å; K231-Q234 PolarHBondContact O-N 2.99Å; V232-Q234 PolarHBondContact O-N 3.08Å; V232-Q234 VanDerWaalsContact O-N 3.16Å; Q234-S236 PolarHBondContact O-N 2.71Å
235	V	95.3	Very high	96.6	Very high	19 Å²	19	41.4 Å²	41.4	12%	0.115	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-69	123.3	175.2	176.7	0	0	0	0	109	V232 I450 I453	V232-V235 WeakPolarHBondContact O-CB 3.18Å; V232-V235 PolarHBondContact O-N 3Å; V232-V235 VanDerWaalsContact O-N 3.16Å; V235-I450 HydrophobicContact CG1-CD1 3.96Å; V235-I450 HydrophobicContact CG1-CG2 4.17Å; V235-I453 HydrophobicContact CB-CD1 4.46Å; V235-I453 HydrophobicContact CG2-CD1 3.8Å; V235-I453 HydrophobicContact CG2-CG1 4.35Å
236	S	93.5	Very high	96.6	Very high	83 Å²	83	41.4 Å²	41.4	58%	0.58	21%	0.213	S	C	*	.	P	Polyproline II helix	trans	-64.9	147.7	177.5	54.5	0	0	0	0	111.5	E81 Q234	E81-S236 WeakPolarHBondContact OE1-CA 3.27Å; Q234-S236 PolarHBondContact O-N 2.71Å
237	L	94.4	Very high	96.6	Very high	21 Å²	21	43.7 Å²	43.7	11%	0.11	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-69	150	175.5	-61.2	175.3	0	0	0	111.6	A77 T80 E81 I84 C241 L245	A77-L237 HydrophobicContact CB-CD1 4.46Å; T80-L237 HydrophobicContact CG2-CD1 4.35Å; E81-L237 HydrophobicContact CG-CD1 3.74Å; E81-L237 HydrophobicContact CG-CG 3.74Å; E81-L237 PolarHBondContact OE1-N 3.1Å; I84-L237 HydrophobicContact CD1-CD2 4.26Å; L237-C241 HydrophobicContact CB-CB 4.38Å; L237-L245 HydrophobicContact CD1-CD1 3.61Å
238	A	93.8	Very high	96.6	Very high	44 Å²	44	40.3 Å²	40.3	36%	0.364	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-72.2	157.5	173.7	0	0	0	0	0	111.4	E240 C241 T242	A238-E240 VanDerWaalsContact C-N 3.27Å; A238-E240 PolarHBondContact O-N 3.11Å; A238-C241 WeakPolarHBondContact O-CB 3.5Å; A238-C241 PolarHBondContact O-N 3.22Å; A238-C241 VanDerWaalsContact O-N 3.09Å; A238-T242 PolarHBondContact O-N 3.07Å; A238-T242 PolarHBondContact O-OG1 3.45Å
239	E	94.3	Very high	96.4	Very high	123 Å²	123	41.9 Å²	41.9	58%	0.575	22%	0.216	S	C	*	.	H	α-helix	trans	-61.7	-37.4	-178.1	-168.7	-170.1	141.9	0	0	111.9	C241 T242 K243	E239-C241 VanDerWaalsContact C-N 3.3Å; E239-C241 PolarHBondContact O-N 2.83Å; E239-T242 WeakPolarHBondContact O-CB 3.46Å; E239-T242 PolarHBondContact O-N 3.09Å; E239-T242 VanDerWaalsContact O-N 3.17Å; E239-K243 WeakPolarHBondContact O-CG 3.13Å; E239-K243 PolarHBondContact O-N 2.69Å; E239-K243 WeakPolarHBondContact OE1-CE 3.33Å; E239-K243 IonicContact OE1-NZ 3.15Å; E239-K243 PolarHBondContact OE1-NZ 3.14Å
240	E	95.2	Very high	96.4	Very high	85 Å²	85	42.2 Å²	42.2	40%	0.397	22%	0.218	S	C	.	.	H	α-helix	trans	-64.1	-37.9	177.3	-60.3	77.8	-165.7	0	0	111	A238 K243 A244 V442 D443	A238-E240 VanDerWaalsContact C-N 3.27Å; A238-E240 PolarHBondContact O-N 3.11Å; E240-K243 PolarHBondContact O-N 3.22Å; E240-A244 WeakPolarHBondContact O-CB 3.35Å; E240-A244 PolarHBondContact O-N 3.45Å; E240-V442 HydrophobicContact CB-CG1 4.31Å; E240-D443 WeakPolarHBondContact CB-O 3.41Å; E240-D443 WeakPolarHBondContact CG-O 3.29Å
241	C	96.5	Very high	96.3	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.007	20%	0.203	C	C	.	.	H	α-helix	trans	-66.4	-42.4	172.3	172	0	0	0	0	111.4	L237 A238 E239 K243 A244 L245 C274	L237-C241 HydrophobicContact CB-CB 4.38Å; A238-C241 WeakPolarHBondContact O-CB 3.5Å; A238-C241 PolarHBondContact O-N 3.22Å; A238-C241 VanDerWaalsContact O-N 3.09Å; E239-C241 VanDerWaalsContact C-N 3.3Å; E239-C241 PolarHBondContact O-N 2.83Å; C241-K243 VanDerWaalsContact C-N 3.28Å; C241-K243 PolarHBondContact O-N 2.9Å; C241-A244 PolarHBondContact O-N 2.8Å; C241-A244 VanDerWaalsContact O-N 3.15Å; C241-L245 WeakPolarHBondContact O-CB 3.39Å; C241-L245 WeakPolarHBondContact O-CG 3.46Å; C241-L245 PolarHBondContact O-N 3.33Å; C241-C274 HydrophobicContact CB-CB 3.97Å; C241-C274 WeakPolarHBondContact CB-SG 3.48Å; C241-C274 WeakPolarHBondContact SG-CB 3.47Å; C241-C274 CovalentContact SG-SG 2.03Å; C241-C274 PolarHBondContact SG-SG 3.49Å
242	T	97.2	Very high	96.3	Very high	31 Å²	31	34.4 Å²	34.4	19%	0.19	18%	0.184	C	C	.	.	H	α-helix	trans	-57.6	-41.7	175.6	-58.1	0	0	0	0	111.8	A73 A77 A238 E239 M246	A73-T242 HydrophobicContact CB-CG2 3.95Å; A77-T242 HydrophobicContact CB-CG2 4.03Å; A238-T242 PolarHBondContact O-N 3.07Å; A238-T242 PolarHBondContact O-OG1 3.45Å; E239-T242 WeakPolarHBondContact O-CB 3.46Å; E239-T242 PolarHBondContact O-N 3.09Å; E239-T242 VanDerWaalsContact O-N 3.17Å; T242-M246 PolarHBondContact O-N 2.88Å
243	K	97	Very high	96.1	Very high	77 Å²	77	36 Å²	36	34%	0.335	19%	0.191	S	C	.	.	H	α-helix	trans	-64	-44.5	174.7	-67.1	169.8	-175.4	159.8	0	111.9	M56 E239 E240 C241 M246 K247	M56-K243 HydrophobicContact CE-CG 3.96Å; M56-K243 HydrophobicContact CG-CB 4.26Å; M56-K243 HydrophobicContact CG-CG 4Å; M56-K243 HydrophobicContact SD-CB 4.26Å; M56-K243 HydrophobicContact SD-CG 3.92Å; E239-K243 WeakPolarHBondContact O-CG 3.13Å; E239-K243 PolarHBondContact O-N 2.69Å; E239-K243 WeakPolarHBondContact OE1-CE 3.33Å; E239-K243 IonicContact OE1-NZ 3.15Å; E239-K243 PolarHBondContact OE1-NZ 3.14Å; E240-K243 PolarHBondContact O-N 3.22Å; C241-K243 VanDerWaalsContact C-N 3.28Å; C241-K243 PolarHBondContact O-N 2.9Å; K243-M246 WeakPolarHBondContact O-CB 3.35Å; K243-M246 PolarHBondContact O-N 3.34Å; K243-K247 PolarHBondContact O-N 3.25Å; K243-K247 VanDerWaalsContact O-N 3.08Å
244	A	98.1	Very high	96.1	Very high	6 Å²	6	35.7 Å²	35.7	5%	0.05	19%	0.189	C	C	.	.	H	α-helix	trans	-65.6	-39.2	179	0	0	0	0	0	112.6	E240 C241 K247 L248 V270 E441 V442	E240-A244 WeakPolarHBondContact O-CB 3.35Å; E240-A244 PolarHBondContact O-N 3.45Å; C241-A244 PolarHBondContact O-N 2.8Å; C241-A244 VanDerWaalsContact O-N 3.15Å; A244-K247 PolarHBondContact O-N 3.5Å; A244-L248 WeakPolarHBondContact O-CB 3.48Å; A244-L248 PolarHBondContact O-N 3.4Å; A244-V270 HydrophobicContact CB-CG1 3.96Å; A244-E441 WeakPolarHBondContact CB-O 3.29Å; A244-V442 HydrophobicContact CB-CG2 3.77Å
245	L	97.9	Very high	96	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66.6	-40.6	175.7	-72.2	172.6	0	0	0	112.1	T80 L237 C241 K247 L248 V249 V270 M271	T80-L245 HydrophobicContact CG2-CD1 4.03Å; T80-L245 HydrophobicContact CG2-CD2 4.22Å; L237-L245 HydrophobicContact CD1-CD1 3.61Å; C241-L245 WeakPolarHBondContact O-CB 3.39Å; C241-L245 WeakPolarHBondContact O-CG 3.46Å; C241-L245 PolarHBondContact O-N 3.33Å; L245-K247 VanDerWaalsContact C-N 3.29Å; L245-K247 PolarHBondContact O-N 3.36Å; L245-L248 HydrophobicContact CD2-CD2 4.38Å; L245-L248 PolarHBondContact O-N 3.23Å; L245-V249 WeakPolarHBondContact O-CB 3.25Å; L245-V249 WeakPolarHBondContact O-CG2 3.42Å; L245-V249 PolarHBondContact O-N 3.17Å; L245-V270 HydrophobicContact CD2-CG1 3.95Å; L245-V270 HydrophobicContact CG-CG1 4.41Å; L245-M271 HydrophobicContact CD2-CE 3.83Å; L245-M271 HydrophobicContact CD2-SD 4.16Å
246	M	97.4	Very high	95.9	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-56.1	-47.2	171.6	177.1	58	-162.1	0	0	111	M56 E69 L72 A73 S76 T242 K243 L248 Y250 C251	M56-M246 HydrophobicContact CB-CB 4.45Å; M56-M246 HydrophobicContact CB-CG 4.1Å; M56-M246 HydrophobicContact SD-CB 3.85Å; M56-M246 HydrophobicContact SD-CG 3.83Å; E69-M246 HydrophobicContact CG-CE 4.19Å; E69-M246 HydrophobicContact CG-CG 4.28Å; L72-M246 HydrophobicContact CB-CE 3.74Å; L72-M246 HydrophobicContact CB-SD 3.47Å; L72-M246 WeakPolarHBondContact CB-SD 3.4Å; L72-M246 HydrophobicContact CD1-CE 4.07Å; A73-M246 HydrophobicContact CB-CB 3.77Å; A73-M246 HydrophobicContact CB-CG 3.99Å; A73-M246 HydrophobicContact CB-SD 4.24Å; A73-M246 PolarHBondContact N-SD 2.85Å; A73-M246 VanDerWaalsContact N-SD 3.45Å; S76-M246 PolarHBondContact OG-N 3.3Å; T242-M246 PolarHBondContact O-N 2.88Å; K243-M246 WeakPolarHBondContact O-CB 3.35Å; K243-M246 PolarHBondContact O-N 3.34Å; M246-L248 PolarHBondContact O-N 3.44Å; M246-Y250 PolarHBondContact O-N 3.08Å; M246-Y250 HydrophobicContact SD-CD2 4.38Å; M246-C251 PolarHBondContact O-N 3.5Å; M246-C251 PolarHBondContact O-SG 3.42Å
247	K	98.1	Very high	95.8	Very high	53 Å²	53	33 Å²	33	23%	0.23	18%	0.18	C	C	.	.	H	α-helix	trans	-63.6	-39	178	-165.6	-175.9	170.1	-162.5	0	113.2	K243 A244 L245 C251 Y266 W416 G418 E441	K243-K247 PolarHBondContact O-N 3.25Å; K243-K247 VanDerWaalsContact O-N 3.08Å; A244-K247 PolarHBondContact O-N 3.5Å; L245-K247 VanDerWaalsContact C-N 3.29Å; L245-K247 PolarHBondContact O-N 3.36Å; K247-C251 WeakPolarHBondContact CA-SG 3.39Å; K247-Y266 WeakPolarHBondContact CG-OH 3.17Å; K247-W416 PolarHBondContact O-NE1 3.34Å; K247-G418 WeakPolarHBondContact CE-O 3.28Å; K247-E441 IonicContact NZ-OE2 3.06Å
248	L	97.4	Very high	95.6	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-68	-48.2	178.9	-179.4	68.1	0	0	0	112.1	A244 L245 M246 P262 Y266 C267 V270 M271	A244-L248 WeakPolarHBondContact O-CB 3.48Å; A244-L248 PolarHBondContact O-N 3.4Å; L245-L248 HydrophobicContact CD2-CD2 4.38Å; L245-L248 PolarHBondContact O-N 3.23Å; M246-L248 PolarHBondContact O-N 3.44Å; L248-P262 HydrophobicContact CD1-CB 3.49Å; L248-P262 VanDerWaalsContact CD1-CB 3.49Å; L248-P262 HydrophobicContact CD1-CG 4.1Å; L248-P262 HydrophobicContact CG-CB 4.31Å; L248-P262 HydrophobicContact CG-CG 4.49Å; L248-Y266 HydrophobicContact CB-CE1 4.47Å; L248-Y266 HydrophobicContact CD1-CD1 3.57Å; L248-Y266 HydrophobicContact CD1-CE1 3.54Å; L248-Y266 HydrophobicContact CD1-CE2 4.47Å; L248-Y266 HydrophobicContact CD1-CG 4.12Å; L248-C267 HydrophobicContact CD1-CB 4.14Å; L248-C267 HydrophobicContact CD2-CB 4.42Å; L248-V270 HydrophobicContact CB-CG1 4.43Å; L248-V270 HydrophobicContact CB-CG2 4.38Å; L248-V270 HydrophobicContact CD1-CG2 4.34Å; L248-V270 HydrophobicContact CD2-CB 4.07Å; L248-V270 HydrophobicContact CD2-CG1 3.92Å; L248-V270 HydrophobicContact CD2-CG2 4.44Å; L248-M271 HydrophobicContact CD2-CE 4.19Å
249	V	95.6	Very high	95.4	Very high	36 Å²	36	37.3 Å²	37.3	22%	0.218	21%	0.213	C	C	.	.	H	α-helix	trans	-99.2	-47.9	-165.2	-176.2	0	0	0	0	112.5	L245	L245-V249 WeakPolarHBondContact O-CB 3.25Å; L245-V249 WeakPolarHBondContact O-CG2 3.42Å; L245-V249 PolarHBondContact O-N 3.17Å
250	Y	97.2	Very high	95.3	Very high	7 Å²	7	32.1 Å²	32.1	3%	0.027	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.1	-17	-165.3	-68.3	-45.5	0	0	0	115.5	F33 K37 L72 L75 E79 M246 P252 H253 C254	F33-Y250 HydrophobicContact CE1-CD1 4.19Å; F33-Y250 HydrophobicContact CE1-CE1 4.32Å; F33-Y250 HydrophobicContact CE2-CE1 4.25Å; F33-Y250 AromaticContact CZ-CD1 3.7Å; F33-Y250 HydrophobicContact CZ-CD1 3.7Å; F33-Y250 AromaticContact CZ-CE1 3.44Å; F33-Y250 HydrophobicContact CZ-CE1 3.44Å; F33-Y250 VanDerWaalsContact CZ-CE1 3.44Å; K37-Y250 WeakPolarHBondContact CE-OH 3.29Å; K37-Y250 PolarHBondContact NZ-OH 3.24Å; K37-Y250 VanDerWaalsContact NZ-OH 3.16Å; L72-Y250 HydrophobicContact CB-CD2 3.96Å; L72-Y250 HydrophobicContact CB-CG 4.25Å; L72-Y250 HydrophobicContact CD2-CD2 4.26Å; L72-Y250 HydrophobicContact CD2-CG 4.27Å; L72-Y250 VanDerWaalsContact O-CD2 3.31Å; L72-Y250 WeakPolarHBondContact O-CD2 3.46Å; L75-Y250 HydrophobicContact CB-CE2 4.31Å; L75-Y250 HydrophobicContact CD2-CE2 4Å; L75-Y250 HydrophobicContact CG-CE2 4.05Å; E79-Y250 VanDerWaalsContact CD-OH 3.22Å; E79-Y250 PolarHBondContact OE1-OH 2.55Å; E79-Y250 PolarHBondContact OE2-OH 3.4Å; M246-Y250 PolarHBondContact O-N 3.08Å; M246-Y250 HydrophobicContact SD-CD2 4.38Å; Y250-P252 VanDerWaalsContact C-N 3.33Å; Y250-H253 AromaticContact CD1-CD2 3.91Å; Y250-H253 WeakPolarHBondContact O-CB 3.27Å; Y250-H253 PolarHBondContact O-N 3.36Å; Y250-C254 PolarHBondContact O-N 2.62Å
251	C	97.4	Very high	95.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.9	-29.8	171.3	-67.8	0	0	0	0	115.4	C57 M246 K247 H253 C254 R255 W416	C57-C251 WeakPolarHBondContact CA-SG 3.39Å; C57-C251 HydrophobicContact CB-CB 3.85Å; C57-C251 WeakPolarHBondContact CB-SG 3.33Å; C57-C251 WeakPolarHBondContact SG-CA 3.25Å; C57-C251 WeakPolarHBondContact SG-CB 3.46Å; C57-C251 CovalentContact SG-SG 2.03Å; C57-C251 PolarHBondContact SG-SG 2.85Å; M246-C251 PolarHBondContact O-N 3.5Å; M246-C251 PolarHBondContact O-SG 3.42Å; K247-C251 WeakPolarHBondContact CA-SG 3.39Å; C251-H253 VanDerWaalsContact C-N 3.3Å; C251-H253 PolarHBondContact O-N 2.85Å; C251-C254 PolarHBondContact O-N 3.48Å; C251-R255 WeakPolarHBondContact O-CG 3.11Å; C251-R255 PolarHBondContact O-N 2.87Å; C251-W416 HydrophobicContact CB-CZ2 3.99Å
252	P	95.7	Very high	95.2	Very high	4 Å²	4	33.1 Å²	33.1	3%	0.026	20%	0.195	C	C	.	.	H	α-helix	trans	-57.2	-42.3	168.2	-25.3	34	0	0	0	112.6	Y250 C254 R255 G256 L257 W416	Y250-P252 VanDerWaalsContact C-N 3.33Å; P252-C254 VanDerWaalsContact C-N 3.35Å; P252-C254 PolarHBondContact O-N 2.86Å; P252-R255 CarbonylContact O-C 3.51Å; P252-R255 PolarHBondContact O-N 3.14Å; P252-R255 VanDerWaalsContact O-N 3.12Å; P252-G256 PolarHBondContact O-N 3.1Å; P252-L257 HydrophobicContact CB-CB 4.18Å; P252-L257 WeakPolarHBondContact CB-O 3.23Å; P252-L257 CarbonylContact O-C 3.59Å; P252-L257 WeakPolarHBondContact O-CA 3.33Å; P252-L257 PolarHBondContact O-N 3.46Å; P252-W416 HydrophobicContact CG-CB 4.3Å; P252-W416 HydrophobicContact CG-CD2 3.67Å; P252-W416 HydrophobicContact CG-CE3 4.27Å; P252-W416 HydrophobicContact CG-CG 3.65Å; P252-W416 HydrophobicContact CG-CZ2 4.38Å
253	H	95.4	Very high	95.2	Very high	35 Å²	35	31.8 Å²	31.8	16%	0.162	19%	0.187	C	C	.	.	H	α-helix	trans	-62.9	-42.9	177.7	-66.4	-101.6	0	0	0	111.3	L30 F33 Y250 C251 R255 G256 A258	L30-H253 HydrophobicContact CD1-CB 3.73Å; F33-H253 AromaticContact CD1-ND1 3.87Å; F33-H253 AromaticContact CD2-CE1 3.77Å; F33-H253 AromaticContact CD2-ND1 3.77Å; F33-H253 HydrophobicContact CE1-CB 4.46Å; F33-H253 AromaticContact CE1-ND1 3.96Å; F33-H253 AromaticContact CE2-CE1 3.62Å; F33-H253 AromaticContact CE2-ND1 3.86Å; F33-H253 AromaticContact CG-ND1 3.77Å; F33-H253 AromaticContact CZ-CE1 3.99Å; F33-H253 AromaticContact CZ-ND1 3.98Å; Y250-H253 AromaticContact CD1-CD2 3.91Å; Y250-H253 WeakPolarHBondContact O-CB 3.27Å; Y250-H253 PolarHBondContact O-N 3.36Å; C251-H253 VanDerWaalsContact C-N 3.3Å; C251-H253 PolarHBondContact O-N 2.85Å; H253-R255 PolarHBondContact O-N 3.41Å; H253-R255 VanDerWaalsContact O-N 3.11Å; H253-G256 PolarHBondContact O-N 2.91Å; H253-A258 WeakPolarHBondContact ND1-CB 3.47Å
254	C	95.7	Very high	95	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.4	-18.9	176.6	-67.6	0	0	0	0	114.1	T62 C63 C64 Y250 C251 P252	T62-C254 VanDerWaalsContact CA-O 3.3Å; T62-C254 WeakPolarHBondContact CA-O 3.49Å; T62-C254 PolarHBondContact OG1-O 3.39Å; C63-C254 PolarHBondContact N-O 3.49Å; C64-C254 HydrophobicContact CB-CB 3.65Å; C64-C254 WeakPolarHBondContact CB-SG 3.43Å; C64-C254 WeakPolarHBondContact SG-CA 3.31Å; C64-C254 WeakPolarHBondContact SG-CB 3.47Å; C64-C254 CovalentContact SG-SG 2.03Å; C64-C254 PolarHBondContact SG-SG 2.91Å; Y250-C254 PolarHBondContact O-N 2.62Å; C251-C254 PolarHBondContact O-N 3.48Å; P252-C254 VanDerWaalsContact C-N 3.35Å; P252-C254 PolarHBondContact O-N 2.86Å
255	R	93.8	Very high	94.9	Very high	62 Å²	62	32.5 Å²	32.5	23%	0.234	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	12.1	-178.6	-62.7	-177.1	68.8	91.4	2.8	113.6	P58 Q59 C251 P252 H253 L257	P58-R255 PolarHBondContact O-NH1 2.76Å; Q59-R255 PolarHBondContact O-NH1 3.14Å; C251-R255 WeakPolarHBondContact O-CG 3.11Å; C251-R255 PolarHBondContact O-N 2.87Å; P252-R255 CarbonylContact O-C 3.51Å; P252-R255 PolarHBondContact O-N 3.14Å; P252-R255 VanDerWaalsContact O-N 3.12Å; H253-R255 PolarHBondContact O-N 3.41Å; H253-R255 VanDerWaalsContact O-N 3.11Å; R255-L257 VanDerWaalsContact C-N 3.29Å; R255-L257 PolarHBondContact O-N 3.11Å
256	G	91.3	Very high	94.8	Very high	59 Å²	59	32.5 Å²	32.5	61%	0.608	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.9	20.7	-178.7	0	0	0	0	0	114.4	P252 H253	P252-G256 PolarHBondContact O-N 3.1Å; H253-G256 PolarHBondContact O-N 2.91Å
257	L	92.4	Very high	94.8	Very high	47 Å²	47	32.5 Å²	32.5	25%	0.246	20%	0.197	C	C	.	.			trans	-110.6	32.1	-179.7	-62.5	176	0	0	0	112.1	P252 R255 S259 V260 W416	P252-L257 HydrophobicContact CB-CB 4.18Å; P252-L257 WeakPolarHBondContact CB-O 3.23Å; P252-L257 CarbonylContact O-C 3.59Å; P252-L257 WeakPolarHBondContact O-CA 3.33Å; P252-L257 PolarHBondContact O-N 3.46Å; R255-L257 VanDerWaalsContact C-N 3.29Å; R255-L257 PolarHBondContact O-N 3.11Å; L257-S259 PolarHBondContact O-N 3.1Å; L257-V260 HydrophobicContact CB-CB 4.41Å; L257-V260 HydrophobicContact CB-CG2 4.03Å; L257-V260 HydrophobicContact CD2-CG2 4.33Å; L257-V260 WeakPolarHBondContact O-CB 3.31Å; L257-V260 PolarHBondContact O-N 2.68Å; L257-W416 HydrophobicContact CD1-CE3 4.35Å; L257-W416 HydrophobicContact CD1-CZ3 4.17Å
258	A	89.4	Confident	94.8	Very high	48 Å²	48	30.6 Å²	30.6	40%	0.397	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-24.3	-173.2	0	0	0	0	0	115.1	H253	H253-A258 WeakPolarHBondContact ND1-CB 3.47Å
259	S	89.9	Confident	94.8	Very high	109 Å²	109	30.5 Å²	30.5	76%	0.762	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-6.9	178.3	57.3	0	0	0	0	114.1	L257	L257-S259 PolarHBondContact O-N 3.1Å
260	V	92.8	Very high	94.9	Very high	14 Å²	14	28.8 Å²	28.8	9%	0.085	18%	0.179	C	C	.	.			trans	-90.6	113.5	-176	-174.2	0	0	0	0	109.9	L257 W416 K421	L257-V260 HydrophobicContact CB-CB 4.41Å; L257-V260 HydrophobicContact CB-CG2 4.03Å; L257-V260 HydrophobicContact CD2-CG2 4.33Å; L257-V260 WeakPolarHBondContact O-CB 3.31Å; L257-V260 PolarHBondContact O-N 2.68Å; V260-W416 HydrophobicContact CG1-CB 3.89Å; V260-K421 HydrophobicContact CG1-CB 4.27Å; V260-K421 HydrophobicContact CG1-CD 4.32Å; V260-K421 HydrophobicContact CG1-CG 3.94Å; V260-K421 HydrophobicContact CG2-CD 3.95Å; V260-K421 HydrophobicContact CG2-CG 4.37Å
261	Q	94.3	Very high	94.9	Very high	96 Å²	96	28.6 Å²	28.6	45%	0.449	18%	0.178	S	C	.	.	P	Polyproline II helix	trans	-74.5	147.7	175.9	-61.8	-59.6	-38.1	0	0	111.7	L405 A407 C415 W416	Q261-L405 PolarHBondContact OE1-O 3.25Å; Q261-L405 VanDerWaalsContact OE1-O 3.05Å; Q261-A407 HydrophobicContact CB-CB 3.89Å; Q261-C415 CarbonylContact O-C 3.57Å; Q261-C415 WeakPolarHBondContact O-CA 3.35Å; Q261-C415 WeakPolarHBondContact O-CB 3.38Å; Q261-W416 PolarHBondContact O-N 3.35Å
262	P	96.1	Very high	94.9	Very high	11 Å²	11	29.8 Å²	29.8	7%	0.071	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-63.2	148.1	175.1	25.4	-33.9	0	0	0	112.8	L248 Y266 L405 A406 A407 W416	L248-P262 HydrophobicContact CD1-CB 3.49Å; L248-P262 VanDerWaalsContact CD1-CB 3.49Å; L248-P262 HydrophobicContact CD1-CG 4.1Å; L248-P262 HydrophobicContact CG-CB 4.31Å; L248-P262 HydrophobicContact CG-CG 4.49Å; P262-Y266 HydrophobicContact CB-CD1 4.29Å; P262-L405 WeakPolarHBondContact CD-O 3.33Å; P262-L405 VanDerWaalsContact CG-O 3.26Å; P262-L405 WeakPolarHBondContact CG-O 3.5Å; P262-A406 CarbonylContact O-C 2.9Å; P262-A406 WeakPolarHBondContact O-CA 3.36Å; P262-A407 PolarHBondContact O-N 3.49Å; P262-W416 CarbonylContact C-O 3.56Å; P262-W416 WeakPolarHBondContact CA-O 3.21Å
263	C	95.9	Very high	95	Very high	3 Å²	3	29.7 Å²	29.7	2%	0.02	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-64.5	143.3	173.9	-57.3	0	0	0	0	111.1	N265 Y266 C267 C415 W416	C263-N265 PolarHBondContact O-N 2.93Å; C263-Y266 WeakPolarHBondContact O-CB 3.46Å; C263-Y266 PolarHBondContact O-N 3.29Å; C263-Y266 VanDerWaalsContact O-N 3.1Å; C263-C267 PolarHBondContact O-N 3.16Å; C263-C415 WeakPolarHBondContact CA-SG 3.34Å; C263-C415 HydrophobicContact CB-CB 3.95Å; C263-C415 WeakPolarHBondContact CB-SG 3.38Å; C263-C415 VanDerWaalsContact SG-C 3.58Å; C263-C415 WeakPolarHBondContact SG-CB 3.33Å; C263-C415 CovalentContact SG-SG 2.03Å; C263-C415 PolarHBondContact SG-SG 3.22Å; C263-W416 PolarHBondContact N-O 2.93Å; C263-W416 PolarHBondContact SG-O 3.01Å
264	S	94.3	Very high	95.1	Very high	40 Å²	40	28.6 Å²	28.6	28%	0.28	18%	0.18	S	C	.	.	H	α-helix	trans	-57.8	-46.9	-178	178.9	0	0	0	0	113.7	Y266 C267 S268	S264-Y266 VanDerWaalsContact C-N 3.31Å; S264-Y266 PolarHBondContact O-N 3.39Å; S264-C267 PolarHBondContact O-N 2.79Å; S264-S268 WeakPolarHBondContact O-CB 3.42Å; S264-S268 PolarHBondContact O-N 2.7Å; S264-S268 PolarHBondContact O-OG 2.91Å
265	N	94.8	Very high	95.2	Very high	57 Å²	57	28.8 Å²	28.8	31%	0.305	18%	0.18	S	C	.	.	H	α-helix	trans	-68.5	-31.4	177.3	-69	-0.2	0	0	0	112.4	C263 S268 N269 Y424 V428	C263-N265 PolarHBondContact O-N 2.93Å; N265-S268 PolarHBondContact O-N 3.16Å; N265-N269 PolarHBondContact O-N 3.16Å; N265-N269 PolarHBondContact O-ND2 3.23Å; N265-Y424 HydrophobicContact CB-CD1 3.65Å; N265-Y424 HydrophobicContact CB-CE1 3.98Å; N265-V428 HydrophobicContact CB-CG2 3.81Å
266	Y	97	Very high	95.4	Very high	1 Å²	1	25.8 Å²	25.8	0%	0.004	17%	0.169	C	C	.	.	H	α-helix	trans	-65.3	-52	174.7	178.1	-144.3	0	0	0	110.5	K247 L248 P262 C263 S264 S268 N269 V270 W416 G418 Y424 E441	K247-Y266 WeakPolarHBondContact CG-OH 3.17Å; L248-Y266 HydrophobicContact CB-CE1 4.47Å; L248-Y266 HydrophobicContact CD1-CD1 3.57Å; L248-Y266 HydrophobicContact CD1-CE1 3.54Å; L248-Y266 HydrophobicContact CD1-CE2 4.47Å; L248-Y266 HydrophobicContact CD1-CG 4.12Å; P262-Y266 HydrophobicContact CB-CD1 4.29Å; C263-Y266 WeakPolarHBondContact O-CB 3.46Å; C263-Y266 PolarHBondContact O-N 3.29Å; C263-Y266 VanDerWaalsContact O-N 3.1Å; S264-Y266 VanDerWaalsContact C-N 3.31Å; S264-Y266 PolarHBondContact O-N 3.39Å; Y266-S268 VanDerWaalsContact C-N 3.27Å; Y266-S268 PolarHBondContact O-N 2.9Å; Y266-N269 PolarHBondContact O-N 3.36Å; Y266-V270 HydrophobicContact CD2-CG2 4.06Å; Y266-V270 HydrophobicContact CE2-CG2 3.58Å; Y266-V270 WeakPolarHBondContact O-CG2 3.36Å; Y266-V270 PolarHBondContact O-N 3.38Å; Y266-V270 VanDerWaalsContact O-N 3.09Å; Y266-W416 WeakPolarHBondContact CD1-O 3.26Å; Y266-W416 AromaticContact CE1-CD1 3.71Å; Y266-W416 AromaticContact CE1-NE1 3.72Å; Y266-G418 VanDerWaalsContact CE1-CA 3.43Å; Y266-G418 VanDerWaalsContact CE1-N 3.26Å; Y266-Y424 HydrophobicContact CD2-CD2 4.13Å; Y266-Y424 AromaticContact CD2-CE2 3.62Å; Y266-Y424 HydrophobicContact CD2-CE2 3.62Å; Y266-Y424 AromaticContact CG-CD2 3.97Å; Y266-Y424 HydrophobicContact CG-CD2 3.97Å; Y266-Y424 AromaticContact CG-CE2 3.94Å; Y266-Y424 HydrophobicContact CG-CE2 3.94Å; Y266-E441 HydrophobicContact CD2-CG 3.7Å; Y266-E441 HydrophobicContact CE2-CB 4.2Å; Y266-E441 VanDerWaalsContact CE2-CD 3.42Å; Y266-E441 HydrophobicContact CE2-CG 3.62Å; Y266-E441 WeakPolarHBondContact CE2-OE2 3.49Å
267	C	97.4	Very high	95.6	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-55.6	-44.9	174.2	-178.1	0	0	0	0	111.4	L248 C263 S264 N269 V270 M271 C402 A406	L248-C267 HydrophobicContact CD1-CB 4.14Å; L248-C267 HydrophobicContact CD2-CB 4.42Å; C263-C267 PolarHBondContact O-N 3.16Å; S264-C267 PolarHBondContact O-N 2.79Å; C267-N269 PolarHBondContact O-N 3.35Å; C267-V270 PolarHBondContact O-N 3.35Å; C267-M271 WeakPolarHBondContact O-CB 3.46Å; C267-M271 WeakPolarHBondContact O-CG 3.34Å; C267-M271 PolarHBondContact O-N 3.43Å; C267-C402 HydrophobicContact CB-CB 3.91Å; C267-C402 WeakPolarHBondContact CB-SG 3.08Å; C267-C402 PolarHBondContact O-SG 2.95Å; C267-C402 VanDerWaalsContact O-SG 3.38Å; C267-C402 WeakPolarHBondContact SG-CA 3.03Å; C267-C402 WeakPolarHBondContact SG-CB 3.17Å; C267-C402 CovalentContact SG-SG 2.04Å; C267-C402 PolarHBondContact SG-SG 3.29Å; C267-A406 HydrophobicContact CB-CB 4.21Å
268	S	96.2	Very high	95.9	Very high	12 Å²	12	22.1 Å²	22.1	8%	0.084	14%	0.135	C	C	.	.	H	α-helix	trans	-59.7	-44.3	-179.9	-61.9	0	0	0	0	111.9	S264 N265 Y266 M271 K272	S264-S268 WeakPolarHBondContact O-CB 3.42Å; S264-S268 PolarHBondContact O-N 2.7Å; S264-S268 PolarHBondContact O-OG 2.91Å; N265-S268 PolarHBondContact O-N 3.16Å; Y266-S268 VanDerWaalsContact C-N 3.27Å; Y266-S268 PolarHBondContact O-N 2.9Å; S268-M271 PolarHBondContact O-N 3.42Å; S268-K272 VanDerWaalsContact O-CB 3.25Å; S268-K272 WeakPolarHBondContact O-CB 3.4Å; S268-K272 VanDerWaalsContact O-CG 3.27Å; S268-K272 WeakPolarHBondContact O-CG 3.28Å; S268-K272 PolarHBondContact O-N 3.23Å
269	N	97.6	Very high	96.3	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-66.4	-39.3	177.9	-78	-31.4	0	0	0	112.9	N265 Y266 C267 G273 Y424 G427 V428 M429 N439 E441	N265-N269 PolarHBondContact O-N 3.16Å; N265-N269 PolarHBondContact O-ND2 3.23Å; Y266-N269 PolarHBondContact O-N 3.36Å; C267-N269 PolarHBondContact O-N 3.35Å; N269-G273 PolarHBondContact O-N 3.4Å; N269-Y424 WeakPolarHBondContact ND2-CE1 3.2Å; N269-Y424 PolarHBondContact ND2-OH 2.91Å; N269-G427 PolarHBondContact ND2-O 3.3Å; N269-V428 WeakPolarHBondContact OD1-CA 3.44Å; N269-M429 WeakPolarHBondContact OD1-CG 3.43Å; N269-M429 PolarHBondContact OD1-N 3.16Å; N269-N439 PolarHBondContact O-ND2 3.02Å; N269-E441 HydrophobicContact CB-CG 3.99Å
270	V	98.3	Very high	96.7	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-62.5	-51.6	173.9	174.4	0	0	0	0	110.4	A244 L245 L248 Y266 C267 K272 G273 C274 E441	A244-V270 HydrophobicContact CB-CG1 3.96Å; L245-V270 HydrophobicContact CD2-CG1 3.95Å; L245-V270 HydrophobicContact CG-CG1 4.41Å; L248-V270 HydrophobicContact CB-CG1 4.43Å; L248-V270 HydrophobicContact CB-CG2 4.38Å; L248-V270 HydrophobicContact CD1-CG2 4.34Å; L248-V270 HydrophobicContact CD2-CB 4.07Å; L248-V270 HydrophobicContact CD2-CG1 3.92Å; L248-V270 HydrophobicContact CD2-CG2 4.44Å; Y266-V270 HydrophobicContact CD2-CG2 4.06Å; Y266-V270 HydrophobicContact CE2-CG2 3.58Å; Y266-V270 WeakPolarHBondContact O-CG2 3.36Å; Y266-V270 PolarHBondContact O-N 3.38Å; Y266-V270 VanDerWaalsContact O-N 3.09Å; C267-V270 PolarHBondContact O-N 3.35Å; V270-K272 PolarHBondContact O-N 3.01Å; V270-G273 PolarHBondContact O-N 3.07Å; V270-C274 WeakPolarHBondContact O-CB 3.23Å; V270-C274 PolarHBondContact O-N 3.02Å; V270-C274 PolarHBondContact O-SG 2.91Å; V270-C274 VanDerWaalsContact O-SG 3.33Å; V270-E441 HydrophobicContact CG2-CB 3.73Å; V270-E441 HydrophobicContact CG2-CG 4.2Å
271	M	97.8	Very high	96.9	Very high	2 Å²	2	15.9 Å²	15.9	1%	0.01	9%	0.087	C	C	.	.	H	α-helix	trans	-66.6	-38.8	-176.9	-67.9	-61.2	178.4	0	0	112.6	T80 L245 L248 C267 S268 C274 L275 P398 L401 C402 L405	T80-M271 HydrophobicContact CG2-CE 4.19Å; T80-M271 HydrophobicContact CG2-SD 4.2Å; L245-M271 HydrophobicContact CD2-CE 3.83Å; L245-M271 HydrophobicContact CD2-SD 4.16Å; L248-M271 HydrophobicContact CD2-CE 4.19Å; C267-M271 WeakPolarHBondContact O-CB 3.46Å; C267-M271 WeakPolarHBondContact O-CG 3.34Å; C267-M271 PolarHBondContact O-N 3.43Å; S268-M271 PolarHBondContact O-N 3.42Å; M271-C274 PolarHBondContact O-N 3.4Å; M271-L275 WeakPolarHBondContact O-CB 3.29Å; M271-L275 PolarHBondContact O-N 3.11Å; M271-P398 HydrophobicContact CB-CB 3.76Å; M271-L401 HydrophobicContact CE-CB 4.45Å; M271-L401 HydrophobicContact SD-CB 4.41Å; M271-L401 HydrophobicContact SD-CD1 4.2Å; M271-C402 VanDerWaalsContact CG-SG 3.53Å; M271-L405 HydrophobicContact CE-CD1 3.9Å
272	K	97.8	Very high	97.1	Very high	25 Å²	25	12.1 Å²	12.1	11%	0.109	7%	0.07	C	C	.	.	H	α-helix	trans	-65.4	-37.4	174.7	-76.3	-170.6	176.6	-142.3	0	112.5	S268 V270 A276 P398 V428 M429 D431	S268-K272 VanDerWaalsContact O-CB 3.25Å; S268-K272 WeakPolarHBondContact O-CB 3.4Å; S268-K272 VanDerWaalsContact O-CG 3.27Å; S268-K272 WeakPolarHBondContact O-CG 3.28Å; S268-K272 PolarHBondContact O-N 3.23Å; V270-K272 PolarHBondContact O-N 3.01Å; K272-A276 WeakPolarHBondContact O-CA 3.46Å; K272-A276 WeakPolarHBondContact O-CB 3.18Å; K272-A276 PolarHBondContact O-N 3.35Å; K272-P398 HydrophobicContact CG-CB 4.03Å; K272-P398 HydrophobicContact CG-CG 4.16Å; K272-V428 HydrophobicContact CD-CG1 4.1Å; K272-M429 WeakPolarHBondContact CD-O 3.47Å; K272-M429 PolarHBondContact NZ-O 2.89Å; K272-D431 WeakPolarHBondContact CE-OD1 3.44Å; K272-D431 IonicContact NZ-OD1 2.7Å; K272-D431 PolarHBondContact NZ-OD1 2.88Å; K272-D431 IonicContact NZ-OD2 3.22Å; K272-D431 PolarHBondContact NZ-OD2 3.03Å
273	G	97.6	Very high	97.2	Very high	2 Å²	2	15.7 Å²	15.7	2%	0.021	9%	0.094	C	C	.	.	H	α-helix	trans	-62.9	-53.6	171.1	0	0	0	0	0	111.4	N269 V270 L275 A276 L444	N269-G273 PolarHBondContact O-N 3.4Å; V270-G273 PolarHBondContact O-N 3.07Å; G273-L275 VanDerWaalsContact C-N 3.26Å; G273-L275 PolarHBondContact O-N 3.4Å; G273-A276 WeakPolarHBondContact O-CB 3.39Å; G273-A276 PolarHBondContact O-N 3.01Å; G273-L444 WeakPolarHBondContact O-CD1 3Å
274	C	97.8	Very high	97.3	Very high	13 Å²	13	16.2 Å²	16.2	9%	0.088	10%	0.097	C	C	.	.	H	α-helix	trans	-56.6	-36.3	179.2	-75.4	0	0	0	0	114.3	C241 V270 M271	C241-C274 HydrophobicContact CB-CB 3.97Å; C241-C274 WeakPolarHBondContact CB-SG 3.48Å; C241-C274 WeakPolarHBondContact SG-CB 3.47Å; C241-C274 CovalentContact SG-SG 2.03Å; C241-C274 PolarHBondContact SG-SG 3.49Å; V270-C274 WeakPolarHBondContact O-CB 3.23Å; V270-C274 PolarHBondContact O-N 3.02Å; V270-C274 PolarHBondContact O-SG 2.91Å; V270-C274 VanDerWaalsContact O-SG 3.33Å; M271-C274 PolarHBondContact O-N 3.4Å
275	L	97.6	Very high	97.5	Very high	3 Å²	3	14.3 Å²	14.3	2%	0.016	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105	16.7	-176.6	-63.9	175.2	0	0	0	113.5	I84 M271 G273 N277 Q278 A279 L397 P398 L401	I84-L275 HydrophobicContact CD1-CD2 3.78Å; I84-L275 HydrophobicContact CG1-CD2 4.36Å; M271-L275 WeakPolarHBondContact O-CB 3.29Å; M271-L275 PolarHBondContact O-N 3.11Å; G273-L275 VanDerWaalsContact C-N 3.26Å; G273-L275 PolarHBondContact O-N 3.4Å; L275-N277 VanDerWaalsContact C-N 3.31Å; L275-N277 PolarHBondContact O-N 2.9Å; L275-Q278 HydrophobicContact CD2-CG 4.28Å; L275-Q278 WeakPolarHBondContact O-CB 3.46Å; L275-Q278 PolarHBondContact O-N 3.35Å; L275-Q278 VanDerWaalsContact O-N 3.09Å; L275-Q278 PolarHBondContact O-OE1 3.03Å; L275-A279 PolarHBondContact O-N 3.4Å; L275-L397 HydrophobicContact CD1-CD2 3.91Å; L275-L397 HydrophobicContact CD1-CG 3.94Å; L275-P398 HydrophobicContact CB-CG 4.44Å; L275-P398 HydrophobicContact CD1-CG 4.08Å; L275-L401 HydrophobicContact CD1-CD1 3.84Å
276	A	97.4	Very high	97.7	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-62.2	-38.3	-172.9	0	0	0	0	0	113	K272 G273 A279 D280 G432 L433 Q436 L444	K272-A276 WeakPolarHBondContact O-CA 3.46Å; K272-A276 WeakPolarHBondContact O-CB 3.18Å; K272-A276 PolarHBondContact O-N 3.35Å; G273-A276 WeakPolarHBondContact O-CB 3.39Å; G273-A276 PolarHBondContact O-N 3.01Å; A276-A279 PolarHBondContact O-N 2.89Å; A276-D280 PolarHBondContact O-N 3.46Å; A276-G432 CarbonylContact O-C 3.57Å; A276-G432 WeakPolarHBondContact O-CA 3.33Å; A276-L433 HydrophobicContact CB-CB 4.5Å; A276-L433 HydrophobicContact CB-CD1 4.19Å; A276-L433 PolarHBondContact O-N 3.3Å; A276-Q436 HydrophobicContact CB-CG 3.41Å; A276-Q436 VanDerWaalsContact CB-CG 3.41Å; A276-L444 HydrophobicContact CB-CD1 4.18Å
277	N	96.6	Very high	97.7	Very high	18 Å²	18	17.1 Å²	17.1	10%	0.096	10%	0.095	C	C	.	.	H	α-helix	trans	-66.3	-40.9	175.6	-77.6	-91.2	0	0	0	111	L275 A279 D280 I450 I453	L275-N277 VanDerWaalsContact C-N 3.31Å; L275-N277 PolarHBondContact O-N 2.9Å; N277-A279 VanDerWaalsContact C-N 3.32Å; N277-A279 PolarHBondContact O-N 3.41Å; N277-D280 WeakPolarHBondContact O-CB 3.28Å; N277-D280 PolarHBondContact O-N 3.47Å; N277-I450 HydrophobicContact CB-CB 4.48Å; N277-I450 HydrophobicContact CB-CD1 4.04Å; N277-I450 HydrophobicContact CB-CG1 4.35Å; N277-I450 PolarHBondContact OD1-N 2.96Å; N277-I453 HydrophobicContact CB-CG1 4.21Å; N277-I453 HydrophobicContact CB-CG2 4.49Å; N277-I453 VanDerWaalsContact O-CG2 3.3Å; N277-I453 WeakPolarHBondContact O-CG2 3.46Å
278	Q	97.3	Very high	97.8	Very high	10 Å²	10	17.1 Å²	17.1	5%	0.047	10%	0.095	C	C	.	.	H	α-helix	trans	-65.2	-37.4	177.8	-67.7	80	-9.5	0	0	111.3	V232 L275 D280 L281 W394 I453	V232-Q278 HydrophobicContact CG1-CB 4.28Å; V232-Q278 HydrophobicContact CG1-CG 3.62Å; L275-Q278 HydrophobicContact CD2-CG 4.28Å; L275-Q278 WeakPolarHBondContact O-CB 3.46Å; L275-Q278 PolarHBondContact O-N 3.35Å; L275-Q278 VanDerWaalsContact O-N 3.09Å; L275-Q278 PolarHBondContact O-OE1 3.03Å; Q278-D280 PolarHBondContact O-N 3.47Å; Q278-L281 WeakPolarHBondContact O-CB 3.24Å; Q278-L281 WeakPolarHBondContact O-CD1 3.15Å; Q278-L281 PolarHBondContact O-N 3.23Å; Q278-L281 VanDerWaalsContact O-N 3.11Å; Q278-W394 HydrophobicContact CB-CE3 4.04Å; Q278-W394 HydrophobicContact CB-CZ3 4.28Å; Q278-I453 HydrophobicContact CG-CD1 4.3Å
279	A	97.8	Very high	97.9	Very high	8 Å²	8	16.6 Å²	16.6	7%	0.066	9%	0.091	C	C	.	.	H	α-helix	trans	-63.9	-23.8	175.2	0	0	0	0	0	113.3	L275 A276 N277 L281 D282 D431 G432	L275-A279 PolarHBondContact O-N 3.4Å; A276-A279 PolarHBondContact O-N 2.89Å; N277-A279 VanDerWaalsContact C-N 3.32Å; N277-A279 PolarHBondContact O-N 3.41Å; A279-L281 PolarHBondContact O-N 3Å; A279-D282 WeakPolarHBondContact O-CB 3.42Å; A279-D282 PolarHBondContact O-N 3.03Å; A279-D431 HydrophobicContact CB-CB 4.3Å; A279-G432 VanDerWaalsContact CB-N 3.34Å
280	D	97.9	Very high	97.9	Very high	32 Å²	32	19 Å²	19	17%	0.171	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-14.6	173.8	-74.6	-1.7	0	0	0	113.4	A276 N277 Q278 D282 G432 L433 R454 I457	A276-D280 PolarHBondContact O-N 3.46Å; N277-D280 WeakPolarHBondContact O-CB 3.28Å; N277-D280 PolarHBondContact O-N 3.47Å; Q278-D280 PolarHBondContact O-N 3.47Å; D280-D282 VanDerWaalsContact C-N 3.26Å; D280-G432 WeakPolarHBondContact OD1-CA 3.25Å; D280-L433 PolarHBondContact OD1-N 2.98Å; D280-R454 IonicContact OD2-CZ 3.22Å; D280-R454 VanDerWaalsContact OD2-CZ 3.26Å; D280-R454 IonicContact OD2-NH1 2.97Å; D280-R454 PolarHBondContact OD2-NH1 3.07Å; D280-R454 VanDerWaalsContact OD2-NH1 3.14Å; D280-R454 IonicContact OD2-NH2 2.76Å; D280-R454 PolarHBondContact OD2-NH2 3.27Å; D280-I457 HydrophobicContact CB-CD1 4.11Å
281	L	98.3	Very high	97.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-23.4	170.8	-73.8	99.1	0	0	0	112.4	V228 V232 Q278 A279 V284 W285 W394 I453 Q456 I457 L460	V228-L281 HydrophobicContact CG1-CD2 3.85Å; V232-L281 HydrophobicContact CG1-CD1 4.15Å; V232-L281 HydrophobicContact CG2-CD1 4.17Å; V232-L281 HydrophobicContact CG2-CD2 3.8Å; Q278-L281 WeakPolarHBondContact O-CB 3.24Å; Q278-L281 WeakPolarHBondContact O-CD1 3.15Å; Q278-L281 PolarHBondContact O-N 3.23Å; Q278-L281 VanDerWaalsContact O-N 3.11Å; A279-L281 PolarHBondContact O-N 3Å; L281-V284 PolarHBondContact O-N 3.01Å; L281-W285 VanDerWaalsContact O-CB 3.26Å; L281-W285 WeakPolarHBondContact O-CB 3.27Å; L281-W285 PolarHBondContact O-N 3.41Å; L281-W394 HydrophobicContact CB-CD2 4.33Å; L281-W394 HydrophobicContact CB-CG 4.13Å; L281-W394 HydrophobicContact CD2-CZ2 4.21Å; L281-I453 HydrophobicContact CD1-CD1 4.37Å; L281-I453 HydrophobicContact CD1-CG2 3.56Å; L281-I453 HydrophobicContact CG-CG2 4.46Å; L281-Q456 HydrophobicContact CD2-CB 4.36Å; L281-I457 HydrophobicContact CG-CG1 3.87Å; L281-L460 HydrophobicContact CD2-CD1 3.87Å
282	D	98.3	Very high	97.9	Very high	17 Å²	17	19.1 Å²	19.1	9%	0.091	11%	0.105	C	C	.	.	H	α-helix	trans	-55.1	-44.9	-167.4	-173.9	75	0	0	0	114.3	A279 D280 V284 W285 Q286 W394 V395	A279-D282 WeakPolarHBondContact O-CB 3.42Å; A279-D282 PolarHBondContact O-N 3.03Å; D280-D282 VanDerWaalsContact C-N 3.26Å; D282-V284 PolarHBondContact O-N 3.38Å; D282-W285 PolarHBondContact O-N 2.9Å; D282-Q286 WeakPolarHBondContact O-CB 3.48Å; D282-Q286 WeakPolarHBondContact O-CG 3.39Å; D282-Q286 PolarHBondContact O-N 3.04Å; D282-Q286 PolarHBondContact OD1-NE2 3.41Å; D282-Q286 PolarHBondContact OD2-NE2 3.49Å; D282-W394 HydrophobicContact CB-CB 4.14Å; D282-V395 HydrophobicContact CB-CG1 3.76Å; D282-V395 VanDerWaalsContact CG-CG1 3.45Å
283	P	98	Very high	98	Very high	87 Å²	87	19.2 Å²	19.2	57%	0.565	11%	0.106	S	C	*	.	H	α-helix	trans	-62.1	-44.8	179.8	-23.3	34.9	0	0	0	113.1	E287	P283-E287 PolarHBondContact O-N 3.2Å; P283-E287 VanDerWaalsContact O-N 3.1Å
284	V	98.1	Very high	97.9	Very high	13 Å²	13	24 Å²	24	8%	0.079	13%	0.128	C	C	.	.	H	α-helix	trans	-74.2	-34.1	-179.6	-179	0	0	0	0	110.9	L281 D282 E287 L288 I457 L460 K461	L281-V284 PolarHBondContact O-N 3.01Å; D282-V284 PolarHBondContact O-N 3.38Å; V284-E287 PolarHBondContact O-N 3.29Å; V284-L288 WeakPolarHBondContact O-CB 3.3Å; V284-L288 PolarHBondContact O-N 3.49Å; V284-I457 HydrophobicContact CG2-CG2 3.92Å; V284-L460 HydrophobicContact CG1-CB 3.58Å; V284-K461 HydrophobicContact CB-CG 4.5Å; V284-K461 HydrophobicContact CG1-CB 4.46Å; V284-K461 HydrophobicContact CG1-CG 3.61Å; V284-K461 HydrophobicContact CG2-CD 4.46Å; V284-K461 HydrophobicContact CG2-CG 3.99Å
285	W	98.6	Very high	97.9	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62.9	-48	173.6	179.8	-99.6	0	0	0	111.5	L91 F95 I229 L281 D282 E287 L288 I289 M390 W394 L460	L91-W285 HydrophobicContact CD2-CZ2 4.35Å; F95-W285 HydrophobicContact CE1-CH2 4.37Å; F95-W285 AromaticContact CE2-CH2 3.5Å; F95-W285 HydrophobicContact CE2-CH2 3.5Å; F95-W285 AromaticContact CE2-CZ2 3.69Å; F95-W285 HydrophobicContact CE2-CZ2 3.69Å; F95-W285 AromaticContact CZ-CH2 3.38Å; F95-W285 HydrophobicContact CZ-CH2 3.38Å; F95-W285 AromaticContact CZ-CZ2 3.61Å; F95-W285 HydrophobicContact CZ-CZ2 3.61Å; I229-W285 HydrophobicContact CD1-CH2 3.72Å; I229-W285 HydrophobicContact CD1-CZ2 4.48Å; I229-W285 HydrophobicContact CD1-CZ3 4.41Å; I229-W285 HydrophobicContact CG1-CH2 4.02Å; I229-W285 HydrophobicContact CG1-CZ3 4.3Å; L281-W285 VanDerWaalsContact O-CB 3.26Å; L281-W285 WeakPolarHBondContact O-CB 3.27Å; L281-W285 PolarHBondContact O-N 3.41Å; D282-W285 PolarHBondContact O-N 2.9Å; W285-E287 VanDerWaalsContact C-N 3.33Å; W285-E287 PolarHBondContact O-N 3.09Å; W285-L288 PolarHBondContact O-N 3.32Å; W285-I289 HydrophobicContact CD2-CG1 4.36Å; W285-I289 HydrophobicContact CZ2-CD1 3.95Å; W285-I289 HydrophobicContact CZ2-CG1 4.32Å; W285-I289 WeakPolarHBondContact O-CB 3.31Å; W285-I289 VanDerWaalsContact O-CG1 3.26Å; W285-I289 WeakPolarHBondContact O-CG1 3.37Å; W285-I289 PolarHBondContact O-N 3.42Å; W285-M390 PolarHBondContact NE1-O 3.25Å; W285-W394 AromaticContact CD1-CD1 3.9Å; W285-W394 AromaticContact CD2-NE1 3.61Å; W285-W394 AromaticContact CE3-NE1 3.86Å; W285-W394 AromaticContact CG-CD1 3.59Å; W285-W394 AromaticContact CG-NE1 3.62Å; W285-L460 HydrophobicContact CE3-CD1 4.02Å; W285-L460 HydrophobicContact CE3-CD2 4.29Å; W285-L460 HydrophobicContact CZ3-CD2 4.37Å
286	Q	98.5	Very high	97.8	Very high	41 Å²	41	23.3 Å²	23.3	19%	0.192	12%	0.123	C	C	.	.	H	α-helix	trans	-59.4	-45.3	175.8	-72.9	-171.7	38.6	0	0	111.2	D282 L288 I289 D290 R391	D282-Q286 WeakPolarHBondContact O-CB 3.48Å; D282-Q286 WeakPolarHBondContact O-CG 3.39Å; D282-Q286 PolarHBondContact O-N 3.04Å; D282-Q286 PolarHBondContact OD1-NE2 3.41Å; D282-Q286 PolarHBondContact OD2-NE2 3.49Å; Q286-L288 PolarHBondContact O-N 2.95Å; Q286-I289 PolarHBondContact O-N 3.45Å; Q286-D290 WeakPolarHBondContact O-CB 3.36Å; Q286-D290 PolarHBondContact O-N 2.92Å; Q286-R391 HydrophobicContact CG-CG 4.1Å; Q286-R391 WeakPolarHBondContact CG-O 3.36Å
287	E	98.1	Very high	97.8	Very high	77 Å²	77	26.2 Å²	26.2	36%	0.36	14%	0.144	S	C	.	.	H	α-helix	trans	-59.9	-43.8	176.2	-177.9	-179.9	-173.1	0	0	112.3	P283 V284 W285 D290 T291 K468	P283-E287 PolarHBondContact O-N 3.2Å; P283-E287 VanDerWaalsContact O-N 3.1Å; V284-E287 PolarHBondContact O-N 3.29Å; W285-E287 VanDerWaalsContact C-N 3.33Å; W285-E287 PolarHBondContact O-N 3.09Å; E287-D290 PolarHBondContact O-N 3.4Å; E287-T291 WeakPolarHBondContact O-CB 3.34Å; E287-T291 PolarHBondContact O-N 3.35Å; E287-T291 PolarHBondContact O-OG1 3.19Å; E287-K468 IonicContact OE1-NZ 3.96Å; E287-K468 PolarHBondContact OE1-NZ 3.19Å
288	L	98.3	Very high	97.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.8	-51	176.3	178.6	65	0	0	0	110.9	S225 V284 W285 Q286 D290 T291 M292 L460 M463 S464 L467	S225-L288 WeakPolarHBondContact OG-CD2 3.42Å; V284-L288 WeakPolarHBondContact O-CB 3.3Å; V284-L288 PolarHBondContact O-N 3.49Å; W285-L288 PolarHBondContact O-N 3.32Å; Q286-L288 PolarHBondContact O-N 2.95Å; L288-D290 VanDerWaalsContact C-N 3.34Å; L288-D290 PolarHBondContact O-N 3.42Å; L288-T291 CarbonylContact O-C 3.48Å; L288-T291 WeakPolarHBondContact O-CB 3.35Å; L288-T291 PolarHBondContact O-N 2.86Å; L288-T291 VanDerWaalsContact O-N 3.17Å; L288-M292 HydrophobicContact CD1-CG 4.28Å; L288-M292 HydrophobicContact CD1-SD 4.33Å; L288-M292 HydrophobicContact CG-CG 4.39Å; L288-M292 HydrophobicContact CG-SD 4.07Å; L288-M292 VanDerWaalsContact O-CG 3.28Å; L288-M292 WeakPolarHBondContact O-CG 3.31Å; L288-M292 PolarHBondContact O-N 3.4Å; L288-L460 HydrophobicContact CD2-CB 4.49Å; L288-L460 HydrophobicContact CD2-CD2 3.53Å; L288-M463 HydrophobicContact CD1-CB 4.38Å; L288-M463 HydrophobicContact CD1-CG 4.25Å; L288-S464 WeakPolarHBondContact CA-OG 3.42Å; L288-S464 WeakPolarHBondContact CB-OG 2.93Å; L288-S464 WeakPolarHBondContact CD1-OG 3.4Å; L288-L467 HydrophobicContact CD1-CD1 3.51Å
289	I	98.5	Very high	97.6	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-59.2	-46	179.3	-68	-64.6	0	0	0	111	F95 W285 Q286 T291 M292 I293 L387 R391	F95-I289 HydrophobicContact CZ-CD1 3.92Å; W285-I289 HydrophobicContact CD2-CG1 4.36Å; W285-I289 HydrophobicContact CZ2-CD1 3.95Å; W285-I289 HydrophobicContact CZ2-CG1 4.32Å; W285-I289 WeakPolarHBondContact O-CB 3.31Å; W285-I289 VanDerWaalsContact O-CG1 3.26Å; W285-I289 WeakPolarHBondContact O-CG1 3.37Å; W285-I289 PolarHBondContact O-N 3.42Å; Q286-I289 PolarHBondContact O-N 3.45Å; I289-T291 VanDerWaalsContact C-N 3.29Å; I289-T291 PolarHBondContact O-N 3.39Å; I289-M292 PolarHBondContact O-N 3.29Å; I289-I293 HydrophobicContact CG2-CD1 3.92Å; I289-I293 VanDerWaalsContact O-CG1 3.29Å; I289-I293 WeakPolarHBondContact O-CG1 3.38Å; I289-I293 PolarHBondContact O-N 2.95Å; I289-L387 HydrophobicContact CD1-CD2 3.84Å; I289-L387 HydrophobicContact CG2-CB 4.21Å; I289-L387 VanDerWaalsContact CG2-O 3.28Å; I289-L387 WeakPolarHBondContact CG2-O 3.4Å; I289-R391 HydrophobicContact CG2-CB 4.07Å; I289-R391 HydrophobicContact CG2-CG 4.18Å
290	D	98.3	Very high	97.4	Very high	52 Å²	52	28.7 Å²	28.7	28%	0.278	16%	0.162	S	C	.	.	H	α-helix	trans	-63.8	-36.6	178.6	-69	-22.1	0	0	0	111.2	Q286 E287 L288 Q294 R391	Q286-D290 WeakPolarHBondContact O-CB 3.36Å; Q286-D290 PolarHBondContact O-N 2.92Å; E287-D290 PolarHBondContact O-N 3.4Å; L288-D290 VanDerWaalsContact C-N 3.34Å; L288-D290 PolarHBondContact O-N 3.42Å; D290-Q294 WeakPolarHBondContact O-CG 3.42Å; D290-Q294 PolarHBondContact O-N 2.95Å; D290-Q294 VanDerWaalsContact O-N 3.1Å; D290-Q294 PolarHBondContact O-NE2 3.38Å; D290-Q294 VanDerWaalsContact O-NE2 3.11Å; D290-R391 IonicContact OD1-CZ 3.82Å; D290-R391 IonicContact OD1-NE 3.63Å; D290-R391 PolarHBondContact OD1-NE 3.44Å; D290-R391 IonicContact OD1-NH2 2.72Å; D290-R391 IonicContact OD2-CZ 2.74Å; D290-R391 IonicContact OD2-NE 3.83Å; D290-R391 PolarHBondContact OD2-NE 2.97Å; D290-R391 IonicContact OD2-NH2 3.06Å; D290-R391 PolarHBondContact OD2-NH2 3.11Å
291	T	98.1	Very high	97.1	Very high	4 Å²	4	31 Å²	31	3%	0.025	18%	0.178	C	C	.	.	H	α-helix	trans	-68.4	-43.5	173.8	-54.8	0	0	0	0	111.3	E287 L288 I289 I293 Q294 V295 L467 K468	E287-T291 WeakPolarHBondContact O-CB 3.34Å; E287-T291 PolarHBondContact O-N 3.35Å; E287-T291 PolarHBondContact O-OG1 3.19Å; L288-T291 CarbonylContact O-C 3.48Å; L288-T291 WeakPolarHBondContact O-CB 3.35Å; L288-T291 PolarHBondContact O-N 2.86Å; L288-T291 VanDerWaalsContact O-N 3.17Å; I289-T291 VanDerWaalsContact C-N 3.29Å; I289-T291 PolarHBondContact O-N 3.39Å; T291-I293 VanDerWaalsContact C-N 3.3Å; T291-I293 PolarHBondContact O-N 3.08Å; T291-Q294 WeakPolarHBondContact O-CB 3.07Å; T291-Q294 PolarHBondContact O-N 3.23Å; T291-Q294 VanDerWaalsContact O-N 3.14Å; T291-V295 VanDerWaalsContact O-CG2 3.31Å; T291-V295 WeakPolarHBondContact O-CG2 3.44Å; T291-V295 PolarHBondContact O-N 3Å; T291-L467 HydrophobicContact CG2-CB 3.64Å; T291-K468 HydrophobicContact CG2-CG 3.85Å
292	M	98.3	Very high	96.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62	-37.3	176.2	-70.3	-178.5	80	0	0	112	F218 L222 L288 I289 V295 A296 L387 L467	F218-M292 HydrophobicContact CD2-CE 4.4Å; F218-M292 HydrophobicContact CE2-CB 4.12Å; F218-M292 HydrophobicContact CE2-CE 4.13Å; F218-M292 WeakPolarHBondContact CE2-O 3.45Å; L222-M292 HydrophobicContact CB-CE 4.31Å; L222-M292 HydrophobicContact CD2-CE 3.39Å; L222-M292 HydrophobicContact CG-CE 3.52Å; L288-M292 HydrophobicContact CD1-CG 4.28Å; L288-M292 HydrophobicContact CD1-SD 4.33Å; L288-M292 HydrophobicContact CG-CG 4.39Å; L288-M292 HydrophobicContact CG-SD 4.07Å; L288-M292 VanDerWaalsContact O-CG 3.28Å; L288-M292 WeakPolarHBondContact O-CG 3.31Å; L288-M292 PolarHBondContact O-N 3.4Å; I289-M292 PolarHBondContact O-N 3.29Å; M292-V295 PolarHBondContact O-N 3.2Å; M292-A296 WeakPolarHBondContact O-CB 3.44Å; M292-A296 PolarHBondContact O-N 3.03Å; M292-L387 HydrophobicContact CB-CD1 3.9Å; M292-L387 HydrophobicContact CB-CD2 4.47Å; M292-L387 HydrophobicContact CE-CD2 4.28Å; M292-L387 HydrophobicContact SD-CD2 4.29Å; M292-L467 HydrophobicContact CG-CD1 3.6Å
293	I	98.1	Very high	96.3	Very high	26 Å²	26	42 Å²	42	13%	0.133	23%	0.234	C	C	.	.	H	α-helix	trans	-65.1	-41.9	173.9	-68.7	166.4	0	0	0	110.6	I289 T291 A296 S297 L387 R388	I289-I293 HydrophobicContact CG2-CD1 3.92Å; I289-I293 VanDerWaalsContact O-CG1 3.29Å; I289-I293 WeakPolarHBondContact O-CG1 3.38Å; I289-I293 PolarHBondContact O-N 2.95Å; T291-I293 VanDerWaalsContact C-N 3.3Å; T291-I293 PolarHBondContact O-N 3.08Å; I293-A296 PolarHBondContact O-N 2.73Å; I293-S297 WeakPolarHBondContact O-CB 3.39Å; I293-S297 PolarHBondContact O-N 2.95Å; I293-S297 PolarHBondContact O-OG 2.76Å; I293-L387 HydrophobicContact CD1-CB 4.09Å; I293-L387 HydrophobicContact CG1-CB 3.78Å; I293-L387 HydrophobicContact CG1-CD1 4.03Å; I293-R388 HydrophobicContact CD1-CB 4.42Å
294	Q	97.3	Very high	96.1	Very high	104 Å²	104	39 Å²	39	49%	0.486	22%	0.215	S	C	.	.	H	α-helix	trans	-61.4	-45.5	174.4	-72.9	168.1	67.9	0	0	111.4	D290 T291 A296 S297 S298 L471	D290-Q294 WeakPolarHBondContact O-CG 3.42Å; D290-Q294 PolarHBondContact O-N 2.95Å; D290-Q294 VanDerWaalsContact O-N 3.1Å; D290-Q294 PolarHBondContact O-NE2 3.38Å; D290-Q294 VanDerWaalsContact O-NE2 3.11Å; T291-Q294 WeakPolarHBondContact O-CB 3.07Å; T291-Q294 PolarHBondContact O-N 3.23Å; T291-Q294 VanDerWaalsContact O-N 3.14Å; Q294-A296 PolarHBondContact O-N 2.68Å; Q294-S297 WeakPolarHBondContact CA-OG 3.34Å; Q294-S297 PolarHBondContact O-N 3.07Å; Q294-S297 PolarHBondContact O-OG 2.83Å; Q294-S298 PolarHBondContact O-N 3.08Å; Q294-L471 HydrophobicContact CB-CD1 4.24Å
295	V	96.8	Very high	95.9	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-57.6	-49.1	174.2	172.8	0	0	0	0	111.4	T214 F218 T291 M292 S297 S298 F299 L467 L471	T214-V295 HydrophobicContact CG2-CG1 3.66Å; F218-V295 HydrophobicContact CB-CG1 3.77Å; F218-V295 HydrophobicContact CD2-CB 4.09Å; F218-V295 HydrophobicContact CD2-CG1 3.58Å; F218-V295 HydrophobicContact CG-CG1 4Å; T291-V295 VanDerWaalsContact O-CG2 3.31Å; T291-V295 WeakPolarHBondContact O-CG2 3.44Å; T291-V295 PolarHBondContact O-N 3Å; M292-V295 PolarHBondContact O-N 3.2Å; V295-S297 VanDerWaalsContact C-N 3.31Å; V295-S297 PolarHBondContact O-N 3.41Å; V295-S298 WeakPolarHBondContact O-CB 3.43Å; V295-S298 PolarHBondContact O-N 3.21Å; V295-S298 VanDerWaalsContact O-N 3.08Å; V295-S298 PolarHBondContact O-OG 3.35Å; V295-F299 HydrophobicContact CG1-CE1 4.25Å; V295-F299 HydrophobicContact CG1-CZ 3.97Å; V295-L467 HydrophobicContact CG2-CB 4.2Å; V295-L467 HydrophobicContact CG2-CD2 4.1Å; V295-L471 HydrophobicContact CB-CD2 4.35Å; V295-L471 HydrophobicContact CG2-CD1 3.96Å; V295-L471 HydrophobicContact CG2-CD2 3.8Å; V295-L471 HydrophobicContact CG2-CG 3.67Å
296	A	96.5	Very high	95.7	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.7	-43	176.7	0	0	0	0	0	111.8	F218 M292 I293 Q294 S298 F299 V380 L383	F218-A296 HydrophobicContact CE2-CB 4.13Å; F218-A296 HydrophobicContact CZ-CB 4.21Å; M292-A296 WeakPolarHBondContact O-CB 3.44Å; M292-A296 PolarHBondContact O-N 3.03Å; I293-A296 PolarHBondContact O-N 2.73Å; Q294-A296 PolarHBondContact O-N 2.68Å; A296-S298 VanDerWaalsContact C-N 3.28Å; A296-S298 PolarHBondContact O-N 3.19Å; A296-F299 WeakPolarHBondContact O-CB 3.37Å; A296-F299 WeakPolarHBondContact O-CD2 3.47Å; A296-F299 PolarHBondContact O-N 3Å; A296-V380 WeakPolarHBondContact O-CG1 3.19Å; A296-V380 WeakPolarHBondContact O-CG2 3.46Å; A296-L383 HydrophobicContact CB-CB 4.43Å
297	S	95.6	Very high	95.5	Very high	61 Å²	61	38.3 Å²	38.3	43%	0.427	21%	0.213	S	C	.	.	H	α-helix	trans	-65.6	-30.4	177.1	75.1	0	0	0	0	113.2	I293 Q294 V295 F299 S300	I293-S297 WeakPolarHBondContact O-CB 3.39Å; I293-S297 PolarHBondContact O-N 2.95Å; I293-S297 PolarHBondContact O-OG 2.76Å; Q294-S297 WeakPolarHBondContact CA-OG 3.34Å; Q294-S297 PolarHBondContact O-N 3.07Å; Q294-S297 PolarHBondContact O-OG 2.83Å; V295-S297 VanDerWaalsContact C-N 3.31Å; V295-S297 PolarHBondContact O-N 3.41Å; S297-F299 PolarHBondContact O-N 3.1Å; S297-S300 PolarHBondContact O-N 3.49Å; S297-S300 VanDerWaalsContact O-N 3.16Å
298	S	95.4	Very high	95.3	Very high	26 Å²	26	35.1 Å²	35.1	18%	0.182	20%	0.199	C	C	.	.	H	α-helix	trans	-63.8	-25.3	178.9	80.4	0	0	0	0	112.5	Q294 V295 A296 S300 T301	Q294-S298 PolarHBondContact O-N 3.08Å; V295-S298 WeakPolarHBondContact O-CB 3.43Å; V295-S298 PolarHBondContact O-N 3.21Å; V295-S298 VanDerWaalsContact O-N 3.08Å; V295-S298 PolarHBondContact O-OG 3.35Å; A296-S298 VanDerWaalsContact C-N 3.28Å; A296-S298 PolarHBondContact O-N 3.19Å; S298-S300 PolarHBondContact O-N 3.25Å; S298-T301 VanDerWaalsContact O-CB 3.26Å; S298-T301 WeakPolarHBondContact O-CB 3.49Å; S298-T301 PolarHBondContact O-N 2.69Å; S298-T301 PolarHBondContact O-OG1 2.96Å
299	F	95.7	Very high	95.2	Very high	4 Å²	4	35.1 Å²	35.1	2%	0.018	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-29.7	177.1	-56.6	-30.3	0	0	0	112.8	F102 T214 F218 V295 A296 S297 S304 M305 L376 V380	F102-F299 HydrophobicContact CD2-CE2 4.3Å; F102-F299 HydrophobicContact CE1-CE2 4.17Å; F102-F299 HydrophobicContact CE1-CZ 4.19Å; F102-F299 AromaticContact CE2-CD2 3.67Å; F102-F299 HydrophobicContact CE2-CD2 3.67Å; F102-F299 AromaticContact CE2-CE2 3.33Å; F102-F299 HydrophobicContact CE2-CE2 3.33Å; F102-F299 HydrophobicContact CE2-CZ 4.07Å; F102-F299 AromaticContact CZ-CD2 3.91Å; F102-F299 HydrophobicContact CZ-CD2 3.91Å; F102-F299 HydrophobicContact CZ-CE1 4.32Å; F102-F299 AromaticContact CZ-CE2 3.25Å; F102-F299 HydrophobicContact CZ-CE2 3.25Å; F102-F299 AromaticContact CZ-CZ 3.48Å; F102-F299 HydrophobicContact CZ-CZ 3.48Å; F102-F299 VanDerWaalsContact CZ-CZ 3.48Å; T214-F299 HydrophobicContact CG2-CD1 4.35Å; T214-F299 HydrophobicContact CG2-CE1 3.61Å; T214-F299 HydrophobicContact CG2-CZ 4.45Å; F218-F299 HydrophobicContact CB-CZ 3.96Å; F218-F299 HydrophobicContact CD1-CE2 4.06Å; F218-F299 HydrophobicContact CD1-CZ 4.17Å; F218-F299 HydrophobicContact CE1-CE2 4.37Å; F218-F299 HydrophobicContact CG-CE2 4.22Å; F218-F299 AromaticContact CG-CZ 3.99Å; F218-F299 HydrophobicContact CG-CZ 3.99Å; V295-F299 HydrophobicContact CG1-CE1 4.25Å; V295-F299 HydrophobicContact CG1-CZ 3.97Å; A296-F299 WeakPolarHBondContact O-CB 3.37Å; A296-F299 WeakPolarHBondContact O-CD2 3.47Å; A296-F299 PolarHBondContact O-N 3Å; S297-F299 PolarHBondContact O-N 3.1Å; F299-S304 CarbonylContact O-C 3.53Å; F299-S304 WeakPolarHBondContact O-CA 3.34Å; F299-S304 WeakPolarHBondContact O-CB 3.26Å; F299-M305 HydrophobicContact CB-CB 4.17Å; F299-M305 HydrophobicContact CB-SD 4.48Å; F299-M305 HydrophobicContact CD1-CE 3.16Å; F299-M305 HydrophobicContact CD1-SD 3.92Å; F299-M305 HydrophobicContact CE1-CE 3.28Å; F299-M305 HydrophobicContact CE1-SD 4.25Å; F299-M305 HydrophobicContact CG-CE 3.97Å; F299-M305 HydrophobicContact CG-SD 4.14Å; F299-M305 HydrophobicContact CZ-CE 4.2Å; F299-M305 PolarHBondContact O-N 3.36Å; F299-L376 HydrophobicContact CB-CD1 4.13Å; F299-L376 WeakPolarHBondContact O-CD2 3.48Å; F299-V380 HydrophobicContact CB-CG2 4.14Å; F299-V380 HydrophobicContact CD2-CG2 4.35Å
300	S	93.5	Very high	94.9	Very high	58 Å²	58	36 Å²	36	41%	0.406	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-1.6	176.6	-57	0	0	0	0	113.4	S297 S298	S297-S300 PolarHBondContact O-N 3.49Å; S297-S300 VanDerWaalsContact O-N 3.16Å; S298-S300 PolarHBondContact O-N 3.25Å
301	T	91.8	Very high	94.7	Very high	81 Å²	81	34.1 Å²	34.1	50%	0.497	20%	0.196	S	C	.	.	S	Bend	trans	-72.1	136.5	179.2	-59.8	0	0	0	0	110.1	S298 P303 S304	S298-T301 VanDerWaalsContact O-CB 3.26Å; S298-T301 WeakPolarHBondContact O-CB 3.49Å; S298-T301 PolarHBondContact O-N 2.69Å; S298-T301 PolarHBondContact O-OG1 2.96Å; T301-P303 CarbonylContact O-C 3.37Å; T301-S304 VanDerWaalsContact O-CA 3.23Å; T301-S304 WeakPolarHBondContact O-CA 3.3Å; T301-S304 PolarHBondContact O-N 3.48Å; T301-S304 VanDerWaalsContact O-N 3.08Å
302	E	89.4	Confident	94.7	Very high	186 Å²	186	34 Å²	34	87%	0.869	20%	0.195	S	C	*	.	S	Bend	trans	-70.7	131.6	-175.5	-166.7	169.6	-172.8	0	0	112.9
303	P	89.8	Confident	94.6	Very high	61 Å²	61	34 Å²	34	40%	0.396	20%	0.195	S	C	.	.	S	Bend	cis	-71.9	130.7	-8.7	31	-33.4	0	0	0	111.4	K207 T301 V307 V308	K207-P303 HydrophobicContact CD-CG 4.14Å; K207-P303 HydrophobicContact CG-CG 4.46Å; T301-P303 CarbonylContact O-C 3.37Å; P303-V307 HydrophobicContact CB-CG1 4.43Å; P303-V308 HydrophobicContact CB-CG2 4.11Å; P303-V308 HydrophobicContact CG-CG2 3.92Å
304	S	93.6	Very high	94.4	Very high	24 Å²	24	33.9 Å²	33.9	17%	0.168	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-64.4	155.8	-177	55.6	0	0	0	0	112	F299 T301 D306 V307 V308	F299-S304 CarbonylContact O-C 3.53Å; F299-S304 WeakPolarHBondContact O-CA 3.34Å; F299-S304 WeakPolarHBondContact O-CB 3.26Å; T301-S304 VanDerWaalsContact O-CA 3.23Å; T301-S304 WeakPolarHBondContact O-CA 3.3Å; T301-S304 PolarHBondContact O-N 3.48Å; T301-S304 VanDerWaalsContact O-N 3.08Å; S304-D306 WeakPolarHBondContact CB-OD1 3.3Å; S304-D306 PolarHBondContact O-N 2.93Å; S304-D306 PolarHBondContact OG-OD1 3.39Å; S304-V307 WeakPolarHBondContact O-CA 3.09Å; S304-V307 WeakPolarHBondContact O-CB 3.36Å; S304-V307 PolarHBondContact O-N 3.25Å; S304-V307 VanDerWaalsContact OG-CG2 3.28Å; S304-V307 WeakPolarHBondContact OG-CG2 3.32Å; S304-V308 WeakPolarHBondContact O-CG2 3.35Å; S304-V308 PolarHBondContact O-N 2.96Å
305	M	94.6	Very high	94.4	Very high	8 Å²	8	33 Å²	33	4%	0.039	19%	0.187	C	C	.	.	H	α-helix	trans	-55.1	-40.4	-176.3	175	174.6	-78.3	0	0	112.6	F102 F106 A211 A215 F299 V307 V308 L309	F102-M305 HydrophobicContact CZ-SD 4.24Å; F106-M305 HydrophobicContact CD2-SD 3.8Å; F106-M305 HydrophobicContact CE2-CE 4.33Å; F106-M305 HydrophobicContact CE2-SD 3.91Å; A211-M305 HydrophobicContact CB-CE 4.35Å; A211-M305 VanDerWaalsContact O-CE 3.31Å; A211-M305 WeakPolarHBondContact O-CE 3.26Å; A215-M305 HydrophobicContact CB-CE 3.84Å; A215-M305 HydrophobicContact CB-SD 4.42Å; F299-M305 HydrophobicContact CB-CB 4.17Å; F299-M305 HydrophobicContact CB-SD 4.48Å; F299-M305 HydrophobicContact CD1-CE 3.16Å; F299-M305 HydrophobicContact CD1-SD 3.92Å; F299-M305 HydrophobicContact CE1-CE 3.28Å; F299-M305 HydrophobicContact CE1-SD 4.25Å; F299-M305 HydrophobicContact CG-CE 3.97Å; F299-M305 HydrophobicContact CG-SD 4.14Å; F299-M305 HydrophobicContact CZ-CE 4.2Å; F299-M305 PolarHBondContact O-N 3.36Å; M305-V307 VanDerWaalsContact C-N 3.33Å; M305-V307 PolarHBondContact O-N 3.29Å; M305-V308 PolarHBondContact O-N 3.17Å; M305-L309 HydrophobicContact CG-CD1 3.96Å; M305-L309 HydrophobicContact CG-CG 4.38Å; M305-L309 WeakPolarHBondContact O-CG 3.2Å; M305-L309 PolarHBondContact O-N 3.19Å
306	D	93.3	Very high	94.4	Very high	3 Å²	3	33 Å²	33	2%	0.016	19%	0.187	C	C	.	.	H	α-helix	trans	-63.8	-38.9	177.6	68.8	-47.7	0	0	0	112.8	Y105 L109 S304 S310 G373 L376	Y105-D306 WeakPolarHBondContact OH-CB 3.31Å; L109-D306 HydrophobicContact CD1-CB 4.44Å; L109-D306 HydrophobicContact CD2-CB 4Å; S304-D306 WeakPolarHBondContact CB-OD1 3.3Å; S304-D306 PolarHBondContact O-N 2.93Å; S304-D306 PolarHBondContact OG-OD1 3.39Å; D306-S310 WeakPolarHBondContact O-CB 3.47Å; D306-S310 PolarHBondContact O-N 3.23Å; D306-S310 PolarHBondContact O-OG 2.88Å; D306-G373 WeakPolarHBondContact OD2-CA 3.25Å; D306-G373 PolarHBondContact OD2-N 3.4Å; D306-L376 HydrophobicContact CB-CD2 4.12Å; D306-L376 VanDerWaalsContact OD1-CD2 3.26Å; D306-L376 WeakPolarHBondContact OD1-CD2 3.27Å
307	V	93.7	Very high	94.4	Very high	29 Å²	29	35 Å²	35	18%	0.176	20%	0.195	C	C	.	.	H	α-helix	trans	-67.4	-45.6	174.5	175.2	0	0	0	0	110.7	P303 S304 M305 S311 Y366 P368	P303-V307 HydrophobicContact CB-CG1 4.43Å; S304-V307 WeakPolarHBondContact O-CA 3.09Å; S304-V307 WeakPolarHBondContact O-CB 3.36Å; S304-V307 PolarHBondContact O-N 3.25Å; S304-V307 VanDerWaalsContact OG-CG2 3.28Å; S304-V307 WeakPolarHBondContact OG-CG2 3.32Å; M305-V307 VanDerWaalsContact C-N 3.33Å; M305-V307 PolarHBondContact O-N 3.29Å; V307-S311 WeakPolarHBondContact O-CB 3.43Å; V307-S311 PolarHBondContact O-N 2.91Å; V307-S311 PolarHBondContact O-OG 3.09Å; V307-Y366 HydrophobicContact CG1-CD1 4.43Å; V307-Y366 HydrophobicContact CG1-CE1 4.48Å; V307-P368 HydrophobicContact CG2-CB 3.85Å; V307-P368 HydrophobicContact CG2-CG 3.74Å
308	V	95.3	Very high	94.4	Very high	10 Å²	10	33.6 Å²	33.6	6%	0.061	18%	0.181	C	C	.	.	H	α-helix	trans	-58.8	-53	178.4	173.2	0	0	0	0	110.7	K207 V208 A211 P303 S304 M305 S311	K207-V308 HydrophobicContact CB-CG1 3.91Å; K207-V308 HydrophobicContact CB-CG2 4.16Å; V208-V308 HydrophobicContact CG2-CG1 4.31Å; A211-V308 HydrophobicContact CB-CG1 4.06Å; P303-V308 HydrophobicContact CB-CG2 4.11Å; P303-V308 HydrophobicContact CG-CG2 3.92Å; S304-V308 WeakPolarHBondContact O-CG2 3.35Å; S304-V308 PolarHBondContact O-N 2.96Å; M305-V308 PolarHBondContact O-N 3.17Å; V308-S311 PolarHBondContact O-N 3.47Å; V308-S311 PolarHBondContact O-OG 3.39Å; V308-S311 VanDerWaalsContact O-OG 3.13Å
309	L	95.2	Very high	94.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66.3	-41.7	-176.7	-67.3	178.2	0	0	0	112.5	F106 L109 S113 F212 M305 S311	F106-L309 HydrophobicContact CD2-CD1 3.93Å; F106-L309 HydrophobicContact CE2-CD1 3.57Å; F106-L309 HydrophobicContact CZ-CD1 3.98Å; F106-L309 HydrophobicContact CZ-CD2 4.38Å; L109-L309 HydrophobicContact CD2-CB 4.11Å; L109-L309 HydrophobicContact CD2-CD1 3.6Å; L109-L309 HydrophobicContact CD2-CG 4.42Å; L109-L309 HydrophobicContact CG-CB 4.17Å; L109-L309 HydrophobicContact CG-CD1 4.15Å; S113-L309 VanDerWaalsContact CB-O 3.26Å; S113-L309 WeakPolarHBondContact CB-O 3.39Å; S113-L309 PolarHBondContact OG-O 3.35Å; F212-L309 HydrophobicContact CD2-CD2 4Å; F212-L309 HydrophobicContact CE2-CD2 3.29Å; F212-L309 HydrophobicContact CZ-CD2 3.84Å; M305-L309 HydrophobicContact CG-CD1 3.96Å; M305-L309 HydrophobicContact CG-CG 4.38Å; M305-L309 WeakPolarHBondContact O-CG 3.2Å; M305-L309 PolarHBondContact O-N 3.19Å; L309-S311 VanDerWaalsContact C-N 3.31Å; L309-S311 PolarHBondContact O-N 3.12Å
310	S	93.4	Very high	94.5	Very high	19 Å²	19	32.1 Å²	32.1	13%	0.133	17%	0.172	C	C	.	.	H	α-helix	trans	-75.8	-21	-178.1	-51.6	0	0	0	0	113.2	L109 D306 Y366	L109-S310 WeakPolarHBondContact CD1-OG 3.27Å; D306-S310 WeakPolarHBondContact O-CB 3.47Å; D306-S310 PolarHBondContact O-N 3.23Å; D306-S310 PolarHBondContact O-OG 2.88Å; S310-Y366 WeakPolarHBondContact CB-OH 3.17Å
311	S	94.4	Very high	94.6	Very high	12 Å²	12	32.6 Å²	32.6	8%	0.084	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-4.9	-179.6	66.4	0	0	0	0	114.3	V307 V308 L309 I314 R315	V307-S311 WeakPolarHBondContact O-CB 3.43Å; V307-S311 PolarHBondContact O-N 2.91Å; V307-S311 PolarHBondContact O-OG 3.09Å; V308-S311 PolarHBondContact O-N 3.47Å; V308-S311 PolarHBondContact O-OG 3.39Å; V308-S311 VanDerWaalsContact O-OG 3.13Å; L309-S311 VanDerWaalsContact C-N 3.31Å; L309-S311 PolarHBondContact O-N 3.12Å; S311-I314 WeakPolarHBondContact O-CG2 3.32Å; S311-I314 PolarHBondContact O-N 3.37Å; S311-R315 WeakPolarHBondContact O-CG 3.38Å; S311-R315 PolarHBondContact O-N 3.45Å
312	I	96.8	Very high	94.7	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-50.9	-51.4	180	-68.6	169.7	0	0	0	112.5	Y139 L142 M204 V208 I314 R315 I316	Y139-I312 HydrophobicContact CE2-CG2 3.91Å; Y139-I312 WeakPolarHBondContact OH-CB 3.19Å; Y139-I312 VanDerWaalsContact OH-CG2 3.28Å; Y139-I312 WeakPolarHBondContact OH-CG2 3.27Å; L142-I312 HydrophobicContact CD1-CD1 4.21Å; M204-I312 HydrophobicContact CE-CB 4.32Å; M204-I312 HydrophobicContact CE-CG1 4.25Å; M204-I312 HydrophobicContact CE-CG2 3.61Å; V208-I312 HydrophobicContact CG2-CD1 4.1Å; V208-I312 HydrophobicContact CG2-CG1 3.99Å; I312-I314 PolarHBondContact O-N 3.32Å; I312-R315 PolarHBondContact O-N 3.02Å; I312-I316 HydrophobicContact CG2-CD1 3.92Å; I312-I316 WeakPolarHBondContact O-CG1 3.45Å; I312-I316 PolarHBondContact O-N 3.17Å
313	P	96.3	Very high	95	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.006	12%	0.116	C	C	.	.	H	α-helix	trans	-61.7	-42	-178.8	-26.4	38	0	0	0	113.3	S113 L117 V120 L121 Y139 I316 Y317	S113-P313 WeakPolarHBondContact O-CG 3.36Å; S113-P313 WeakPolarHBondContact OG-CD 3.26Å; L117-P313 HydrophobicContact CD2-CB 3.95Å; L117-P313 HydrophobicContact CD2-CG 3.95Å; L117-P313 HydrophobicContact CG-CG 4.27Å; V120-P313 HydrophobicContact CB-CB 3.91Å; V120-P313 HydrophobicContact CG1-CB 3.92Å; V120-P313 HydrophobicContact CG2-CB 4.2Å; L121-P313 WeakPolarHBondContact CD2-O 3.39Å; Y139-P313 WeakPolarHBondContact OH-CD 3.4Å; Y139-P313 WeakPolarHBondContact OH-CG 3.44Å; P313-I316 WeakPolarHBondContact O-CB 3.38Å; P313-I316 PolarHBondContact O-N 3.02Å; P313-Y317 PolarHBondContact O-N 3.11Å
314	I	94.8	Very high	95.2	Very high	23 Å²	23	24.8 Å²	24.8	12%	0.118	12%	0.117	C	C	.	.	H	α-helix	trans	-72	-33.8	-178.4	-175.1	65.5	0	0	0	111.2	V120 S311 I312 I316 Y317 E318 Y366	V120-I314 HydrophobicContact CG1-CB 4.11Å; V120-I314 HydrophobicContact CG1-CD1 4.16Å; S311-I314 WeakPolarHBondContact O-CG2 3.32Å; S311-I314 PolarHBondContact O-N 3.37Å; I312-I314 PolarHBondContact O-N 3.32Å; I314-I316 VanDerWaalsContact C-N 3.34Å; I314-Y317 HydrophobicContact CD1-CD1 4.07Å; I314-Y317 WeakPolarHBondContact O-CB 3.45Å; I314-Y317 PolarHBondContact O-N 2.97Å; I314-E318 HydrophobicContact CG1-CG 4.42Å; I314-E318 WeakPolarHBondContact O-CB 3.37Å; I314-E318 VanDerWaalsContact O-CG 3.28Å; I314-E318 WeakPolarHBondContact O-CG 3.43Å; I314-E318 PolarHBondContact O-N 2.93Å; I314-Y366 HydrophobicContact CG2-CD2 3.99Å; I314-Y366 HydrophobicContact CG2-CG 4.15Å
315	R	96.8	Very high	95.3	Very high	86 Å²	86	28.7 Å²	28.7	33%	0.325	13%	0.133	S	C	.	.	H	α-helix	trans	-63.5	-40.5	171.4	-66.2	-48.7	-179.8	-175.2	-2.1	111.8	V200 M204 S311 I312 E318 A319	V200-R315 HydrophobicContact CG1-CB 4Å; V200-R315 VanDerWaalsContact CG1-O 3.31Å; V200-R315 WeakPolarHBondContact CG1-O 3.21Å; M204-R315 HydrophobicContact SD-CB 3.77Å; S311-R315 WeakPolarHBondContact O-CG 3.38Å; S311-R315 PolarHBondContact O-N 3.45Å; I312-R315 PolarHBondContact O-N 3.02Å; R315-E318 WeakPolarHBondContact CD-OE2 3.42Å; R315-E318 IonicContact CZ-OE2 2.95Å; R315-E318 IonicContact NE-OE2 2.73Å; R315-E318 IonicContact NH1-OE1 2.83Å; R315-E318 IonicContact NH1-OE2 3.78Å; R315-E318 PolarHBondContact NH1-OE2 2.91Å; R315-E318 PolarHBondContact O-N 3.44Å; R315-A319 WeakPolarHBondContact O-CB 3.44Å; R315-A319 PolarHBondContact O-N 2.91Å
316	I	97.3	Very high	95.3	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-61.2	-46.4	173.4	-66.7	166	0	0	0	110.4	L121 F135 L138 F160 W161 L164 M204 I312 P313 I314 A319 V320	L121-I316 HydrophobicContact CD1-CG2 4.21Å; L121-I316 HydrophobicContact CD2-CB 4.28Å; L121-I316 HydrophobicContact CD2-CG2 3.98Å; F135-I316 HydrophobicContact CD1-CD1 4.37Å; F135-I316 HydrophobicContact CD1-CG2 4.22Å; F135-I316 HydrophobicContact CE1-CG2 3.64Å; L138-I316 HydrophobicContact CD2-CD1 4.06Å; F160-I316 HydrophobicContact CE1-CD1 4.26Å; F160-I316 HydrophobicContact CE1-CG1 4.13Å; F160-I316 HydrophobicContact CZ-CD1 3.76Å; F160-I316 HydrophobicContact CZ-CG1 3.96Å; F160-I316 HydrophobicContact CZ-CG2 4.34Å; W161-I316 HydrophobicContact CH2-CG1 4.15Å; L164-I316 HydrophobicContact CD2-CG2 4.24Å; M204-I316 HydrophobicContact CE-CD1 4.48Å; M204-I316 HydrophobicContact CE-CG1 4.35Å; M204-I316 HydrophobicContact SD-CG1 4.35Å; I312-I316 HydrophobicContact CG2-CD1 3.92Å; I312-I316 WeakPolarHBondContact O-CG1 3.45Å; I312-I316 PolarHBondContact O-N 3.17Å; P313-I316 WeakPolarHBondContact O-CB 3.38Å; P313-I316 PolarHBondContact O-N 3.02Å; I314-I316 VanDerWaalsContact C-N 3.34Å; I316-A319 PolarHBondContact O-N 3.4Å; I316-V320 WeakPolarHBondContact O-CG2 3.44Å; I316-V320 PolarHBondContact O-N 3.29Å
317	Y	96.4	Very high	95.3	Very high	42 Å²	42	32 Å²	32	17%	0.165	15%	0.15	C	C	.	.	H	α-helix	trans	-58	-50.9	176.1	179.2	-97.3	0	0	0	112.3	P123 L124 P313 I314 A319 V320 H321	P123-Y317 HydrophobicContact CB-CE2 3.95Å; P123-Y317 HydrophobicContact CG-CE2 4.25Å; L124-Y317 HydrophobicContact CD1-CD2 4.36Å; L124-Y317 HydrophobicContact CD2-CD2 3.72Å; L124-Y317 HydrophobicContact CD2-CE2 3.71Å; L124-Y317 HydrophobicContact CG-CD2 3.86Å; L124-Y317 HydrophobicContact CG-CE2 4.13Å; P313-Y317 PolarHBondContact O-N 3.11Å; I314-Y317 HydrophobicContact CD1-CD1 4.07Å; I314-Y317 WeakPolarHBondContact O-CB 3.45Å; I314-Y317 PolarHBondContact O-N 2.97Å; Y317-A319 VanDerWaalsContact C-N 3.33Å; Y317-A319 PolarHBondContact O-N 3.22Å; Y317-V320 PolarHBondContact O-N 3Å; Y317-H321 HydrophobicContact CE1-CB 4.4Å; Y317-H321 VanDerWaalsContact O-CB 3.31Å; Y317-H321 WeakPolarHBondContact O-CB 3.33Å; Y317-H321 PolarHBondContact O-N 3.33Å
318	E	95.7	Very high	95.3	Very high	31 Å²	31	37.4 Å²	37.4	15%	0.145	18%	0.178	C	C	.	.	H	α-helix	trans	-58.4	-43.4	179.6	-75.4	176.1	158.2	0	0	111.9	I314 R315 H321 Y322	I314-E318 HydrophobicContact CG1-CG 4.42Å; I314-E318 WeakPolarHBondContact O-CB 3.37Å; I314-E318 VanDerWaalsContact O-CG 3.28Å; I314-E318 WeakPolarHBondContact O-CG 3.43Å; I314-E318 PolarHBondContact O-N 2.93Å; R315-E318 WeakPolarHBondContact CD-OE2 3.42Å; R315-E318 IonicContact CZ-OE2 2.95Å; R315-E318 IonicContact NE-OE2 2.73Å; R315-E318 IonicContact NH1-OE1 2.83Å; R315-E318 IonicContact NH1-OE2 3.78Å; R315-E318 PolarHBondContact NH1-OE2 2.91Å; R315-E318 PolarHBondContact O-N 3.44Å; E318-H321 PolarHBondContact O-N 3.22Å; E318-Y322 VanDerWaalsContact O-CB 3.28Å; E318-Y322 WeakPolarHBondContact O-CB 3.48Å; E318-Y322 PolarHBondContact O-N 3.3Å
319	A	96.9	Very high	95.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58.9	-52.6	176.1	0	0	0	0	0	111.2	W161 F197 V200 R315 I316 Y317 H321 Y322 L323	W161-A319 HydrophobicContact CH2-CB 3.82Å; W161-A319 HydrophobicContact CZ3-CB 3.59Å; F197-A319 HydrophobicContact CB-CB 3.97Å; F197-A319 HydrophobicContact CD1-CB 4.07Å; F197-A319 WeakPolarHBondContact CD1-O 3.48Å; F197-A319 HydrophobicContact CG-CB 4.2Å; V200-A319 HydrophobicContact CB-CB 4.04Å; V200-A319 HydrophobicContact CG1-CB 3.9Å; R315-A319 WeakPolarHBondContact O-CB 3.44Å; R315-A319 PolarHBondContact O-N 2.91Å; I316-A319 PolarHBondContact O-N 3.4Å; Y317-A319 VanDerWaalsContact C-N 3.33Å; Y317-A319 PolarHBondContact O-N 3.22Å; A319-H321 PolarHBondContact O-N 3.27Å; A319-Y322 WeakPolarHBondContact O-CB 3.45Å; A319-Y322 PolarHBondContact O-N 3.05Å; A319-L323 PolarHBondContact O-N 3.04Å
320	V	96.2	Very high	95.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-62.8	-44.1	-179.4	173.9	0	0	0	0	111.1	L124 L127 L164 T168 F197 I316 Y317 Y322 L323 Q324	L124-V320 HydrophobicContact CD1-CB 4.16Å; L124-V320 HydrophobicContact CD1-CG1 4.04Å; L124-V320 HydrophobicContact CD1-CG2 4.29Å; L124-V320 HydrophobicContact CD2-CB 4.15Å; L124-V320 HydrophobicContact CD2-CG1 3.64Å; L124-V320 HydrophobicContact CG-CG1 4.44Å; L127-V320 HydrophobicContact CD2-CG1 3.45Å; L127-V320 VanDerWaalsContact CD2-CG1 3.45Å; L164-V320 HydrophobicContact CD1-CG2 4.38Å; L164-V320 HydrophobicContact CD2-CG2 3.88Å; L164-V320 HydrophobicContact CG-CG2 4.3Å; T168-V320 HydrophobicContact CG2-CG1 4.41Å; F197-V320 HydrophobicContact CE1-CG2 4.45Å; I316-V320 WeakPolarHBondContact O-CG2 3.44Å; I316-V320 PolarHBondContact O-N 3.29Å; Y317-V320 PolarHBondContact O-N 3Å; V320-Y322 VanDerWaalsContact C-N 3.34Å; V320-Y322 PolarHBondContact O-N 3.31Å; V320-L323 PolarHBondContact O-N 3.26Å; V320-Q324 HydrophobicContact CG1-CG 4.4Å; V320-Q324 WeakPolarHBondContact O-CG 3.42Å; V320-Q324 PolarHBondContact O-N 3.29Å
321	H	94.4	Very high	95.2	Very high	67 Å²	67	41.5 Å²	41.5	31%	0.31	20%	0.202	S	C	.	.	H	α-helix	trans	-60	-44.4	176.9	-173.7	-84.1	0	0	0	111.5	Y317 E318 A319 L323 Q324 E325	Y317-H321 HydrophobicContact CE1-CB 4.4Å; Y317-H321 VanDerWaalsContact O-CB 3.31Å; Y317-H321 WeakPolarHBondContact O-CB 3.33Å; Y317-H321 PolarHBondContact O-N 3.33Å; E318-H321 PolarHBondContact O-N 3.22Å; A319-H321 PolarHBondContact O-N 3.27Å; H321-L323 VanDerWaalsContact C-N 3.34Å; H321-L323 PolarHBondContact O-N 3.19Å; H321-Q324 WeakPolarHBondContact O-CB 3.49Å; H321-Q324 PolarHBondContact O-N 3.4Å; H321-Q324 VanDerWaalsContact O-N 3.16Å; H321-E325 IonicContact CE1-OE1 3.5Å; H321-E325 PolarHBondContact CE1-OE1 3.46Å; H321-E325 VanDerWaalsContact CE1-OE1 3.29Å; H321-E325 IonicContact CE1-OE2 2.69Å; H321-E325 IonicContact ND1-OE1 2.79Å; H321-E325 IonicContact ND1-OE2 3.14Å; H321-E325 PolarHBondContact ND1-OE2 3.33Å; H321-E325 PolarHBondContact O-N 3.41Å
322	Y	95.7	Very high	95.2	Very high	76 Å²	76	43.3 Å²	43.3	30%	0.298	22%	0.217	S	C	.	.	H	α-helix	trans	-58.8	-44.6	175.9	-179.7	-88	0	0	0	112	P196 E318 A319 V320 E325 N326 L361	P196-Y322 WeakPolarHBondContact O-CD1 3.26Å; E318-Y322 VanDerWaalsContact O-CB 3.28Å; E318-Y322 WeakPolarHBondContact O-CB 3.48Å; E318-Y322 PolarHBondContact O-N 3.3Å; A319-Y322 WeakPolarHBondContact O-CB 3.45Å; A319-Y322 PolarHBondContact O-N 3.05Å; V320-Y322 VanDerWaalsContact C-N 3.34Å; V320-Y322 PolarHBondContact O-N 3.31Å; Y322-E325 PolarHBondContact O-N 2.94Å; Y322-N326 PolarHBondContact O-N 2.97Å; Y322-N326 PolarHBondContact O-ND2 3.45Å; Y322-L361 HydrophobicContact CD2-CD1 3.82Å; Y322-L361 HydrophobicContact CE2-CD1 4.14Å
323	L	95.8	Very high	95.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.8	-43.1	175.2	174	55.1	0	0	0	111.3	L165 T168 P196 F197 A319 V320 H321 E325 N326 M327 F330	L165-L323 HydrophobicContact CD1-CD2 3.65Å; T168-L323 HydrophobicContact CG2-CD2 3.7Å; T168-L323 HydrophobicContact CG2-CG 4.33Å; P196-L323 HydrophobicContact CB-CD1 3.66Å; P196-L323 HydrophobicContact CB-CD2 4.31Å; P196-L323 HydrophobicContact CB-CG 4.49Å; P196-L323 WeakPolarHBondContact O-CA 3.35Å; P196-L323 WeakPolarHBondContact O-CB 3.26Å; F197-L323 HydrophobicContact CD1-CB 3.75Å; F197-L323 HydrophobicContact CD1-CD2 3.92Å; F197-L323 HydrophobicContact CD1-CG 4.47Å; F197-L323 HydrophobicContact CE1-CB 3.93Å; F197-L323 HydrophobicContact CE1-CD2 3.37Å; F197-L323 HydrophobicContact CE1-CG 4.29Å; F197-L323 HydrophobicContact CZ-CD2 3.93Å; A319-L323 PolarHBondContact O-N 3.04Å; V320-L323 PolarHBondContact O-N 3.26Å; H321-L323 VanDerWaalsContact C-N 3.34Å; H321-L323 PolarHBondContact O-N 3.19Å; L323-E325 PolarHBondContact O-N 3.34Å; L323-N326 CarbonylContact O-C 3.57Å; L323-N326 PolarHBondContact O-N 3.48Å; L323-N326 VanDerWaalsContact O-N 3.13Å; L323-M327 HydrophobicContact CD1-CE 4.1Å; L323-M327 HydrophobicContact CD1-SD 4.31Å; L323-M327 HydrophobicContact CD2-CE 4.25Å; L323-M327 HydrophobicContact CG-CE 3.73Å; L323-M327 WeakPolarHBondContact O-CA 2.94Å; L323-M327 PolarHBondContact O-N 2.93Å; L323-F330 HydrophobicContact CD1-CB 4.16Å; L323-F330 HydrophobicContact CD1-CD1 3.8Å; L323-F330 HydrophobicContact CD1-CE1 4.41Å; L323-F330 HydrophobicContact CD1-CG 3.98Å
324	Q	93.5	Very high	94.9	Very high	88 Å²	88	47.7 Å²	47.7	41%	0.411	24%	0.236	S	C	.	.	H	α-helix	trans	-60.5	-42.7	178.6	-74.6	176.6	-23.7	0	0	112.3	V320 H321 N326 M327	V320-Q324 HydrophobicContact CG1-CG 4.4Å; V320-Q324 WeakPolarHBondContact O-CG 3.42Å; V320-Q324 PolarHBondContact O-N 3.29Å; H321-Q324 WeakPolarHBondContact O-CB 3.49Å; H321-Q324 PolarHBondContact O-N 3.4Å; H321-Q324 VanDerWaalsContact O-N 3.16Å; Q324-N326 PolarHBondContact O-N 3.43Å; Q324-M327 WeakPolarHBondContact O-CB 3.35Å; Q324-M327 PolarHBondContact O-N 3.09Å
325	E	94.6	Very high	94.8	Very high	106 Å²	106	50.4 Å²	50.4	50%	0.495	25%	0.246	S	C	.	.	H	α-helix	trans	-66	-26	176.3	-71.4	-175.7	131.6	0	0	113.3	H321 Y322 L323	H321-E325 IonicContact CE1-OE1 3.5Å; H321-E325 PolarHBondContact CE1-OE1 3.46Å; H321-E325 VanDerWaalsContact CE1-OE1 3.29Å; H321-E325 IonicContact CE1-OE2 2.69Å; H321-E325 IonicContact ND1-OE1 2.79Å; H321-E325 IonicContact ND1-OE2 3.14Å; H321-E325 PolarHBondContact ND1-OE2 3.33Å; H321-E325 PolarHBondContact O-N 3.41Å; Y322-E325 PolarHBondContact O-N 2.94Å; L323-E325 PolarHBondContact O-N 3.34Å
326	N	95.4	Very high	94.5	Very high	61 Å²	61	53.3 Å²	53.3	33%	0.326	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	13.6	-176.7	-65.7	-81.8	0	0	0	113.2	Y322 L323 Q324 D328 T329 F330	Y322-N326 PolarHBondContact O-N 2.97Å; Y322-N326 PolarHBondContact O-ND2 3.45Å; L323-N326 CarbonylContact O-C 3.57Å; L323-N326 PolarHBondContact O-N 3.48Å; L323-N326 VanDerWaalsContact O-N 3.13Å; Q324-N326 PolarHBondContact O-N 3.43Å; N326-D328 PolarHBondContact O-N 3.05Å; N326-T329 PolarHBondContact O-N 3.07Å; N326-F330 PolarHBondContact O-N 2.8Å
327	M	93.8	Very high	94.3	Very high	20 Å²	20	56.8 Å²	56.8	10%	0.099	28%	0.284	C	S	.	.	H	α-helix	trans	-59.9	-42.9	-168.4	-173.5	61.6	70.4	0	0	113	T168 F169 S172 L323 Q324 T329 F330 T331	T168-M327 HydrophobicContact CG2-CE 4.09Å; F169-M327 HydrophobicContact CD2-SD 4.41Å; S172-M327 PolarHBondContact OG-SD 3.5Å; L323-M327 HydrophobicContact CD1-CE 4.1Å; L323-M327 HydrophobicContact CD1-SD 4.31Å; L323-M327 HydrophobicContact CD2-CE 4.25Å; L323-M327 HydrophobicContact CG-CE 3.73Å; L323-M327 WeakPolarHBondContact O-CA 2.94Å; L323-M327 PolarHBondContact O-N 2.93Å; Q324-M327 WeakPolarHBondContact O-CB 3.35Å; Q324-M327 PolarHBondContact O-N 3.09Å; M327-T329 VanDerWaalsContact C-N 3.33Å; M327-T329 PolarHBondContact O-N 2.87Å; M327-F330 PolarHBondContact O-N 3.29Å; M327-F330 HydrophobicContact SD-CD1 4.43Å; M327-T331 WeakPolarHBondContact O-CB 3.49Å; M327-T331 PolarHBondContact O-N 2.74Å; M327-T331 PolarHBondContact O-OG1 3Å
328	D	93.4	Very high	94	Very high	142 Å²	142	56.1 Å²	56.1	76%	0.759	29%	0.285	S	S	*	.	H	α-helix	trans	-62.1	-42.3	-179.5	-65.2	-26.7	0	0	0	111.7	N326 T331 A332	N326-D328 PolarHBondContact O-N 3.05Å; D328-T331 PolarHBondContact O-N 2.74Å; D328-A332 WeakPolarHBondContact O-CB 3.37Å; D328-A332 PolarHBondContact O-N 3.39Å
329	T	94.4	Very high	93.6	Very high	81 Å²	81	56.1 Å²	56.1	50%	0.497	29%	0.294	S	S	.	.	H	α-helix	trans	-68.9	-40.7	179.3	-58.5	0	0	0	0	110.7	N326 M327 K333	N326-T329 PolarHBondContact O-N 3.07Å; M327-T329 VanDerWaalsContact C-N 3.33Å; M327-T329 PolarHBondContact O-N 2.87Å; T329-K333 WeakPolarHBondContact O-CG 3.47Å; T329-K333 PolarHBondContact O-N 3.29Å
330	F	94.8	Very high	93	Very high	11 Å²	11	59.2 Å²	59.2	5%	0.048	32%	0.315	C	S	.	.	H	α-helix	trans	-63.1	-48.9	175.6	177.7	-113.4	0	0	0	111.2	L165 F169 V187 L194 P196 L323 N326 M327 A332 K333 V334	L165-F330 HydrophobicContact CD1-CE1 3.89Å; L165-F330 HydrophobicContact CD1-CZ 3.85Å; L165-F330 HydrophobicContact CD2-CZ 4.27Å; L165-F330 HydrophobicContact CG-CZ 4.46Å; F169-F330 HydrophobicContact CD2-CD1 4.01Å; F169-F330 AromaticContact CD2-CE1 3.7Å; F169-F330 HydrophobicContact CD2-CE1 3.7Å; F169-F330 HydrophobicContact CE2-CD1 4.33Å; F169-F330 HydrophobicContact CE2-CE1 4.21Å; V187-F330 HydrophobicContact CG1-CE1 4.17Å; V187-F330 HydrophobicContact CG1-CZ 4.03Å; L194-F330 HydrophobicContact CB-CD2 4.33Å; L194-F330 HydrophobicContact CB-CE2 4.09Å; L194-F330 HydrophobicContact CD1-CD2 4.23Å; L194-F330 HydrophobicContact CD1-CE2 3.92Å; P196-F330 HydrophobicContact CB-CD2 3.77Å; P196-F330 HydrophobicContact CB-CE1 4.34Å; P196-F330 HydrophobicContact CB-CE2 3.6Å; P196-F330 HydrophobicContact CB-CG 4.23Å; P196-F330 HydrophobicContact CB-CZ 3.9Å; P196-F330 HydrophobicContact CG-CE2 3.9Å; P196-F330 HydrophobicContact CG-CZ 4.12Å; L323-F330 HydrophobicContact CD1-CB 4.16Å; L323-F330 HydrophobicContact CD1-CD1 3.8Å; L323-F330 HydrophobicContact CD1-CE1 4.41Å; L323-F330 HydrophobicContact CD1-CG 3.98Å; N326-F330 PolarHBondContact O-N 2.8Å; M327-F330 PolarHBondContact O-N 3.29Å; M327-F330 HydrophobicContact SD-CD1 4.43Å; F330-A332 VanDerWaalsContact C-N 3.34Å; F330-A332 PolarHBondContact O-N 3.18Å; F330-K333 PolarHBondContact O-N 3.49Å; F330-K333 VanDerWaalsContact O-N 3.09Å; F330-V334 HydrophobicContact CD1-CG2 4.13Å; F330-V334 HydrophobicContact CD2-CG2 4.13Å; F330-V334 HydrophobicContact CE1-CG2 3.69Å; F330-V334 HydrophobicContact CE2-CG2 3.68Å; F330-V334 HydrophobicContact CG-CG2 4.34Å; F330-V334 HydrophobicContact CZ-CG2 3.45Å; F330-V334 VanDerWaalsContact CZ-CG2 3.45Å; F330-V334 WeakPolarHBondContact O-CG2 3.27Å; F330-V334 PolarHBondContact O-N 3.18Å
331	T	92.9	Very high	91.9	Very high	23 Å²	23	60.7 Å²	60.7	14%	0.141	33%	0.325	C	S	.	.	H	α-helix	trans	-58.9	-43.7	-180	-56.6	0	0	0	0	111.7	F169 M327 D328 K333 V334 Y335	F169-T331 HydrophobicContact CE2-CG2 4.18Å; F169-T331 HydrophobicContact CZ-CG2 4.33Å; M327-T331 WeakPolarHBondContact O-CB 3.49Å; M327-T331 PolarHBondContact O-N 2.74Å; M327-T331 PolarHBondContact O-OG1 3Å; D328-T331 PolarHBondContact O-N 2.74Å; T331-K333 VanDerWaalsContact C-N 3.33Å; T331-K333 PolarHBondContact O-N 3.06Å; T331-V334 PolarHBondContact O-N 3.07Å; T331-Y335 HydrophobicContact CG2-CD1 4.38Å; T331-Y335 HydrophobicContact CG2-CD2 4.28Å; T331-Y335 HydrophobicContact CG2-CE1 3.78Å; T331-Y335 HydrophobicContact CG2-CE2 3.68Å; T331-Y335 PolarHBondContact O-N 2.96Å
332	A	93.3	Very high	90.4	Very high	50 Å²	50	61.2 Å²	61.2	41%	0.413	35%	0.348	S	S	.	.	H	α-helix	trans	-60.4	-40.1	176	0	0	0	0	0	112.9	D328 F330 Q336	D328-A332 WeakPolarHBondContact O-CB 3.37Å; D328-A332 PolarHBondContact O-N 3.39Å; F330-A332 VanDerWaalsContact C-N 3.34Å; F330-A332 PolarHBondContact O-N 3.18Å; A332-Q336 WeakPolarHBondContact O-CG 3.32Å; A332-Q336 PolarHBondContact O-N 3.35Å
333	K	94.3	Very high	88.1	Confident	95 Å²	95	64.6 Å²	64.6	41%	0.413	37%	0.367	S	S	.	.	H	α-helix	trans	-71.1	-38.5	176.1	-68.8	-178.3	-170.4	176.6	0	112	L194 T329 F330 T331 Y335 Q336 T337	L194-K333 HydrophobicContact CD1-CB 3.89Å; L194-K333 HydrophobicContact CD2-CB 4.34Å; L194-K333 HydrophobicContact CD2-CD 4Å; T329-K333 WeakPolarHBondContact O-CG 3.47Å; T329-K333 PolarHBondContact O-N 3.29Å; F330-K333 PolarHBondContact O-N 3.49Å; F330-K333 VanDerWaalsContact O-N 3.09Å; T331-K333 VanDerWaalsContact C-N 3.33Å; T331-K333 PolarHBondContact O-N 3.06Å; K333-Y335 VanDerWaalsContact C-N 3.32Å; K333-Y335 PolarHBondContact O-N 2.74Å; K333-Q336 WeakPolarHBondContact O-CB 3.46Å; K333-Q336 PolarHBondContact O-N 3.28Å; K333-Q336 VanDerWaalsContact O-N 3.15Å; K333-T337 PolarHBondContact O-N 3.46Å; K333-T337 VanDerWaalsContact O-N 3.07Å; K333-T337 PolarHBondContact O-OG1 2.84Å
334	V	93.3	Very high	85.5	Confident	0 Å²	0	71 Å²	71	0%	0	41%	0.408	C	S	.	.	H	α-helix	trans	-60.4	-43	174.5	167.5	0	0	0	0	110.7	F169 Y183 V187 L194 F330 T331 Q336 T337 C338	F169-V334 HydrophobicContact CE2-CG1 4.43Å; F169-V334 HydrophobicContact CZ-CG1 4.14Å; Y183-V334 HydrophobicContact CE1-CG1 4.39Å; Y183-V334 WeakPolarHBondContact OH-CG1 3.5Å; V187-V334 HydrophobicContact CG2-CG1 3.71Å; L194-V334 HydrophobicContact CD1-CG2 4.32Å; F330-V334 HydrophobicContact CD1-CG2 4.13Å; F330-V334 HydrophobicContact CD2-CG2 4.13Å; F330-V334 HydrophobicContact CE1-CG2 3.69Å; F330-V334 HydrophobicContact CE2-CG2 3.68Å; F330-V334 HydrophobicContact CG-CG2 4.34Å; F330-V334 HydrophobicContact CZ-CG2 3.45Å; F330-V334 VanDerWaalsContact CZ-CG2 3.45Å; F330-V334 WeakPolarHBondContact O-CG2 3.27Å; F330-V334 PolarHBondContact O-N 3.18Å; T331-V334 PolarHBondContact O-N 3.07Å; V334-Q336 PolarHBondContact O-N 2.89Å; V334-T337 PolarHBondContact O-N 2.93Å; V334-T337 VanDerWaalsContact O-N 3.13Å; V334-T337 PolarHBondContact O-OG1 3.06Å; V334-C338 HydrophobicContact CG1-CB 4.22Å; V334-C338 WeakPolarHBondContact O-CA 3.44Å; V334-C338 WeakPolarHBondContact O-CB 3.43Å; V334-C338 PolarHBondContact O-N 3.36Å
335	Y	91.8	Very high	83.3	Confident	80 Å²	80	69.4 Å²	69.4	31%	0.314	42%	0.415	S	S	.	.	H	α-helix	trans	-64.2	-29.5	176.8	-65.6	-11.4	0	0	0	112.8	F169 Y183 T331 K333 G339 P341	F169-Y335 HydrophobicContact CZ-CE1 4.39Å; Y183-Y335 VanDerWaalsContact OH-CD1 3.27Å; Y183-Y335 WeakPolarHBondContact OH-CD1 3.17Å; Y183-Y335 WeakPolarHBondContact OH-CE1 3.48Å; T331-Y335 HydrophobicContact CG2-CD1 4.38Å; T331-Y335 HydrophobicContact CG2-CD2 4.28Å; T331-Y335 HydrophobicContact CG2-CE1 3.78Å; T331-Y335 HydrophobicContact CG2-CE2 3.68Å; T331-Y335 PolarHBondContact O-N 2.96Å; K333-Y335 VanDerWaalsContact C-N 3.32Å; K333-Y335 PolarHBondContact O-N 2.74Å; Y335-G339 CarbonylContact O-C 3.58Å; Y335-G339 WeakPolarHBondContact O-CA 3.39Å; Y335-G339 PolarHBondContact O-N 3.18Å; Y335-G339 VanDerWaalsContact O-N 3.14Å; Y335-P341 HydrophobicContact CD1-CG 4.31Å; Y335-P341 HydrophobicContact CE1-CG 3.54Å
336	Q	91.1	Very high	80.9	Confident	146 Å²	146	71.4 Å²	71.4	68%	0.682	44%	0.435	S	S	*	.	H	α-helix	trans	-72.9	-33.2	174.3	-68.5	170.3	12.1	0	0	112.9	A332 K333 V334	A332-Q336 WeakPolarHBondContact O-CG 3.32Å; A332-Q336 PolarHBondContact O-N 3.35Å; K333-Q336 WeakPolarHBondContact O-CB 3.46Å; K333-Q336 PolarHBondContact O-N 3.28Å; K333-Q336 VanDerWaalsContact O-N 3.15Å; V334-Q336 PolarHBondContact O-N 2.89Å
337	T	91.7	Very high	78.1	Confident	74 Å²	74	72.2 Å²	72.2	45%	0.454	46%	0.458	S	S	.	.	H	α-helix	trans	-95.8	-42.5	-175.1	54.1	0	0	0	0	113.5	K333 V334	K333-T337 PolarHBondContact O-N 3.46Å; K333-T337 VanDerWaalsContact O-N 3.07Å; K333-T337 PolarHBondContact O-OG1 2.84Å; V334-T337 PolarHBondContact O-N 2.93Å; V334-T337 VanDerWaalsContact O-N 3.13Å; V334-T337 PolarHBondContact O-OG1 3.06Å
338	C	90.8	Very high	75.5	Confident	28 Å²	28	76.9 Å²	76.9	19%	0.189	49%	0.492	C	S	.	.	H	α-helix	trans	-99.1	-12.2	-178.2	-64.2	0	0	0	0	113.8	Y183 C186 V334	Y183-C338 HydrophobicContact CD2-CB 4.49Å; Y183-C338 HydrophobicContact CE2-CB 3.94Å; C186-C338 HydrophobicContact CB-CB 3.93Å; C186-C338 WeakPolarHBondContact CB-SG 3.33Å; C186-C338 VanDerWaalsContact SG-CA 3.5Å; C186-C338 WeakPolarHBondContact SG-CB 3.46Å; C186-C338 CovalentContact SG-SG 2.05Å; C186-C338 PolarHBondContact SG-SG 3.4Å; V334-C338 HydrophobicContact CG1-CB 4.22Å; V334-C338 WeakPolarHBondContact O-CA 3.44Å; V334-C338 WeakPolarHBondContact O-CB 3.43Å; V334-C338 PolarHBondContact O-N 3.36Å
339	G	88.1	Confident	73.5	Confident	31 Å²	31	75 Å²	75	32%	0.32	49%	0.488	S	S	.	.			trans	92	167.7	-176.5	0	0	0	0	0	113.6	Y183 Y335	Y183-G339 VanDerWaalsContact CE2-O 3.32Å; Y183-G339 WeakPolarHBondContact CE2-O 3.36Å; Y183-G339 PolarHBondContact OH-O 2.91Å; Y183-G339 VanDerWaalsContact OH-O 3.08Å; Y335-G339 CarbonylContact O-C 3.58Å; Y335-G339 WeakPolarHBondContact O-CA 3.39Å; Y335-G339 PolarHBondContact O-N 3.18Å; Y335-G339 VanDerWaalsContact O-N 3.14Å
340	S	82.9	Confident	70.5	Confident	64 Å²	64	78.4 Å²	78.4	45%	0.448	50%	0.503	S	S	.	.			trans	-78.8	133.5	177.5	-66.3	0	0	0	0	111.2	G342	S340-G342 PolarHBondContact O-N 3.37Å
341	P	73.9	Confident	68	Low	32 Å²	32	82.2 Å²	82.2	21%	0.208	54%	0.537	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	123.5	175.5	-23.8	32.8	0	0	0	111.7	V177 L179 Y183 Y335	V177-P341 HydrophobicContact CG1-CB 3.35Å; V177-P341 HydrophobicContact CG1-CG 4.12Å; L179-P341 HydrophobicContact CD2-CB 3.92Å; L179-P341 HydrophobicContact CD2-CG 3.87Å; Y183-P341 HydrophobicContact CE1-CG 4.31Å; Y183-P341 HydrophobicContact CE2-CG 4.36Å; Y335-P341 HydrophobicContact CD1-CG 4.31Å; Y335-P341 HydrophobicContact CE1-CG 3.54Å
342	G	62.5	Low	65.2	Low	77 Å²	77	89.4 Å²	89.4	79%	0.794	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	99.6	-0.9	174	0	0	0	0	0	116.7	S340	S340-G342 PolarHBondContact O-N 3.37Å
343	E	47.9	Very low	62.6	Low	148 Å²	148	95.1 Å²	95.1	69%	0.692	59%	0.586	S	S	*	*			trans	-101.6	120.6	168.3	-77.6	-167.7	148.5	0	0	111.6	G345	E343-G345 VanDerWaalsContact C-N 3.35Å; E343-G345 PolarHBondContact O-N 3.18Å
344	P	41.8	Very low	59.7	Low	134 Å²	134	98.4 Å²	98.4	87%	0.87	60%	0.603	S	S	*	*			trans	-74.5	91.4	170.2	29.9	-29.3	0	0	0	109.2
345	G	46.6	Very low	57.3	Low	54 Å²	54	108.2 Å²	108.2	56%	0.557	65%	0.646	S	S	*	*	S	Bend	trans	79.7	141.2	160.4	0	0	0	0	0	117	E343	E343-G345 VanDerWaalsContact C-N 3.35Å; E343-G345 PolarHBondContact O-N 3.18Å
346	T	44.7	Very low	54.4	Low	149 Å²	149	113.4 Å²	113.4	91%	0.914	67%	0.67	S	S	*	*			trans	70.1	114.8	163.2	52.8	0	0	0	0	119.1
347	G	35.3	Very low	51.8	Low	78 Å²	78	116.5 Å²	116.5	80%	0.804	68%	0.681	S	S	*	*			trans	142.3	101.3	145.1	0	0	0	0	0	116.5
348	S	39.1	Very low	48.9	Very low	118 Å²	118	118.1 Å²	118.1	83%	0.825	70%	0.695	S	S	*	*			trans	-59.5	160.9	150.3	-132.2	0	0	0	0	109.6
349	P	52.9	Low	46.1	Very low	103 Å²	103	119.5 Å²	119.5	67%	0.669	72%	0.715	S	S	*	*			cis	-153.5	179.9	38.6	41.5	-18.8	0	0	0	119.2
350	N	31.3	Very low	43.7	Very low	152 Å²	152	124 Å²	124	81%	0.813	74%	0.741	S	S	*	*			trans	107.7	113.7	147.1	-71.2	-16.7	0	0	0	120.1
351	A	42.4	Very low	41.5	Very low	91 Å²	91	125.5 Å²	125.5	75%	0.752	74%	0.744	S	S	*	*			trans	-69.7	132.9	171.6	0	0	0	0	0	111.8
352	H	32.9	Very low	39.6	Very low	174 Å²	174	130.4 Å²	130.4	81%	0.806	77%	0.773	S	S	*	*			trans	-123.8	106.8	154.2	-145.2	-55.1	0	0	0	108.3	Q354	H352-Q354 PolarHBondContact O-N 2.99Å
353	E	39.3	Very low	38.5	Very low	170 Å²	170	129.8 Å²	129.8	79%	0.794	76%	0.761	S	S	*	*			trans	-65.2	127.2	169.9	-71.4	-175.1	124.1	0	0	109.3
354	Q	33.7	Very low	38.2	Very low	163 Å²	163	130.2 Å²	130.2	76%	0.762	76%	0.761	S	S	*	*			trans	-129.7	104.6	151	-76.5	-166.7	1.3	0	0	108.8	H352 K356	H352-Q354 PolarHBondContact O-N 2.99Å; Q354-K356 PolarHBondContact O-N 3.33Å
355	K	41.8	Very low	38.2	Very low	207 Å²	207	131.3 Å²	131.3	90%	0.9	75%	0.754	S	S	*	*			trans	-64.1	114.8	160.8	-89.3	173.1	173.1	165.4	0	108.5
356	K	32	Very low	38.6	Very low	189 Å²	189	132.2 Å²	132.2	82%	0.822	74%	0.741	S	S	*	*			trans	-119.5	130.5	153.2	-91.5	-178	177.6	174.6	0	109.7	Q354 S358	Q354-K356 PolarHBondContact O-N 3.33Å; K356-S358 PolarHBondContact O-N 2.9Å
357	K	36.3	Very low	39.2	Very low	210 Å²	210	133.1 Å²	133.1	91%	0.913	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-59.2	124.4	-179.8	-78.1	174.1	169.4	178	0	109.8	G359	K357-G359 PolarHBondContact O-N 3.32Å
358	S	31.4	Very low	40.5	Very low	108 Å²	108	132.5 Å²	132.5	76%	0.755	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-57.5	116.4	163.3	-169.7	0	0	0	0	108.6	K356	K356-S358 PolarHBondContact O-N 2.9Å
359	G	30.5	Very low	41.8	Very low	58 Å²	58	129.5 Å²	129.5	60%	0.598	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-67.4	138.2	161.2	0	0	0	0	0	108.5	K357 L361	K357-G359 PolarHBondContact O-N 3.32Å; G359-L361 PolarHBondContact O-N 2.93Å
360	S	38	Very low	42.6	Very low	125 Å²	125	129.9 Å²	129.9	87%	0.874	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-60.3	116.1	173.9	-174.3	0	0	0	0	109.2	T362	S360-T362 PolarHBondContact O-N 2.93Å
361	L	37.5	Very low	44.7	Very low	95 Å²	95	127.5 Å²	127.5	50%	0.497	69%	0.687	S	S	.	*	P	Polyproline II helix	trans	-67.2	125	171	-73.2	160.8	0	0	0	108.7	Y322 G359 A363	Y322-L361 HydrophobicContact CD2-CD1 3.82Å; Y322-L361 HydrophobicContact CE2-CD1 4.14Å; G359-L361 PolarHBondContact O-N 2.93Å; L361-A363 PolarHBondContact O-N 3.46Å
362	T	34.3	Very low	46.3	Very low	135 Å²	135	124.2 Å²	124.2	83%	0.828	66%	0.66	S	S	*	*			trans	-70.7	104.6	159.1	46.8	0	0	0	0	106.7	S360 F364	S360-T362 PolarHBondContact O-N 2.93Å; T362-F364 PolarHBondContact O-N 2.88Å
363	A	39.5	Very low	48.5	Very low	64 Å²	64	117.2 Å²	117.2	53%	0.529	64%	0.635	S	S	.	*			trans	-50.9	135.5	172.1	0	0	0	0	0	109.3	L361 E365	L361-A363 PolarHBondContact O-N 3.46Å; A363-E365 PolarHBondContact O-N 3.18Å
364	F	40.2	Very low	50.7	Low	157 Å²	157	113.7 Å²	113.7	69%	0.689	62%	0.621	S	S	*	*			trans	-64.2	92.2	158.7	-109	-91.2	0	0	0	105.4	T362 Y366	T362-F364 PolarHBondContact O-N 2.88Å; F364-Y366 PolarHBondContact O-N 3.39Å
365	E	43.1	Very low	53.4	Low	157 Å²	157	111.7 Å²	111.7	73%	0.734	61%	0.606	S	S	*	*			trans	-60.3	105.5	176.2	-81.6	-178.1	164.3	0	0	107.9	A363 K367	A363-E365 PolarHBondContact O-N 3.18Å; E365-K367 VanDerWaalsContact C-N 3.35Å; E365-K367 PolarHBondContact O-N 3.43Å
366	Y	54.7	Low	55.7	Low	74 Å²	74	102 Å²	102	29%	0.29	57%	0.565	S	S	.	*			trans	-55.2	105.4	160	174.7	-100.3	0	0	0	106.9	V307 S310 I314 F364 P368	V307-Y366 HydrophobicContact CG1-CD1 4.43Å; V307-Y366 HydrophobicContact CG1-CE1 4.48Å; S310-Y366 WeakPolarHBondContact CB-OH 3.17Å; I314-Y366 HydrophobicContact CG2-CD2 3.99Å; I314-Y366 HydrophobicContact CG2-CG 4.15Å; F364-Y366 PolarHBondContact O-N 3.39Å; Y366-P368 HydrophobicContact CE1-CB 4.43Å; Y366-P368 VanDerWaalsContact O-CD 3.26Å; Y366-P368 WeakPolarHBondContact O-CD 3.47Å
367	K	57.1	Low	58.5	Low	168 Å²	168	98.9 Å²	98.9	73%	0.73	55%	0.553	S	S	*	*			trans	-78.2	114.1	172.3	-75.3	-174.7	178.5	179.5	0	107.3	E365 S369	E365-K367 VanDerWaalsContact C-N 3.35Å; E365-K367 PolarHBondContact O-N 3.43Å; K367-S369 PolarHBondContact O-N 3.26Å
368	P	61.6	Low	61.1	Low	64 Å²	64	93.7 Å²	93.7	42%	0.416	53%	0.534	S	S	.	.			trans	-54.3	138	174.6	-22.3	33.9	0	0	0	109.7	V307 Y366 P370	V307-P368 HydrophobicContact CG2-CB 3.85Å; V307-P368 HydrophobicContact CG2-CG 3.74Å; Y366-P368 HydrophobicContact CE1-CB 4.43Å; Y366-P368 VanDerWaalsContact O-CD 3.26Å; Y366-P368 WeakPolarHBondContact O-CD 3.47Å; P368-P370 VanDerWaalsContact O-CD 3.23Å; P368-P370 WeakPolarHBondContact O-CD 3.31Å
369	S	67.9	Low	64.1	Low	55 Å²	55	90.2 Å²	90.2	39%	0.385	51%	0.506	S	S	.	.			trans	-61.2	119.2	169.3	173.8	0	0	0	0	108.5	K367 T371 A372 G373	K367-S369 PolarHBondContact O-N 3.26Å; S369-T371 PolarHBondContact O-N 2.95Å; S369-T371 VanDerWaalsContact O-N 3.08Å; S369-A372 PolarHBondContact O-N 3.38Å; S369-G373 PolarHBondContact O-N 3.01Å
370	P	68.8	Low	67.2	Low	112 Å²	112	88 Å²	88	73%	0.727	48%	0.481	S	S	*	.	H	α-helix	trans	-57.4	-28.7	179.2	-24.1	33.9	0	0	0	112.2	P368 L374	P368-P370 VanDerWaalsContact O-CD 3.23Å; P368-P370 WeakPolarHBondContact O-CD 3.31Å; P370-L374 PolarHBondContact O-N 3.41Å
371	T	76.2	Confident	69.9	Low	101 Å²	101	85.8 Å²	85.8	62%	0.62	47%	0.465	S	S	*	.	H	α-helix	trans	-71.5	-35.3	176.8	-48	0	0	0	0	112.5	S369 R375	S369-T371 PolarHBondContact O-N 2.95Å; S369-T371 VanDerWaalsContact O-N 3.08Å; T371-R375 WeakPolarHBondContact O-CB 3.33Å; T371-R375 PolarHBondContact O-N 3.04Å
372	A	75.4	Confident	72.6	Confident	22 Å²	22	84.5 Å²	84.5	18%	0.182	46%	0.459	C	S	.	.	H	α-helix	trans	-69.1	-43.3	178.4	0	0	0	0	0	111.4	S369 R375 L376	S369-A372 PolarHBondContact O-N 3.38Å; A372-R375 WeakPolarHBondContact O-CB 3.4Å; A372-R375 PolarHBondContact O-N 3.15Å; A372-L376 PolarHBondContact O-N 2.83Å
373	G	79.2	Confident	75.5	Confident	28 Å²	28	78.1 Å²	78.1	29%	0.289	42%	0.419	S	S	.	.	H	α-helix	trans	-62.3	-44.4	175.8	0	0	0	0	0	112.5	D306 S369 R375 L376 E377	D306-G373 WeakPolarHBondContact OD2-CA 3.25Å; D306-G373 PolarHBondContact OD2-N 3.4Å; S369-G373 PolarHBondContact O-N 3.01Å; G373-R375 VanDerWaalsContact C-N 3.31Å; G373-R375 PolarHBondContact O-N 3.34Å; G373-L376 WeakPolarHBondContact O-CB 3.5Å; G373-L376 PolarHBondContact O-N 2.03Å; G373-E377 PolarHBondContact O-N 3.34Å
374	L	85.7	Confident	78.3	Confident	95 Å²	95	76 Å²	76	50%	0.497	40%	0.401	S	S	.	.	H	α-helix	trans	-62.1	-38.6	174.8	-177.4	65	0	0	0	112.1	P370 L376 E377 I378	P370-L374 PolarHBondContact O-N 3.41Å; L374-L376 VanDerWaalsContact C-N 3.34Å; L374-E377 PolarHBondContact O-N 3.27Å; L374-I378 HydrophobicContact CD1-CD1 4.42Å; L374-I378 HydrophobicContact CG-CD1 4.1Å; L374-I378 VanDerWaalsContact O-CG1 3.3Å; L374-I378 WeakPolarHBondContact O-CG1 3.26Å; L374-I378 PolarHBondContact O-N 3.48Å
375	R	89.5	Confident	81	Confident	122 Å²	122	71.4 Å²	71.4	46%	0.46	39%	0.388	S	S	.	.	H	α-helix	trans	-63.5	-41.5	177	-133.6	177.3	-178.6	-151.6	-3.2	110.8	Y105 E108 T371 A372 G373 Q379	Y105-R375 HydrophobicContact CE2-CB 4.31Å; E108-R375 IonicContact OE2-CZ 2.71Å; E108-R375 IonicContact OE2-NH1 3.69Å; E108-R375 PolarHBondContact OE2-NH1 2.96Å; E108-R375 IonicContact OE2-NH2 2.74Å; T371-R375 WeakPolarHBondContact O-CB 3.33Å; T371-R375 PolarHBondContact O-N 3.04Å; A372-R375 WeakPolarHBondContact O-CB 3.4Å; A372-R375 PolarHBondContact O-N 3.15Å; G373-R375 VanDerWaalsContact C-N 3.31Å; G373-R375 PolarHBondContact O-N 3.34Å; R375-Q379 VanDerWaalsContact O-CG 3.31Å; R375-Q379 WeakPolarHBondContact O-CG 3.48Å; R375-Q379 PolarHBondContact O-N 2.86Å; R375-Q379 VanDerWaalsContact O-N 3.09Å
376	L	90.3	Very high	83.5	Confident	4 Å²	4	67.9 Å²	67.9	2%	0.021	37%	0.37	C	S	.	.	H	α-helix	trans	-63.3	-46.9	175.4	-177.9	58.5	0	0	0	111.5	Y105 F299 D306 A372 G373 L374 I378 Q379 V380	Y105-L376 HydrophobicContact CE1-CD1 3.77Å; Y105-L376 WeakPolarHBondContact OH-CB 3.31Å; F299-L376 HydrophobicContact CB-CD1 4.13Å; F299-L376 WeakPolarHBondContact O-CD2 3.48Å; D306-L376 HydrophobicContact CB-CD2 4.12Å; D306-L376 VanDerWaalsContact OD1-CD2 3.26Å; D306-L376 WeakPolarHBondContact OD1-CD2 3.27Å; A372-L376 PolarHBondContact O-N 2.83Å; G373-L376 WeakPolarHBondContact O-CB 3.5Å; G373-L376 PolarHBondContact O-N 2.03Å; L374-L376 VanDerWaalsContact C-N 3.34Å; L376-I378 VanDerWaalsContact C-N 3.33Å; L376-I378 PolarHBondContact O-N 3.33Å; L376-Q379 WeakPolarHBondContact O-CB 3.48Å; L376-Q379 PolarHBondContact O-N 3.08Å; L376-Q379 VanDerWaalsContact O-N 3.11Å; L376-V380 HydrophobicContact CD1-CG2 3.99Å; L376-V380 HydrophobicContact CG-CG2 4.29Å; L376-V380 WeakPolarHBondContact O-CG2 3.48Å; L376-V380 PolarHBondContact O-N 3.09Å
377	E	91.1	Very high	85.6	Confident	123 Å²	123	64.3 Å²	64.3	58%	0.575	36%	0.356	S	S	*	.	H	α-helix	trans	-58.7	-44.4	179.8	-172.8	-179.2	-176.8	0	0	111.8	G373 L374 Q379 V380 S381	G373-E377 PolarHBondContact O-N 3.34Å; L374-E377 PolarHBondContact O-N 3.27Å; E377-Q379 PolarHBondContact O-N 3.45Å; E377-V380 PolarHBondContact O-N 3.23Å; E377-S381 VanDerWaalsContact O-CB 3.27Å; E377-S381 WeakPolarHBondContact O-CB 3.44Å; E377-S381 PolarHBondContact O-N 3.02Å
378	I	92.3	Very high	87.5	Confident	101 Å²	101	64 Å²	64	52%	0.518	35%	0.351	S	S	.	.	H	α-helix	trans	-61.1	-45.1	174.9	-67.3	166.6	0	0	0	110.7	L374 L376 S381 D382	L374-I378 HydrophobicContact CD1-CD1 4.42Å; L374-I378 HydrophobicContact CG-CD1 4.1Å; L374-I378 VanDerWaalsContact O-CG1 3.3Å; L374-I378 WeakPolarHBondContact O-CG1 3.26Å; L374-I378 PolarHBondContact O-N 3.48Å; L376-I378 VanDerWaalsContact C-N 3.33Å; L376-I378 PolarHBondContact O-N 3.33Å; I378-S381 PolarHBondContact O-N 2.85Å; I378-D382 WeakPolarHBondContact O-CB 3.01Å; I378-D382 PolarHBondContact O-N 3.08Å
379	Q	93.5	Very high	89.2	Confident	34 Å²	34	66.1 Å²	66.1	16%	0.159	36%	0.358	C	S	.	.	H	α-helix	trans	-61.4	-48.1	178	-73.3	-66.5	-47.4	0	0	111.7	S101 Y105 R375 L376 E377 S381 D382 L383	S101-Q379 PolarHBondContact OG-NE2 3.06Å; S101-Q379 PolarHBondContact OG-OE1 2.88Å; Y105-Q379 HydrophobicContact CD2-CG 4.11Å; Y105-Q379 HydrophobicContact CG-CG 4.1Å; R375-Q379 VanDerWaalsContact O-CG 3.31Å; R375-Q379 WeakPolarHBondContact O-CG 3.48Å; R375-Q379 PolarHBondContact O-N 2.86Å; R375-Q379 VanDerWaalsContact O-N 3.09Å; L376-Q379 WeakPolarHBondContact O-CB 3.48Å; L376-Q379 PolarHBondContact O-N 3.08Å; L376-Q379 VanDerWaalsContact O-N 3.11Å; E377-Q379 PolarHBondContact O-N 3.45Å; Q379-S381 VanDerWaalsContact C-N 3.34Å; Q379-S381 PolarHBondContact O-N 2.97Å; Q379-D382 PolarHBondContact O-N 3.24Å; Q379-L383 WeakPolarHBondContact O-CB 3.43Å; Q379-L383 WeakPolarHBondContact O-CD1 3.35Å; Q379-L383 WeakPolarHBondContact O-CG 3.49Å; Q379-L383 PolarHBondContact O-N 3.32Å
380	V	94.9	Very high	90.5	Very high	13 Å²	13	64.1 Å²	64.1	8%	0.079	34%	0.343	C	S	.	.	H	α-helix	trans	-63.6	-40.4	-179.9	171.4	0	0	0	0	111.4	A296 F299 L376 E377 S384	A296-V380 WeakPolarHBondContact O-CG1 3.19Å; A296-V380 WeakPolarHBondContact O-CG2 3.46Å; F299-V380 HydrophobicContact CB-CG2 4.14Å; F299-V380 HydrophobicContact CD2-CG2 4.35Å; L376-V380 HydrophobicContact CD1-CG2 3.99Å; L376-V380 HydrophobicContact CG-CG2 4.29Å; L376-V380 WeakPolarHBondContact O-CG2 3.48Å; L376-V380 PolarHBondContact O-N 3.09Å; E377-V380 PolarHBondContact O-N 3.23Å; V380-S384 VanDerWaalsContact O-CB 3.25Å; V380-S384 WeakPolarHBondContact O-CB 3.06Å; V380-S384 PolarHBondContact O-N 2.88Å; V380-S384 PolarHBondContact O-OG 3.01Å
381	S	95.3	Very high	91.8	Very high	78 Å²	78	61.9 Å²	61.9	55%	0.545	32%	0.32	S	S	.	.	H	α-helix	trans	-64.6	-47.9	177.1	-174.8	0	0	0	0	112.2	E377 I378 Q379 S384 S385	E377-S381 VanDerWaalsContact O-CB 3.27Å; E377-S381 WeakPolarHBondContact O-CB 3.44Å; E377-S381 PolarHBondContact O-N 3.02Å; I378-S381 PolarHBondContact O-N 2.85Å; Q379-S381 VanDerWaalsContact C-N 3.34Å; Q379-S381 PolarHBondContact O-N 2.97Å; S381-S384 PolarHBondContact O-N 3.33Å; S381-S385 WeakPolarHBondContact O-CB 3.42Å; S381-S385 PolarHBondContact O-N 2.99Å
382	D	94.1	Very high	92.8	Very high	67 Å²	67	61.2 Å²	61.2	36%	0.358	31%	0.31	S	S	.	.	H	α-helix	trans	-63.2	-46.8	178	-174	51.2	0	0	0	111.5	I378 Q379 S384 S385 K386	I378-D382 WeakPolarHBondContact O-CB 3.01Å; I378-D382 PolarHBondContact O-N 3.08Å; Q379-D382 PolarHBondContact O-N 3.24Å; D382-S384 PolarHBondContact O-N 3.41Å; D382-S385 PolarHBondContact O-N 2.79Å; D382-K386 WeakPolarHBondContact O-CB 3.02Å; D382-K386 VanDerWaalsContact O-CG 3.3Å; D382-K386 WeakPolarHBondContact O-CG 3.12Å; D382-K386 PolarHBondContact O-N 3.36Å
383	L	95.7	Very high	93.9	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-54.5	-51.5	174.5	-73.4	166.4	0	0	0	111.1	L98 F102 F218 A296 Q379 S385 K386 L387	L98-L383 HydrophobicContact CB-CD2 3.94Å; L98-L383 HydrophobicContact CD1-CD2 4.42Å; L98-L383 HydrophobicContact CD2-CD2 3.96Å; L98-L383 HydrophobicContact CG-CD2 4.3Å; F102-L383 HydrophobicContact CB-CD1 4.47Å; F102-L383 HydrophobicContact CD2-CD1 3.79Å; F102-L383 HydrophobicContact CE2-CD1 4.47Å; F102-L383 HydrophobicContact CG-CD1 4.38Å; F218-L383 HydrophobicContact CE1-CD1 3.81Å; F218-L383 HydrophobicContact CE1-CD2 3.92Å; F218-L383 HydrophobicContact CE1-CG 4.47Å; F218-L383 HydrophobicContact CZ-CB 4.5Å; F218-L383 HydrophobicContact CZ-CD1 3.96Å; F218-L383 HydrophobicContact CZ-CD2 3.91Å; F218-L383 HydrophobicContact CZ-CG 4.36Å; A296-L383 HydrophobicContact CB-CB 4.43Å; Q379-L383 WeakPolarHBondContact O-CB 3.43Å; Q379-L383 WeakPolarHBondContact O-CD1 3.35Å; Q379-L383 WeakPolarHBondContact O-CG 3.49Å; Q379-L383 PolarHBondContact O-N 3.32Å; L383-S385 PolarHBondContact O-N 2.89Å; L383-K386 PolarHBondContact O-N 3.39Å; L383-L387 VanDerWaalsContact O-CB 3.28Å; L383-L387 WeakPolarHBondContact O-CB 3.3Å; L383-L387 WeakPolarHBondContact O-CD1 3.39Å; L383-L387 WeakPolarHBondContact O-CG 3.37Å; L383-L387 PolarHBondContact O-N 3.04Å
384	S	97	Very high	94.8	Very high	21 Å²	21	60.4 Å²	60.4	15%	0.147	29%	0.294	C	S	.	.	H	α-helix	trans	-64.8	-40.2	-177	-61	0	0	0	0	112.4	V380 S381 D382 R388	V380-S384 VanDerWaalsContact O-CB 3.25Å; V380-S384 WeakPolarHBondContact O-CB 3.06Å; V380-S384 PolarHBondContact O-N 2.88Å; V380-S384 PolarHBondContact O-OG 3.01Å; S381-S384 PolarHBondContact O-N 3.33Å; D382-S384 PolarHBondContact O-N 3.41Å; S384-R388 VanDerWaalsContact O-CB 3.32Å; S384-R388 WeakPolarHBondContact O-CB 3.12Å; S384-R388 PolarHBondContact O-N 3.34Å; S384-R388 VanDerWaalsContact O-N 3.07Å
385	S	97.2	Very high	95.3	Very high	59 Å²	59	57.1 Å²	57.1	41%	0.413	28%	0.278	S	S	.	.	H	α-helix	trans	-64.5	-50.7	177.4	-172.9	0	0	0	0	110.9	S381 D382 L383 L387 R388 D389	S381-S385 WeakPolarHBondContact O-CB 3.42Å; S381-S385 PolarHBondContact O-N 2.99Å; D382-S385 PolarHBondContact O-N 2.79Å; L383-S385 PolarHBondContact O-N 2.89Å; S385-L387 PolarHBondContact O-N 3.39Å; S385-R388 WeakPolarHBondContact O-CB 3.41Å; S385-R388 PolarHBondContact O-N 3.48Å; S385-D389 PolarHBondContact O-N 2.97Å
386	K	97	Very high	95.7	Very high	83 Å²	83	55.9 Å²	55.9	36%	0.361	28%	0.277	S	S	.	.	H	α-helix	trans	-64	-42.6	-178.7	-65.9	-61.5	179.2	-165.6	0	111.9	L98 D382 L383 R388 D389 M390	L98-K386 HydrophobicContact CD1-CB 3.94Å; L98-K386 HydrophobicContact CD2-CB 3.97Å; L98-K386 HydrophobicContact CD2-CG 4.03Å; L98-K386 HydrophobicContact CG-CB 4.45Å; D382-K386 WeakPolarHBondContact O-CB 3.02Å; D382-K386 VanDerWaalsContact O-CG 3.3Å; D382-K386 WeakPolarHBondContact O-CG 3.12Å; D382-K386 PolarHBondContact O-N 3.36Å; L383-K386 PolarHBondContact O-N 3.39Å; K386-R388 VanDerWaalsContact C-N 3.28Å; K386-R388 PolarHBondContact O-N 3.02Å; K386-D389 PolarHBondContact O-N 3.4Å; K386-M390 VanDerWaalsContact O-CE 3.26Å; K386-M390 WeakPolarHBondContact O-CE 3.37Å; K386-M390 WeakPolarHBondContact O-CG 3.4Å; K386-M390 PolarHBondContact O-N 2.92Å
387	L	97.8	Very high	95.9	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-58.5	-42	174.9	-74.1	170.2	0	0	0	111.4	F95 L98 F218 L222 I289 M292 I293 L383 S385 D389 M390 R391	F95-L387 HydrophobicContact CE1-CD2 4.11Å; F95-L387 HydrophobicContact CZ-CD2 4.43Å; L98-L387 HydrophobicContact CD1-CD2 4.41Å; L98-L387 HydrophobicContact CD1-CG 4.37Å; F218-L387 HydrophobicContact CE2-CD1 4.36Å; F218-L387 HydrophobicContact CZ-CD1 4.41Å; L222-L387 HydrophobicContact CD2-CD2 4.47Å; I289-L387 HydrophobicContact CD1-CD2 3.84Å; I289-L387 HydrophobicContact CG2-CB 4.21Å; I289-L387 VanDerWaalsContact CG2-O 3.28Å; I289-L387 WeakPolarHBondContact CG2-O 3.4Å; M292-L387 HydrophobicContact CB-CD1 3.9Å; M292-L387 HydrophobicContact CB-CD2 4.47Å; M292-L387 HydrophobicContact CE-CD2 4.28Å; M292-L387 HydrophobicContact SD-CD2 4.29Å; I293-L387 HydrophobicContact CD1-CB 4.09Å; I293-L387 HydrophobicContact CG1-CB 3.78Å; I293-L387 HydrophobicContact CG1-CD1 4.03Å; L383-L387 VanDerWaalsContact O-CB 3.28Å; L383-L387 WeakPolarHBondContact O-CB 3.3Å; L383-L387 WeakPolarHBondContact O-CD1 3.39Å; L383-L387 WeakPolarHBondContact O-CG 3.37Å; L383-L387 PolarHBondContact O-N 3.04Å; S385-L387 PolarHBondContact O-N 3.39Å; L387-D389 PolarHBondContact O-N 3.46Å; L387-M390 HydrophobicContact CD2-CE 4.06Å; L387-M390 PolarHBondContact O-N 3.46Å; L387-R391 PolarHBondContact O-N 2.78Å
388	R	97.6	Very high	96.1	Very high	161 Å²	161	50.2 Å²	50.2	61%	0.608	25%	0.251	S	S	*	.	H	α-helix	trans	-63.8	-40.3	178	-168.8	177.3	-61.4	-140.2	-1.4	112.9	I293 S384 S385 K386 M390 R391	I293-R388 HydrophobicContact CD1-CB 4.42Å; S384-R388 VanDerWaalsContact O-CB 3.32Å; S384-R388 WeakPolarHBondContact O-CB 3.12Å; S384-R388 PolarHBondContact O-N 3.34Å; S384-R388 VanDerWaalsContact O-N 3.07Å; S385-R388 WeakPolarHBondContact O-CB 3.41Å; S385-R388 PolarHBondContact O-N 3.48Å; K386-R388 VanDerWaalsContact C-N 3.28Å; K386-R388 PolarHBondContact O-N 3.02Å; R388-M390 PolarHBondContact O-N 2.84Å; R388-R391 WeakPolarHBondContact O-CB 3.32Å; R388-R391 PolarHBondContact O-N 3.44Å
389	D	96.1	Very high	96.2	Very high	108 Å²	108	49.4 Å²	49.4	58%	0.578	25%	0.25	S	S	*	.	H	α-helix	trans	-60.4	-30.7	176.7	-65.3	-21	0	0	0	112	S385 K386 L387	S385-D389 PolarHBondContact O-N 2.97Å; K386-D389 PolarHBondContact O-N 3.4Å; L387-D389 PolarHBondContact O-N 3.46Å
390	M	95.4	Very high	96.2	Very high	13 Å²	13	50.7 Å²	50.7	6%	0.064	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-2.5	-177.2	-59.5	-179.2	-65.1	0	0	113.5	L91 T94 F95 L98 W285 K386 L387 R388 Q392 Y393	L91-M390 HydrophobicContact CD1-CB 3.91Å; L91-M390 HydrophobicContact CD1-CG 3.47Å; L91-M390 VanDerWaalsContact CD1-CG 3.47Å; L91-M390 HydrophobicContact CD1-SD 3.31Å; L91-M390 WeakPolarHBondContact CD1-SD 3.11Å; L91-M390 HydrophobicContact CG-SD 4.44Å; T94-M390 HydrophobicContact CG2-CE 4.04Å; T94-M390 HydrophobicContact CG2-SD 3.54Å; T94-M390 VanDerWaalsContact CG2-SD 3.54Å; F95-M390 HydrophobicContact CD2-CE 4.23Å; F95-M390 HydrophobicContact CD2-SD 3.94Å; F95-M390 HydrophobicContact CE1-CE 4.32Å; F95-M390 HydrophobicContact CE2-CE 3.74Å; F95-M390 HydrophobicContact CE2-SD 3.57Å; F95-M390 VanDerWaalsContact CE2-SD 3.57Å; F95-M390 HydrophobicContact CZ-CE 3.79Å; F95-M390 HydrophobicContact CZ-SD 4.22Å; L98-M390 HydrophobicContact CD1-CE 3.91Å; W285-M390 PolarHBondContact NE1-O 3.25Å; K386-M390 VanDerWaalsContact O-CE 3.26Å; K386-M390 WeakPolarHBondContact O-CE 3.37Å; K386-M390 WeakPolarHBondContact O-CG 3.4Å; K386-M390 PolarHBondContact O-N 2.92Å; L387-M390 HydrophobicContact CD2-CE 4.06Å; L387-M390 PolarHBondContact O-N 3.46Å; R388-M390 PolarHBondContact O-N 2.84Å; M390-Q392 VanDerWaalsContact C-N 3.35Å; M390-Q392 PolarHBondContact O-N 3.45Å; M390-Y393 WeakPolarHBondContact O-CB 3.04Å; M390-Y393 PolarHBondContact O-N 2.86Å
391	R	97.6	Very high	96.2	Very high	66 Å²	66	50.8 Å²	50.8	25%	0.249	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-38.2	-171.1	-173.3	177	-177.1	-72.4	-9.5	113.7	Q286 I289 D290 L387 R388	Q286-R391 HydrophobicContact CG-CG 4.1Å; Q286-R391 WeakPolarHBondContact CG-O 3.36Å; I289-R391 HydrophobicContact CG2-CB 4.07Å; I289-R391 HydrophobicContact CG2-CG 4.18Å; D290-R391 IonicContact OD1-CZ 3.82Å; D290-R391 IonicContact OD1-NE 3.63Å; D290-R391 PolarHBondContact OD1-NE 3.44Å; D290-R391 IonicContact OD1-NH2 2.72Å; D290-R391 IonicContact OD2-CZ 2.74Å; D290-R391 IonicContact OD2-NE 3.83Å; D290-R391 PolarHBondContact OD2-NE 2.97Å; D290-R391 IonicContact OD2-NH2 3.06Å; D290-R391 PolarHBondContact OD2-NH2 3.11Å; L387-R391 PolarHBondContact O-N 2.78Å; R388-R391 WeakPolarHBondContact O-CB 3.32Å; R388-R391 PolarHBondContact O-N 3.44Å
392	Q	96.9	Very high	96.2	Very high	87 Å²	87	47.2 Å²	47.2	41%	0.407	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	20.8	-176.2	-66.2	-172.6	-29.7	0	0	113.4	M390 W394 V395 Q396	M390-Q392 VanDerWaalsContact C-N 3.35Å; M390-Q392 PolarHBondContact O-N 3.45Å; Q392-W394 PolarHBondContact O-N 3.24Å; Q392-V395 HydrophobicContact CB-CG2 4.1Å; Q392-V395 WeakPolarHBondContact O-CG2 3.28Å; Q392-V395 PolarHBondContact O-N 3.4Å; Q392-Q396 HydrophobicContact CB-CG 3.93Å; Q392-Q396 WeakPolarHBondContact O-CB 3.5Å; Q392-Q396 WeakPolarHBondContact O-CG 3.43Å; Q392-Q396 PolarHBondContact O-N 2.75Å
393	Y	97.9	Very high	95.9	Very high	29 Å²	29	48.1 Å²	48.1	11%	0.114	25%	0.253	C	S	.	.	H	α-helix	trans	-53.1	-49.2	-170.3	174.1	-102.4	0	0	0	113.9	G88 L91 M390 V395 Q396 L397	G88-Y393 WeakPolarHBondContact CA-OH 3.49Å; G88-Y393 PolarHBondContact N-OH 3.2Å; L91-Y393 HydrophobicContact CB-CE2 4.22Å; L91-Y393 HydrophobicContact CD1-CD2 4.33Å; L91-Y393 HydrophobicContact CD2-CD1 3.51Å; L91-Y393 HydrophobicContact CD2-CD2 3.7Å; L91-Y393 HydrophobicContact CD2-CE1 3.59Å; L91-Y393 HydrophobicContact CD2-CE2 3.76Å; L91-Y393 HydrophobicContact CD2-CG 3.56Å; L91-Y393 HydrophobicContact CG-CD2 4.48Å; L91-Y393 HydrophobicContact CG-CE2 4.45Å; M390-Y393 WeakPolarHBondContact O-CB 3.04Å; M390-Y393 PolarHBondContact O-N 2.86Å; Y393-V395 PolarHBondContact O-N 3.03Å; Y393-Q396 PolarHBondContact O-N 3.21Å; Y393-L397 WeakPolarHBondContact O-CB 3.43Å; Y393-L397 PolarHBondContact O-N 2.86Å
394	W	98	Very high	95.3	Very high	4 Å²	4	57.2 Å²	57.2	2%	0.015	29%	0.293	C	S	.	.	H	α-helix	trans	-66.7	-36.1	-172.3	-66.1	115.1	0	0	0	113.4	I229 V232 Q278 L281 D282 W285 Q392	I229-W394 HydrophobicContact CG1-CZ2 4.37Å; V232-W394 HydrophobicContact CB-CH2 3.66Å; V232-W394 HydrophobicContact CB-CZ2 4.33Å; V232-W394 HydrophobicContact CB-CZ3 4.29Å; V232-W394 HydrophobicContact CG1-CE3 4.37Å; V232-W394 HydrophobicContact CG1-CH2 3.3Å; V232-W394 HydrophobicContact CG1-CZ2 4.15Å; V232-W394 HydrophobicContact CG1-CZ3 3.43Å; V232-W394 VanDerWaalsContact CG1-CZ3 3.43Å; V232-W394 HydrophobicContact CG2-CH2 4.36Å; Q278-W394 HydrophobicContact CB-CE3 4.04Å; Q278-W394 HydrophobicContact CB-CZ3 4.28Å; L281-W394 HydrophobicContact CB-CD2 4.33Å; L281-W394 HydrophobicContact CB-CG 4.13Å; L281-W394 HydrophobicContact CD2-CZ2 4.21Å; D282-W394 HydrophobicContact CB-CB 4.14Å; W285-W394 AromaticContact CD1-CD1 3.9Å; W285-W394 AromaticContact CD2-NE1 3.61Å; W285-W394 AromaticContact CE3-NE1 3.86Å; W285-W394 AromaticContact CG-CD1 3.59Å; W285-W394 AromaticContact CG-NE1 3.62Å; Q392-W394 PolarHBondContact O-N 3.24Å
395	V	96.8	Very high	94.7	Very high	26 Å²	26	58.7 Å²	58.7	16%	0.158	30%	0.299	C	S	.	.	H	α-helix	trans	-85.6	-22.8	178	-64	0	0	0	0	113.2	D282 Q392 Y393 D431	D282-V395 HydrophobicContact CB-CG1 3.76Å; D282-V395 VanDerWaalsContact CG-CG1 3.45Å; Q392-V395 HydrophobicContact CB-CG2 4.1Å; Q392-V395 WeakPolarHBondContact O-CG2 3.28Å; Q392-V395 PolarHBondContact O-N 3.4Å; Y393-V395 PolarHBondContact O-N 3.03Å; V395-D431 HydrophobicContact CG1-CB 3.77Å
396	Q	96.4	Very high	94.2	Very high	96 Å²	96	56.7 Å²	56.7	45%	0.449	29%	0.286	S	S	.	.	H	α-helix	trans	-84.1	-20.8	175.3	-71.3	-173.4	9	0	0	113.3	Q392 Y393 V399 A400	Q392-Q396 HydrophobicContact CB-CG 3.93Å; Q392-Q396 WeakPolarHBondContact O-CB 3.5Å; Q392-Q396 WeakPolarHBondContact O-CG 3.43Å; Q392-Q396 PolarHBondContact O-N 2.75Å; Y393-Q396 PolarHBondContact O-N 3.21Å; Q396-V399 WeakPolarHBondContact O-CB 3.35Å; Q396-V399 PolarHBondContact O-N 3.49Å; Q396-V399 VanDerWaalsContact O-N 3.08Å; Q396-A400 PolarHBondContact O-N 3.16Å
397	L	96.2	Very high	93.3	Very high	6 Å²	6	53.4 Å²	53.4	3%	0.031	27%	0.274	C	S	.	.	H	α-helix	trans	-55.4	-46.6	-178.7	179.9	62.9	0	0	0	113.5	I84 A87 L275 Y393 V399 A400 L401	I84-L397 HydrophobicContact CG2-CD2 4.49Å; A87-L397 HydrophobicContact CB-CD1 3.83Å; L275-L397 HydrophobicContact CD1-CD2 3.91Å; L275-L397 HydrophobicContact CD1-CG 3.94Å; Y393-L397 WeakPolarHBondContact O-CB 3.43Å; Y393-L397 PolarHBondContact O-N 2.86Å; L397-V399 VanDerWaalsContact C-N 3.29Å; L397-V399 PolarHBondContact O-N 3.06Å; L397-A400 PolarHBondContact O-N 2.9Å; L397-L401 HydrophobicContact CD1-CD1 4.29Å; L397-L401 HydrophobicContact CD1-CG 4.16Å; L397-L401 HydrophobicContact CG-CD1 4.19Å; L397-L401 HydrophobicContact CG-CG 4.5Å; L397-L401 WeakPolarHBondContact O-CG 3.16Å; L397-L401 PolarHBondContact O-N 3.05Å
398	P	95.3	Very high	92.4	Very high	2 Å²	2	60.5 Å²	60.5	1%	0.013	31%	0.307	C	S	.	.	H	α-helix	trans	-55.4	-42	174.1	-26.7	35.1	0	0	0	113.5	M271 K272 L275 L401 C402	M271-P398 HydrophobicContact CB-CB 3.76Å; K272-P398 HydrophobicContact CG-CB 4.03Å; K272-P398 HydrophobicContact CG-CG 4.16Å; L275-P398 HydrophobicContact CB-CG 4.44Å; L275-P398 HydrophobicContact CD1-CG 4.08Å; P398-L401 PolarHBondContact O-N 3.46Å; P398-C402 PolarHBondContact O-N 3.35Å; P398-C402 PolarHBondContact O-SG 2.91Å; P398-C402 VanDerWaalsContact O-SG 3.39Å
399	V	92.9	Very high	90.9	Very high	84 Å²	84	57 Å²	57	51%	0.509	31%	0.307	S	S	.	.	H	α-helix	trans	-67.5	-43.2	-180	-179.1	0	0	0	0	110.5	Q396 L397 L401 C402 S403	Q396-V399 WeakPolarHBondContact O-CB 3.35Å; Q396-V399 PolarHBondContact O-N 3.49Å; Q396-V399 VanDerWaalsContact O-N 3.08Å; L397-V399 VanDerWaalsContact C-N 3.29Å; L397-V399 PolarHBondContact O-N 3.06Å; V399-L401 PolarHBondContact O-N 3.44Å; V399-C402 PolarHBondContact O-N 3.08Å; V399-S403 PolarHBondContact O-N 3.25Å
400	A	94.1	Very high	89.5	Confident	60 Å²	60	58.9 Å²	58.9	50%	0.496	32%	0.318	S	S	.	.	H	α-helix	trans	-61.6	-42.7	177.3	0	0	0	0	0	111.8	Q396 L397 C402 S403	Q396-A400 PolarHBondContact O-N 3.16Å; L397-A400 PolarHBondContact O-N 2.9Å; A400-C402 VanDerWaalsContact C-N 3.35Å; A400-C402 PolarHBondContact O-N 3.41Å; A400-S403 PolarHBondContact O-N 2.74Å; A400-S403 PolarHBondContact O-OG 2.76Å
401	L	94.9	Very high	88.4	Confident	15 Å²	15	60.3 Å²	60.3	8%	0.079	33%	0.329	C	S	.	.	H	α-helix	trans	-63.9	-39.6	176	-68.2	173.4	0	0	0	111.9	L83 I84 M271 L275 L397 P398 V399 L405	L83-L401 HydrophobicContact CB-CD2 3.54Å; L83-L401 HydrophobicContact CD1-CD2 4.21Å; L83-L401 HydrophobicContact CG-CD2 4.49Å; I84-L401 HydrophobicContact CG1-CD1 3.92Å; M271-L401 HydrophobicContact CE-CB 4.45Å; M271-L401 HydrophobicContact SD-CB 4.41Å; M271-L401 HydrophobicContact SD-CD1 4.2Å; L275-L401 HydrophobicContact CD1-CD1 3.84Å; L397-L401 HydrophobicContact CD1-CD1 4.29Å; L397-L401 HydrophobicContact CD1-CG 4.16Å; L397-L401 HydrophobicContact CG-CD1 4.19Å; L397-L401 HydrophobicContact CG-CG 4.5Å; L397-L401 WeakPolarHBondContact O-CG 3.16Å; L397-L401 PolarHBondContact O-N 3.05Å; P398-L401 PolarHBondContact O-N 3.46Å; V399-L401 PolarHBondContact O-N 3.44Å; L401-L405 WeakPolarHBondContact O-CD1 3.47Å
402	C	94.4	Very high	87.2	Confident	4 Å²	4	61.9 Å²	61.9	3%	0.027	34%	0.339	C	S	.	.	H	α-helix	trans	-73.5	-24.8	178.3	-72.1	0	0	0	0	114.1	C267 M271 P398 V399 A400 K404 L405 A406	C267-C402 HydrophobicContact CB-CB 3.91Å; C267-C402 WeakPolarHBondContact CB-SG 3.08Å; C267-C402 PolarHBondContact O-SG 2.95Å; C267-C402 VanDerWaalsContact O-SG 3.38Å; C267-C402 WeakPolarHBondContact SG-CA 3.03Å; C267-C402 WeakPolarHBondContact SG-CB 3.17Å; C267-C402 CovalentContact SG-SG 2.04Å; C267-C402 PolarHBondContact SG-SG 3.29Å; M271-C402 VanDerWaalsContact CG-SG 3.53Å; P398-C402 PolarHBondContact O-N 3.35Å; P398-C402 PolarHBondContact O-SG 2.91Å; P398-C402 VanDerWaalsContact O-SG 3.39Å; V399-C402 PolarHBondContact O-N 3.08Å; A400-C402 VanDerWaalsContact C-N 3.35Å; A400-C402 PolarHBondContact O-N 3.41Å; C402-K404 PolarHBondContact O-N 3.42Å; C402-K404 VanDerWaalsContact O-N 3.12Å; C402-L405 PolarHBondContact O-N 2.86Å; C402-L405 VanDerWaalsContact O-N 3.08Å; C402-A406 VanDerWaalsContact O-CB 3.29Å; C402-A406 WeakPolarHBondContact O-CB 3.23Å; C402-A406 PolarHBondContact O-N 3.41Å
403	S	89.4	Confident	86.5	Confident	85 Å²	85	61.9 Å²	61.9	59%	0.594	34%	0.342	S	S	*	.	H	α-helix	trans	-57	-31.4	-174.4	68.8	0	0	0	0	114.8	V399 A400	V399-S403 PolarHBondContact O-N 3.25Å; A400-S403 PolarHBondContact O-N 2.74Å; A400-S403 PolarHBondContact O-OG 2.76Å
404	K	81.9	Confident	86.1	Confident	193 Å²	193	65.6 Å²	65.6	84%	0.839	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-16	178.3	-63.3	-176.1	-179.1	178.9	0	113.8	C402	C402-K404 PolarHBondContact O-N 3.42Å; C402-K404 VanDerWaalsContact O-N 3.12Å
405	L	85.8	Confident	86	Confident	51 Å²	51	65.5 Å²	65.5	27%	0.267	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-31.5	-176.3	-68.7	174.3	0	0	0	112.3	Q261 P262 M271 L401 C402	Q261-L405 PolarHBondContact OE1-O 3.25Å; Q261-L405 VanDerWaalsContact OE1-O 3.05Å; P262-L405 WeakPolarHBondContact CD-O 3.33Å; P262-L405 VanDerWaalsContact CG-O 3.26Å; P262-L405 WeakPolarHBondContact CG-O 3.5Å; M271-L405 HydrophobicContact CE-CD1 3.9Å; L401-L405 WeakPolarHBondContact O-CD1 3.47Å; C402-L405 PolarHBondContact O-N 2.86Å; C402-L405 VanDerWaalsContact O-N 3.08Å
406	A	85.3	Confident	85.9	Confident	17 Å²	17	64.3 Å²	64.3	14%	0.14	36%	0.356	C	S	.	.	S	Bend	trans	-90.8	154.5	-173.3	0	0	0	0	0	112.8	P262 C267 C402	P262-A406 CarbonylContact O-C 2.9Å; P262-A406 WeakPolarHBondContact O-CA 3.36Å; C267-A406 HydrophobicContact CB-CB 4.21Å; C402-A406 VanDerWaalsContact O-CB 3.29Å; C402-A406 WeakPolarHBondContact O-CB 3.23Å; C402-A406 PolarHBondContact O-N 3.41Å
407	A	78.1	Confident	85.9	Confident	14 Å²	14	61.1 Å²	61.1	12%	0.116	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-61.8	140.7	172	0	0	0	0	0	110.6	Q261 P262 S411 C415	Q261-A407 HydrophobicContact CB-CB 3.89Å; P262-A407 PolarHBondContact O-N 3.49Å; A407-S411 WeakPolarHBondContact CB-OG 3.34Å; A407-C415 HydrophobicContact CB-CB 3.8Å
408	E	78.4	Confident	85.9	Confident	149 Å²	149	60.9 Å²	60.9	70%	0.696	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-58.7	155.6	177.1	-65.7	-178.2	-179	0	0	111.4	N410 S411	E408-N410 PolarHBondContact O-N 3.39Å; E408-S411 PolarHBondContact N-OG 3.38Å; E408-S411 PolarHBondContact O-N 2.04Å; E408-S411 PolarHBondContact O-OG 3.25Å
409	S	68.1	Low	85.8	Confident	88 Å²	88	66.7 Å²	66.7	62%	0.615	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-52.3	-29	-177.6	50	0	0	0	0	114.1	S411 Q412	S409-S411 VanDerWaalsContact C-N 3.26Å; S409-S411 PolarHBondContact O-N 3.05Å; S409-Q412 WeakPolarHBondContact O-CG 3.11Å
410	N	65.4	Low	85.8	Confident	148 Å²	148	66.2 Å²	66.2	79%	0.791	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-76.3	-8.4	179.7	-63.2	-23.1	0	0	0	114.3	E408	E408-N410 PolarHBondContact O-N 3.39Å
411	S	72.3	Confident	85.8	Confident	42 Å²	42	68.3 Å²	68.3	29%	0.294	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-116.3	16.4	-174.2	63.2	0	0	0	0	114	A407 E408 S409 D413 N414	A407-S411 WeakPolarHBondContact CB-OG 3.34Å; E408-S411 PolarHBondContact N-OG 3.38Å; E408-S411 PolarHBondContact O-N 2.04Å; E408-S411 PolarHBondContact O-OG 3.25Å; S409-S411 VanDerWaalsContact C-N 3.26Å; S409-S411 PolarHBondContact O-N 3.05Å; S411-D413 PolarHBondContact O-N 3.5Å; S411-N414 CarbonylContact O-C 3.58Å; S411-N414 PolarHBondContact O-N 3.45Å
412	Q	73.4	Confident	85.8	Confident	99 Å²	99	69.1 Å²	69.1	46%	0.463	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-21	-177.4	-77	-173.5	-2.5	0	0	114.9	S409 C415 R423	S409-Q412 WeakPolarHBondContact O-CG 3.11Å; Q412-C415 PolarHBondContact O-SG 2.69Å; Q412-R423 WeakPolarHBondContact O-CA 3.39Å
413	D	81.1	Confident	85.8	Confident	88 Å²	88	75.5 Å²	75.5	47%	0.471	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-13.5	177.6	-75.7	-28.4	0	0	0	114.2	S411 R423	S411-D413 PolarHBondContact O-N 3.5Å; D413-R423 VanDerWaalsContact CG-NH2 3.28Å; D413-R423 IonicContact OD1-CZ 2.64Å; D413-R423 IonicContact OD1-NE 3.26Å; D413-R423 PolarHBondContact OD1-NE 3.32Å; D413-R423 IonicContact OD1-NH2 2.92Å; D413-R423 PolarHBondContact OD1-NH2 2.83Å; D413-R423 IonicContact OD2-NH2 2.73Å; D413-R423 PolarHBondContact OD2-NH2 2.89Å
414	N	90.8	Very high	86.1	Confident	107 Å²	107	72.7 Å²	72.7	57%	0.572	37%	0.373	S	S	*	.	S	Bend	trans	-131.8	37	-170.9	-79.5	-43.8	0	0	0	112.7	S411 K421	S411-N414 CarbonylContact O-C 3.58Å; S411-N414 PolarHBondContact O-N 3.45Å; N414-K421 WeakPolarHBondContact O-CE 3.01Å
415	C	94.6	Very high	86.8	Confident	2 Å²	2	70.3 Å²	70.3	1%	0.014	37%	0.369	C	S	.	.	S	Bend	trans	-111.1	169.5	179.8	52.2	0	0	0	0	111.8	Q261 C263 A407 Q412 K421 A422	Q261-C415 CarbonylContact O-C 3.57Å; Q261-C415 WeakPolarHBondContact O-CA 3.35Å; Q261-C415 WeakPolarHBondContact O-CB 3.38Å; C263-C415 WeakPolarHBondContact CA-SG 3.34Å; C263-C415 HydrophobicContact CB-CB 3.95Å; C263-C415 WeakPolarHBondContact CB-SG 3.38Å; C263-C415 VanDerWaalsContact SG-C 3.58Å; C263-C415 WeakPolarHBondContact SG-CB 3.33Å; C263-C415 CovalentContact SG-SG 2.03Å; C263-C415 PolarHBondContact SG-SG 3.22Å; A407-C415 HydrophobicContact CB-CB 3.8Å; Q412-C415 PolarHBondContact O-SG 2.69Å; C415-K421 CarbonylContact O-C 3.54Å; C415-K421 WeakPolarHBondContact O-CA 3.08Å; C415-A422 PolarHBondContact O-N 3.47Å
416	W	96.2	Very high	87.3	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	37%	0.371	C	S	.	.	B	Isolated β-bridge	trans	-78.6	120.5	174.6	168.6	-110.3	0	0	0	109.5	P58 K247 C251 P252 L257 V260 Q261 P262 C263 Y266 G418 M419	P58-W416 HydrophobicContact CG-CH2 4.25Å; K247-W416 PolarHBondContact O-NE1 3.34Å; C251-W416 HydrophobicContact CB-CZ2 3.99Å; P252-W416 HydrophobicContact CG-CB 4.3Å; P252-W416 HydrophobicContact CG-CD2 3.67Å; P252-W416 HydrophobicContact CG-CE3 4.27Å; P252-W416 HydrophobicContact CG-CG 3.65Å; P252-W416 HydrophobicContact CG-CZ2 4.38Å; L257-W416 HydrophobicContact CD1-CE3 4.35Å; L257-W416 HydrophobicContact CD1-CZ3 4.17Å; V260-W416 HydrophobicContact CG1-CB 3.89Å; Q261-W416 PolarHBondContact O-N 3.35Å; P262-W416 CarbonylContact C-O 3.56Å; P262-W416 WeakPolarHBondContact CA-O 3.21Å; C263-W416 PolarHBondContact N-O 2.93Å; C263-W416 PolarHBondContact SG-O 3.01Å; Y266-W416 WeakPolarHBondContact CD1-O 3.26Å; Y266-W416 AromaticContact CE1-CD1 3.71Å; Y266-W416 AromaticContact CE1-NE1 3.72Å; W416-G418 VanDerWaalsContact CE2-CA 3.46Å; W416-G418 WeakPolarHBondContact CZ2-O 3.38Å; W416-M419 VanDerWaalsContact CH2-C 3.47Å; W416-M419 WeakPolarHBondContact CH2-O 3.29Å; W416-M419 VanDerWaalsContact CZ3-O 3.24Å; W416-M419 WeakPolarHBondContact CZ3-O 3.36Å
417	N	95.6	Very high	87.7	Confident	30 Å²	30	71.6 Å²	71.6	16%	0.16	39%	0.388	C	S	.	.			trans	-103.8	14.7	-177.9	71.8	0.6	0	0	0	113.7	M419 T420 R423 Y424	N417-M419 PolarHBondContact OD1-N 2.9Å; N417-T420 PolarHBondContact N-O 3.46Å; N417-T420 VanDerWaalsContact N-O 3.16Å; N417-T420 PolarHBondContact OD1-N 3.43Å; N417-T420 PolarHBondContact OD1-O 3.41Å; N417-R423 PolarHBondContact ND2-O 2.88Å; N417-R423 VanDerWaalsContact ND2-O 3.07Å; N417-Y424 HydrophobicContact CB-CD2 4.14Å
418	G	95.3	Very high	88.5	Confident	0 Å²	0	74 Å²	74	0%	0	40%	0.401	C	S	.	.	S	Bend	trans	91.6	-11.1	-175.6	0	0	0	0	0	114.5	P58 K247 Y266 W416	P58-G418 WeakPolarHBondContact CG-O 3.46Å; K247-G418 WeakPolarHBondContact CE-O 3.28Å; Y266-G418 VanDerWaalsContact CE1-CA 3.43Å; Y266-G418 VanDerWaalsContact CE1-N 3.26Å; W416-G418 VanDerWaalsContact CE2-CA 3.46Å; W416-G418 WeakPolarHBondContact CZ2-O 3.38Å
419	M	94.1	Very high	89.4	Confident	125 Å²	125	68.8 Å²	68.8	62%	0.616	38%	0.377	S	S	*	.	S	Bend	trans	-125.7	-46.9	176.4	-64.3	-172.8	68	0	0	113	W416 N417	W416-M419 VanDerWaalsContact CH2-C 3.47Å; W416-M419 WeakPolarHBondContact CH2-O 3.29Å; W416-M419 VanDerWaalsContact CZ3-O 3.24Å; W416-M419 WeakPolarHBondContact CZ3-O 3.36Å; N417-M419 PolarHBondContact OD1-N 2.9Å
420	T	93.4	Very high	90.8	Very high	73 Å²	73	66.2 Å²	66.2	45%	0.448	36%	0.364	S	S	.	.	S	Bend	trans	-151.8	-179.9	-176.5	-168.4	0	0	0	0	110.6	N417 A422	N417-T420 PolarHBondContact N-O 3.46Å; N417-T420 VanDerWaalsContact N-O 3.16Å; N417-T420 PolarHBondContact OD1-N 3.43Å; N417-T420 PolarHBondContact OD1-O 3.41Å; T420-A422 HydrophobicContact CG2-CB 3.93Å; T420-A422 PolarHBondContact O-N 3.1Å
421	K	94.4	Very high	92.3	Very high	104 Å²	104	61.7 Å²	61.7	45%	0.452	34%	0.34	S	S	.	.	B	Isolated β-bridge	trans	-80	97.5	169	-175.6	-178.5	-178.9	177.7	0	109.4	V260 N414 C415	V260-K421 HydrophobicContact CG1-CB 4.27Å; V260-K421 HydrophobicContact CG1-CD 4.32Å; V260-K421 HydrophobicContact CG1-CG 3.94Å; V260-K421 HydrophobicContact CG2-CD 3.95Å; V260-K421 HydrophobicContact CG2-CG 4.37Å; N414-K421 WeakPolarHBondContact O-CE 3.01Å; C415-K421 CarbonylContact O-C 3.54Å; C415-K421 WeakPolarHBondContact O-CA 3.08Å
422	A	94.1	Very high	93.4	Very high	32 Å²	32	60 Å²	60	26%	0.264	33%	0.329	S	S	.	.	S	Bend	trans	-165.8	172.6	178.3	0	0	0	0	0	109.9	C415 T420	C415-A422 PolarHBondContact O-N 3.47Å; T420-A422 HydrophobicContact CG2-CB 3.93Å; T420-A422 PolarHBondContact O-N 3.1Å
423	R	94.9	Very high	94.5	Very high	139 Å²	139	55.5 Å²	55.5	53%	0.525	31%	0.309	S	S	.	.			trans	-59	146.9	172.5	61.5	174.4	55.9	168.3	-1.1	112.9	Q412 D413 N417 L425	Q412-R423 WeakPolarHBondContact O-CA 3.39Å; D413-R423 VanDerWaalsContact CG-NH2 3.28Å; D413-R423 IonicContact OD1-CZ 2.64Å; D413-R423 IonicContact OD1-NE 3.26Å; D413-R423 PolarHBondContact OD1-NE 3.32Å; D413-R423 IonicContact OD1-NH2 2.92Å; D413-R423 PolarHBondContact OD1-NH2 2.83Å; D413-R423 IonicContact OD2-NH2 2.73Å; D413-R423 PolarHBondContact OD2-NH2 2.89Å; N417-R423 PolarHBondContact ND2-O 2.88Å; N417-R423 VanDerWaalsContact ND2-O 3.07Å; R423-L425 HydrophobicContact CG-CD2 3.94Å
424	Y	95.8	Very high	95.2	Very high	25 Å²	25	54.7 Å²	54.7	10%	0.098	31%	0.314	C	S	.	.			trans	-91.6	121.6	169.1	-176.6	-98.1	0	0	0	109.5	N265 Y266 N269 N417 P426 P440 E441	N265-Y424 HydrophobicContact CB-CD1 3.65Å; N265-Y424 HydrophobicContact CB-CE1 3.98Å; Y266-Y424 HydrophobicContact CD2-CD2 4.13Å; Y266-Y424 AromaticContact CD2-CE2 3.62Å; Y266-Y424 HydrophobicContact CD2-CE2 3.62Å; Y266-Y424 AromaticContact CG-CD2 3.97Å; Y266-Y424 HydrophobicContact CG-CD2 3.97Å; Y266-Y424 AromaticContact CG-CE2 3.94Å; Y266-Y424 HydrophobicContact CG-CE2 3.94Å; N269-Y424 WeakPolarHBondContact ND2-CE1 3.2Å; N269-Y424 PolarHBondContact ND2-OH 2.91Å; N417-Y424 HydrophobicContact CB-CD2 4.14Å; Y424-P426 WeakPolarHBondContact CD1-O 3.34Å; Y424-P426 HydrophobicContact CE1-CB 3.7Å; Y424-P426 HydrophobicContact CE1-CG 3.96Å; Y424-P426 WeakPolarHBondContact CE1-O 3.34Å; Y424-P426 HydrophobicContact CE2-CG 3.97Å; Y424-P440 WeakPolarHBondContact OH-CG 3.48Å; Y424-E441 VanDerWaalsContact CE2-OE1 3.3Å; Y424-E441 WeakPolarHBondContact CE2-OE1 3.49Å; Y424-E441 WeakPolarHBondContact OH-CG 3.22Å; Y424-E441 PolarHBondContact OH-OE1 2.94Å
425	L	95.6	Very high	95.5	Very high	143 Å²	143	54.1 Å²	54.1	75%	0.749	31%	0.311	S	S	*	.			trans	-90.2	-37.5	-173.7	-61.3	176.2	0	0	0	114.8	R423	R423-L425 HydrophobicContact CG-CD2 3.94Å
426	P	96.1	Very high	95.6	Very high	48 Å²	48	54.1 Å²	54.1	31%	0.312	31%	0.311	S	S	.	.	S	Bend	trans	-61.1	147.1	-177.7	-22.7	31.8	0	0	0	113.3	Y424 P440	Y424-P426 WeakPolarHBondContact CD1-O 3.34Å; Y424-P426 HydrophobicContact CE1-CB 3.7Å; Y424-P426 HydrophobicContact CE1-CG 3.96Å; Y424-P426 WeakPolarHBondContact CE1-O 3.34Å; Y424-P426 HydrophobicContact CE2-CG 3.97Å; P426-P440 HydrophobicContact CB-CG 3.9Å; P426-P440 HydrophobicContact CG-CG 4.26Å
427	G	94.3	Very high	95.6	Very high	48 Å²	48	59.1 Å²	59.1	50%	0.495	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-68.2	164.8	171.6	0	0	0	0	0	112.4	N269	N269-G427 PolarHBondContact ND2-O 3.3Å
428	V	96	Very high	95.5	Very high	64 Å²	64	63.9 Å²	63.9	39%	0.388	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-80.6	131.1	175.4	-178.4	0	0	0	0	109.5	N265 N269 K272	N265-V428 HydrophobicContact CB-CG2 3.81Å; N269-V428 WeakPolarHBondContact OD1-CA 3.44Å; K272-V428 HydrophobicContact CD-CG1 4.1Å
429	M	96.9	Very high	95.6	Very high	39 Å²	39	64.5 Å²	64.5	19%	0.192	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-68	155.1	177.2	-63.9	-60.6	117.2	0	0	111.9	N269 K272 N439	N269-M429 WeakPolarHBondContact OD1-CG 3.43Å; N269-M429 PolarHBondContact OD1-N 3.16Å; K272-M429 WeakPolarHBondContact CD-O 3.47Å; K272-M429 PolarHBondContact NZ-O 2.89Å; M429-N439 HydrophobicContact CG-CB 3.98Å
430	G	96.8	Very high	95.8	Very high	34 Å²	34	61.6 Å²	61.6	35%	0.351	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-65.7	169	169.6	0	0	0	0	0	111.9	Q436	G430-Q436 PolarHBondContact O-NE2 2.03Å
431	D	97	Very high	96	Very high	54 Å²	54	59.6 Å²	59.6	29%	0.289	34%	0.341	S	S	.	.	S	Bend	trans	-87	154.3	178.6	-58.6	-65.1	0	0	0	111.9	K272 A279 V395 N435	K272-D431 WeakPolarHBondContact CE-OD1 3.44Å; K272-D431 IonicContact NZ-OD1 2.7Å; K272-D431 PolarHBondContact NZ-OD1 2.88Å; K272-D431 IonicContact NZ-OD2 3.22Å; K272-D431 PolarHBondContact NZ-OD2 3.03Å; A279-D431 HydrophobicContact CB-CB 4.3Å; V395-D431 HydrophobicContact CG1-CB 3.77Å; D431-N435 PolarHBondContact O-ND2 3.49Å
432	G	96.4	Very high	96.1	Very high	6 Å²	6	54.8 Å²	54.8	6%	0.062	32%	0.32	C	S	.	.	S	Bend	trans	87.9	163.2	-180	0	0	0	0	0	114	A276 A279 D280 A434 N435 Q436	A276-G432 CarbonylContact O-C 3.57Å; A276-G432 WeakPolarHBondContact O-CA 3.33Å; A279-G432 VanDerWaalsContact CB-N 3.34Å; D280-G432 WeakPolarHBondContact OD1-CA 3.25Å; G432-A434 PolarHBondContact O-N 3.23Å; G432-N435 PolarHBondContact O-N 2.92Å; G432-Q436 WeakPolarHBondContact O-CG 3.46Å; G432-Q436 PolarHBondContact O-NE2 3.17Å
433	L	96.2	Very high	96.1	Very high	5 Å²	5	59.8 Å²	59.8	3%	0.026	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-64.3	-43.7	-171.2	-175	62.5	0	0	0	112.5	A276 D280 N435 Q436 I446 P449	A276-L433 HydrophobicContact CB-CB 4.5Å; A276-L433 HydrophobicContact CB-CD1 4.19Å; A276-L433 PolarHBondContact O-N 3.3Å; D280-L433 PolarHBondContact OD1-N 2.98Å; L433-N435 PolarHBondContact O-N 2.03Å; L433-Q436 PolarHBondContact O-N 2.53Å; L433-Q436 VanDerWaalsContact O-N 3.08Å; L433-I446 HydrophobicContact CD1-CG2 4.43Å; L433-I446 HydrophobicContact CG-CB 4.32Å; L433-I446 HydrophobicContact CG-CG2 4.34Å; L433-I446 VanDerWaalsContact O-CG2 3.27Å; L433-I446 WeakPolarHBondContact O-CG2 3.4Å; L433-P449 HydrophobicContact CD2-CB 3.95Å
434	A	95.7	Very high	96	Very high	71 Å²	71	54.4 Å²	54.4	59%	0.587	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-61.2	-30.4	-178.5	0	0	0	0	0	113	G432 Q436	G432-A434 PolarHBondContact O-N 3.23Å; A434-Q436 VanDerWaalsContact C-N 3.27Å; A434-Q436 PolarHBondContact O-N 3.19Å
435	N	96.7	Very high	95.8	Very high	94 Å²	94	56.7 Å²	56.7	50%	0.503	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-81.5	-2.5	-179.3	-71.8	-41.9	0	0	0	113.6	D431 G432 L433	D431-N435 PolarHBondContact O-ND2 3.49Å; G432-N435 PolarHBondContact O-N 2.92Å; L433-N435 PolarHBondContact O-N 2.03Å
436	Q	96.6	Very high	95.6	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.009	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-94	0.3	179.1	-52.6	-44.7	-57.6	0	0	114.5	A276 G430 G432 L433 A434 N438 N439 L444	A276-Q436 HydrophobicContact CB-CG 3.41Å; A276-Q436 VanDerWaalsContact CB-CG 3.41Å; G430-Q436 PolarHBondContact O-NE2 2.03Å; G432-Q436 WeakPolarHBondContact O-CG 3.46Å; G432-Q436 PolarHBondContact O-NE2 3.17Å; L433-Q436 PolarHBondContact O-N 2.53Å; L433-Q436 VanDerWaalsContact O-N 3.08Å; A434-Q436 VanDerWaalsContact C-N 3.27Å; A434-Q436 PolarHBondContact O-N 3.19Å; Q436-N438 PolarHBondContact O-N 3.16Å; Q436-N439 HydrophobicContact CB-CB 4.22Å; Q436-N439 VanDerWaalsContact O-CB 3.29Å; Q436-N439 WeakPolarHBondContact O-CB 3.34Å; Q436-N439 PolarHBondContact O-N 2.71Å; Q436-N439 PolarHBondContact OE1-ND2 3.04Å; Q436-L444 HydrophobicContact CB-CD1 3.89Å; Q436-L444 HydrophobicContact CG-CD1 4.02Å
437	I	94.9	Very high	95.5	Very high	106 Å²	106	55.5 Å²	55.5	54%	0.544	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-31.7	-177.4	-166.6	175.3	0	0	0	113.3	I446	I437-I446 HydrophobicContact CB-CD1 4.22Å; I437-I446 HydrophobicContact CB-CG2 4.38Å; I437-I446 HydrophobicContact CD1-CD1 3.83Å; I437-I446 HydrophobicContact CG1-CD1 4.12Å
438	N	95.5	Very high	95.3	Very high	129 Å²	129	60.3 Å²	60.3	69%	0.69	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.8	22.5	179.1	-62.5	-44.1	0	0	0	112.2	Q436 P440	Q436-N438 PolarHBondContact O-N 3.16Å; N438-P440 WeakPolarHBondContact O-CD 3.24Å
439	N	97.4	Very high	95.2	Very high	14 Å²	14	59.1 Å²	59.1	8%	0.075	33%	0.334	C	S	.	.			trans	-65.8	120.8	178.6	-174.1	-36	0	0	0	109.4	N269 M429 Q436 E441 V442	N269-N439 PolarHBondContact O-ND2 3.02Å; M429-N439 HydrophobicContact CG-CB 3.98Å; Q436-N439 HydrophobicContact CB-CB 4.22Å; Q436-N439 VanDerWaalsContact O-CB 3.29Å; Q436-N439 WeakPolarHBondContact O-CB 3.34Å; Q436-N439 PolarHBondContact O-N 2.71Å; Q436-N439 PolarHBondContact OE1-ND2 3.04Å; N439-E441 PolarHBondContact O-N 3.49Å; N439-E441 PolarHBondContact OD1-N 3.21Å; N439-V442 PolarHBondContact OD1-N 3.5Å
440	P	96.6	Very high	95.1	Very high	63 Å²	63	59.8 Å²	59.8	41%	0.409	34%	0.338	S	S	.	.	S	Bend	trans	-72.1	-15.5	-175.8	27.5	-33.7	0	0	0	113.7	Y424 P426 N438	Y424-P440 WeakPolarHBondContact OH-CG 3.48Å; P426-P440 HydrophobicContact CB-CG 3.9Å; P426-P440 HydrophobicContact CG-CG 4.26Å; N438-P440 WeakPolarHBondContact O-CD 3.24Å
441	E	97.2	Very high	95	Very high	32 Å²	32	65.1 Å²	65.1	15%	0.15	36%	0.356	C	S	.	.	S	Bend	trans	-110.6	-24.2	-170.9	-52.6	-50.7	146.7	0	0	114.4	A244 K247 Y266 N269 V270 Y424 N439	A244-E441 WeakPolarHBondContact CB-O 3.29Å; K247-E441 IonicContact NZ-OE2 3.06Å; Y266-E441 HydrophobicContact CD2-CG 3.7Å; Y266-E441 HydrophobicContact CE2-CB 4.2Å; Y266-E441 VanDerWaalsContact CE2-CD 3.42Å; Y266-E441 HydrophobicContact CE2-CG 3.62Å; Y266-E441 WeakPolarHBondContact CE2-OE2 3.49Å; N269-E441 HydrophobicContact CB-CG 3.99Å; V270-E441 HydrophobicContact CG2-CB 3.73Å; V270-E441 HydrophobicContact CG2-CG 4.2Å; Y424-E441 VanDerWaalsContact CE2-OE1 3.3Å; Y424-E441 WeakPolarHBondContact CE2-OE1 3.49Å; Y424-E441 WeakPolarHBondContact OH-CG 3.22Å; Y424-E441 PolarHBondContact OH-OE1 2.94Å; N439-E441 PolarHBondContact O-N 3.49Å; N439-E441 PolarHBondContact OD1-N 3.21Å
442	V	96.9	Very high	94.9	Very high	2 Å²	2	69.8 Å²	69.8	1%	0.012	37%	0.373	C	S	.	.			trans	-134	112.4	-179.4	-164.2	0	0	0	0	109.1	E240 A244 N439 L444	E240-V442 HydrophobicContact CB-CG1 4.31Å; A244-V442 HydrophobicContact CB-CG2 3.77Å; N439-V442 PolarHBondContact OD1-N 3.5Å; V442-L444 HydrophobicContact CB-CG 4.43Å; V442-L444 HydrophobicContact CG1-CD1 4.23Å; V442-L444 HydrophobicContact CG1-CD2 3.77Å; V442-L444 HydrophobicContact CG1-CG 3.81Å; V442-L444 PolarHBondContact O-N 3.39Å
443	D	94	Very high	94.9	Very high	137 Å²	137	69.5 Å²	69.5	73%	0.733	37%	0.371	S	S	*	.			trans	-80.8	114.9	174.9	-171.3	11.1	0	0	0	109.3	E240	E240-D443 WeakPolarHBondContact CB-O 3.41Å; E240-D443 WeakPolarHBondContact CG-O 3.29Å
444	L	92.9	Very high	95	Very high	27 Å²	27	73.7 Å²	73.7	14%	0.141	39%	0.386	C	S	.	.			trans	-126.6	133.7	-174.5	-65.6	173.3	0	0	0	111	G273 A276 Q436 V442 I446	G273-L444 WeakPolarHBondContact O-CD1 3Å; A276-L444 HydrophobicContact CB-CD1 4.18Å; Q436-L444 HydrophobicContact CB-CD1 3.89Å; Q436-L444 HydrophobicContact CG-CD1 4.02Å; V442-L444 HydrophobicContact CB-CG 4.43Å; V442-L444 HydrophobicContact CG1-CD1 4.23Å; V442-L444 HydrophobicContact CG1-CD2 3.77Å; V442-L444 HydrophobicContact CG1-CG 3.81Å; V442-L444 PolarHBondContact O-N 3.39Å; L444-I446 PolarHBondContact O-N 2.88Å; L444-I446 VanDerWaalsContact O-N 3.09Å
445	D	91.8	Very high	95.1	Very high	72 Å²	72	75.6 Å²	75.6	39%	0.385	38%	0.383	S	S	.	.			trans	-78	93.5	169.8	-173.1	-10	0	0	0	110.4	T447 K448	D445-T447 PolarHBondContact O-N 2.83Å; D445-T447 VanDerWaalsContact O-N 3.07Å; D445-T447 WeakPolarHBondContact OD1-CB 3.42Å; D445-T447 PolarHBondContact OD1-N 2.94Å; D445-T447 PolarHBondContact OD1-OG1 3.05Å; D445-K448 PolarHBondContact O-N 3.08Å; D445-K448 VanDerWaalsContact O-N 3.1Å; D445-K448 VanDerWaalsContact OD2-CD 3.29Å; D445-K448 WeakPolarHBondContact OD2-CD 3.49Å; D445-K448 VanDerWaalsContact OD2-CE 3.26Å; D445-K448 WeakPolarHBondContact OD2-CE 3.24Å; D445-K448 WeakPolarHBondContact OD2-CG 3.4Å; D445-K448 IonicContact OD2-NZ 3.85Å; D445-K448 PolarHBondContact OD2-NZ 3.12Å
446	I	92.1	Very high	95.1	Very high	57 Å²	57	71.6 Å²	71.6	29%	0.292	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-16.7	179.4	64.6	164.7	0	0	0	113.5	L433 I437 L444 K448	L433-I446 HydrophobicContact CD1-CG2 4.43Å; L433-I446 HydrophobicContact CG-CB 4.32Å; L433-I446 HydrophobicContact CG-CG2 4.34Å; L433-I446 VanDerWaalsContact O-CG2 3.27Å; L433-I446 WeakPolarHBondContact O-CG2 3.4Å; I437-I446 HydrophobicContact CB-CD1 4.22Å; I437-I446 HydrophobicContact CB-CG2 4.38Å; I437-I446 HydrophobicContact CD1-CD1 3.83Å; I437-I446 HydrophobicContact CG1-CD1 4.12Å; L444-I446 PolarHBondContact O-N 2.88Å; L444-I446 VanDerWaalsContact O-N 3.09Å; I446-K448 VanDerWaalsContact C-N 3.3Å
447	T	92.8	Very high	95.2	Very high	109 Å²	109	72.2 Å²	72.2	67%	0.669	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-11.2	179.6	74.8	0	0	0	0	112.8	D445 P449	D445-T447 PolarHBondContact O-N 2.83Å; D445-T447 VanDerWaalsContact O-N 3.07Å; D445-T447 WeakPolarHBondContact OD1-CB 3.42Å; D445-T447 PolarHBondContact OD1-N 2.94Å; D445-T447 PolarHBondContact OD1-OG1 3.05Å; T447-P449 VanDerWaalsContact C-CD 3.41Å; T447-P449 WeakPolarHBondContact O-CD 3.3Å
448	K	91.4	Very high	95.3	Very high	150 Å²	150	72.2 Å²	72.2	65%	0.652	36%	0.363	S	S	*	.	S	Bend	trans	-116.7	72.4	-178.8	-66.5	-175.7	-171.8	124.9	0	111.7	D445 I446	D445-K448 PolarHBondContact O-N 3.08Å; D445-K448 VanDerWaalsContact O-N 3.1Å; D445-K448 VanDerWaalsContact OD2-CD 3.29Å; D445-K448 WeakPolarHBondContact OD2-CD 3.49Å; D445-K448 VanDerWaalsContact OD2-CE 3.26Å; D445-K448 WeakPolarHBondContact OD2-CE 3.24Å; D445-K448 WeakPolarHBondContact OD2-CG 3.4Å; D445-K448 IonicContact OD2-NZ 3.85Å; D445-K448 PolarHBondContact OD2-NZ 3.12Å; I446-K448 VanDerWaalsContact C-N 3.3Å
449	P	93.3	Very high	95.4	Very high	39 Å²	39	69.5 Å²	69.5	25%	0.253	35%	0.346	S	S	.	.			trans	-66.1	151.4	175.5	29.1	-35.3	0	0	0	112	L433 T447 M451 R454	L433-P449 HydrophobicContact CD2-CB 3.95Å; T447-P449 VanDerWaalsContact C-CD 3.41Å; T447-P449 WeakPolarHBondContact O-CD 3.3Å; P449-M451 PolarHBondContact O-N 3Å; P449-R454 HydrophobicContact CB-CG 4.2Å; P449-R454 VanDerWaalsContact CB-NE 3.34Å; P449-R454 HydrophobicContact CG-CG 4.5Å
450	I	94.3	Very high	95.4	Very high	52 Å²	52	68.8 Å²	68.8	27%	0.267	34%	0.343	S	S	.	.			trans	-72	112.8	177.8	-61.3	175	0	0	0	109.6	V235 N277 K452 I453 R454	V235-I450 HydrophobicContact CG1-CD1 3.96Å; V235-I450 HydrophobicContact CG1-CG2 4.17Å; N277-I450 HydrophobicContact CB-CB 4.48Å; N277-I450 HydrophobicContact CB-CD1 4.04Å; N277-I450 HydrophobicContact CB-CG1 4.35Å; N277-I450 PolarHBondContact OD1-N 2.96Å; I450-K452 VanDerWaalsContact C-N 3.28Å; I450-K452 HydrophobicContact CG2-CB 4.16Å; I450-K452 PolarHBondContact O-N 3.31Å; I450-I453 HydrophobicContact CB-CB 4.3Å; I450-I453 HydrophobicContact CB-CG1 3.96Å; I450-I453 HydrophobicContact CG2-CB 4.45Å; I450-I453 HydrophobicContact CG2-CG1 3.9Å; I450-I453 WeakPolarHBondContact O-CB 3.44Å; I450-I453 PolarHBondContact O-N 2.03Å; I450-R454 PolarHBondContact O-N 3.4Å; I450-R454 VanDerWaalsContact O-N 3.12Å
451	M	95.1	Very high	95.5	Very high	147 Å²	147	70.4 Å²	70.4	72%	0.724	34%	0.343	S	S	*	.	H	α-helix	trans	-59.3	-35.6	-176.7	-68.1	-58.6	-165	0	0	113.6	P449 I453 R454 Q455	P449-M451 PolarHBondContact O-N 3Å; M451-I453 VanDerWaalsContact C-N 3.25Å; M451-I453 PolarHBondContact O-N 3.04Å; M451-R454 PolarHBondContact O-N 3.02Å; M451-Q455 PolarHBondContact O-N 3.16Å
452	K	95.7	Very high	95.4	Very high	151 Å²	151	71.7 Å²	71.7	66%	0.657	35%	0.35	S	S	*	.	H	α-helix	trans	-58.5	-38.4	175.1	-68.7	-176.9	179	178.1	0	112.2	I450 Q456	I450-K452 VanDerWaalsContact C-N 3.28Å; I450-K452 HydrophobicContact CG2-CB 4.16Å; I450-K452 PolarHBondContact O-N 3.31Å; K452-Q456 WeakPolarHBondContact O-CG 3.41Å; K452-Q456 PolarHBondContact O-N 2.89Å; K452-Q456 PolarHBondContact O-NE2 3.28Å
453	I	96.6	Very high	95.4	Very high	1 Å²	1	71.8 Å²	71.8	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-70.7	-45.5	176.9	-63.8	-64.4	0	0	0	110.5	V232 V235 N277 Q278 L281 I450 M451 Q455 Q456 I457	V232-I453 HydrophobicContact CB-CD1 4.18Å; V232-I453 HydrophobicContact CG1-CD1 3.68Å; V232-I453 HydrophobicContact CG2-CD1 3.95Å; V235-I453 HydrophobicContact CB-CD1 4.46Å; V235-I453 HydrophobicContact CG2-CD1 3.8Å; V235-I453 HydrophobicContact CG2-CG1 4.35Å; N277-I453 HydrophobicContact CB-CG1 4.21Å; N277-I453 HydrophobicContact CB-CG2 4.49Å; N277-I453 VanDerWaalsContact O-CG2 3.3Å; N277-I453 WeakPolarHBondContact O-CG2 3.46Å; Q278-I453 HydrophobicContact CG-CD1 4.3Å; L281-I453 HydrophobicContact CD1-CD1 4.37Å; L281-I453 HydrophobicContact CD1-CG2 3.56Å; L281-I453 HydrophobicContact CG-CG2 4.46Å; I450-I453 HydrophobicContact CB-CB 4.3Å; I450-I453 HydrophobicContact CB-CG1 3.96Å; I450-I453 HydrophobicContact CG2-CB 4.45Å; I450-I453 HydrophobicContact CG2-CG1 3.9Å; I450-I453 WeakPolarHBondContact O-CB 3.44Å; I450-I453 PolarHBondContact O-N 2.03Å; M451-I453 VanDerWaalsContact C-N 3.25Å; M451-I453 PolarHBondContact O-N 3.04Å; I453-Q455 VanDerWaalsContact C-N 3.27Å; I453-Q455 PolarHBondContact O-N 3.22Å; I453-Q456 PolarHBondContact O-N 3.23Å; I453-I457 HydrophobicContact CG2-CD1 4.31Å; I453-I457 PolarHBondContact O-N 2.88Å
454	R	97.1	Very high	95.5	Very high	93 Å²	93	65.3 Å²	65.3	35%	0.351	32%	0.316	S	S	.	.	H	α-helix	trans	-59.2	-37.7	177.1	-63.6	-62.4	-176.7	-160.5	-11.3	112.5	D280 P449 I450 M451 I457 M458	D280-R454 IonicContact OD2-CZ 3.22Å; D280-R454 VanDerWaalsContact OD2-CZ 3.26Å; D280-R454 IonicContact OD2-NH1 2.97Å; D280-R454 PolarHBondContact OD2-NH1 3.07Å; D280-R454 VanDerWaalsContact OD2-NH1 3.14Å; D280-R454 IonicContact OD2-NH2 2.76Å; D280-R454 PolarHBondContact OD2-NH2 3.27Å; P449-R454 HydrophobicContact CB-CG 4.2Å; P449-R454 VanDerWaalsContact CB-NE 3.34Å; P449-R454 HydrophobicContact CG-CG 4.5Å; I450-R454 PolarHBondContact O-N 3.4Å; I450-R454 VanDerWaalsContact O-N 3.12Å; M451-R454 PolarHBondContact O-N 3.02Å; R454-I457 WeakPolarHBondContact O-CB 3.34Å; R454-I457 PolarHBondContact O-N 2.83Å; R454-M458 PolarHBondContact O-N 3.46Å; R454-M458 VanDerWaalsContact O-N 3.12Å
455	Q	97.3	Very high	95.6	Very high	111 Å²	111	68.1 Å²	68.1	52%	0.519	33%	0.332	S	S	.	.	H	α-helix	trans	-60.2	-45.5	172.5	-173.6	-178.6	7.7	0	0	111.4	M451 I453 I457 M458 E459	M451-Q455 PolarHBondContact O-N 3.16Å; I453-Q455 VanDerWaalsContact C-N 3.27Å; I453-Q455 PolarHBondContact O-N 3.22Å; Q455-I457 VanDerWaalsContact C-N 3.3Å; Q455-I457 PolarHBondContact O-N 3.35Å; Q455-M458 WeakPolarHBondContact O-CB 3.37Å; Q455-M458 PolarHBondContact O-N 3.02Å; Q455-M458 VanDerWaalsContact O-N 3.07Å; Q455-E459 WeakPolarHBondContact O-CG 3.27Å; Q455-E459 PolarHBondContact O-N 3.33Å
456	Q	98.1	Very high	95.7	Very high	10 Å²	10	68.1 Å²	68.1	5%	0.047	33%	0.326	C	S	.	.	H	α-helix	trans	-66.5	-33.1	178.9	-58.9	-33.1	-75.5	0	0	112.5	V228 K231 V232 L281 K452 I453 M458 E459 L460	V228-Q456 HydrophobicContact CG1-CB 3.89Å; V228-Q456 HydrophobicContact CG1-CG 4.41Å; V228-Q456 HydrophobicContact CG2-CB 4.29Å; K231-Q456 HydrophobicContact CB-CG 4.31Å; V232-Q456 HydrophobicContact CG2-CB 4.01Å; V232-Q456 HydrophobicContact CG2-CG 3.81Å; L281-Q456 HydrophobicContact CD2-CB 4.36Å; K452-Q456 WeakPolarHBondContact O-CG 3.41Å; K452-Q456 PolarHBondContact O-N 2.89Å; K452-Q456 PolarHBondContact O-NE2 3.28Å; I453-Q456 PolarHBondContact O-N 3.23Å; Q456-M458 VanDerWaalsContact C-N 3.28Å; Q456-M458 PolarHBondContact O-N 3.3Å; Q456-E459 PolarHBondContact O-N 3.46Å; Q456-L460 WeakPolarHBondContact O-CG 3.33Å; Q456-L460 PolarHBondContact O-N 2.97Å
457	I	98.1	Very high	95.9	Very high	15 Å²	15	65.4 Å²	65.4	8%	0.077	31%	0.312	C	S	.	.	H	α-helix	trans	-59.6	-42	171.2	-67	174.2	0	0	0	110.5	D280 L281 V284 I453 R454 Q455 L460 K461	D280-I457 HydrophobicContact CB-CD1 4.11Å; L281-I457 HydrophobicContact CG-CG1 3.87Å; V284-I457 HydrophobicContact CG2-CG2 3.92Å; I453-I457 HydrophobicContact CG2-CD1 4.31Å; I453-I457 PolarHBondContact O-N 2.88Å; R454-I457 WeakPolarHBondContact O-CB 3.34Å; R454-I457 PolarHBondContact O-N 2.83Å; Q455-I457 VanDerWaalsContact C-N 3.3Å; Q455-I457 PolarHBondContact O-N 3.35Å; I457-L460 PolarHBondContact O-N 3.09Å; I457-K461 WeakPolarHBondContact O-CG 3.47Å; I457-K461 PolarHBondContact O-N 2.84Å
458	M	97.3	Very high	96	Very high	105 Å²	105	63.6 Å²	63.6	52%	0.517	30%	0.295	S	S	.	.	H	α-helix	trans	-65.2	-43.7	177	-171.3	63.6	-170.1	0	0	111.9	R454 Q455 Q456 L460 K461 I462	R454-M458 PolarHBondContact O-N 3.46Å; R454-M458 VanDerWaalsContact O-N 3.12Å; Q455-M458 WeakPolarHBondContact O-CB 3.37Å; Q455-M458 PolarHBondContact O-N 3.02Å; Q455-M458 VanDerWaalsContact O-N 3.07Å; Q456-M458 VanDerWaalsContact C-N 3.28Å; Q456-M458 PolarHBondContact O-N 3.3Å; M458-L460 VanDerWaalsContact C-N 3.33Å; M458-L460 PolarHBondContact O-N 2.93Å; M458-K461 WeakPolarHBondContact O-CB 3.2Å; M458-K461 PolarHBondContact O-N 3.5Å; M458-K461 VanDerWaalsContact O-N 3.12Å; M458-I462 HydrophobicContact CE-CD1 4Å; M458-I462 HydrophobicContact CE-CG1 3.9Å; M458-I462 HydrophobicContact CG-CD1 4.05Å; M458-I462 HydrophobicContact CG-CG1 4.48Å; M458-I462 WeakPolarHBondContact O-CG1 3.37Å; M458-I462 PolarHBondContact O-N 3.33Å
459	E	97.4	Very high	96.1	Very high	72 Å²	72	59 Å²	59	34%	0.336	28%	0.278	S	S	.	.	H	α-helix	trans	-56.2	-46.3	175.5	-65.9	-65.1	157.2	0	0	111.7	V228 Q455 Q456 K461 I462 M463	V228-E459 HydrophobicContact CG2-CB 4.25Å; Q455-E459 WeakPolarHBondContact O-CG 3.27Å; Q455-E459 PolarHBondContact O-N 3.33Å; Q456-E459 PolarHBondContact O-N 3.46Å; E459-K461 VanDerWaalsContact C-N 3.34Å; E459-K461 PolarHBondContact O-N 2.77Å; E459-I462 PolarHBondContact O-N 3.46Å; E459-M463 PolarHBondContact O-N 3.13Å
460	L	97.9	Very high	96.1	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.5	-39.2	176.8	-63.9	178.7	0	0	0	111.8	V228 L281 V284 W285 L288 Q456 I457 M458 M463 S464	V228-L460 HydrophobicContact CB-CD2 3.98Å; V228-L460 HydrophobicContact CB-CG 4.49Å; V228-L460 HydrophobicContact CG1-CD1 4.05Å; V228-L460 HydrophobicContact CG1-CD2 3.95Å; V228-L460 HydrophobicContact CG1-CG 4.04Å; V228-L460 HydrophobicContact CG2-CD2 3.77Å; V228-L460 HydrophobicContact CG2-CG 4.13Å; L281-L460 HydrophobicContact CD2-CD1 3.87Å; V284-L460 HydrophobicContact CG1-CB 3.58Å; W285-L460 HydrophobicContact CE3-CD1 4.02Å; W285-L460 HydrophobicContact CE3-CD2 4.29Å; W285-L460 HydrophobicContact CZ3-CD2 4.37Å; L288-L460 HydrophobicContact CD2-CB 4.49Å; L288-L460 HydrophobicContact CD2-CD2 3.53Å; Q456-L460 WeakPolarHBondContact O-CG 3.33Å; Q456-L460 PolarHBondContact O-N 2.97Å; I457-L460 PolarHBondContact O-N 3.09Å; M458-L460 VanDerWaalsContact C-N 3.33Å; M458-L460 PolarHBondContact O-N 2.93Å; L460-M463 PolarHBondContact O-N 3.12Å; L460-S464 WeakPolarHBondContact O-CB 3.5Å; L460-S464 PolarHBondContact O-N 3.28Å; L460-S464 PolarHBondContact O-OG 2.79Å; L460-S464 VanDerWaalsContact O-OG 3.08Å
461	K	97.6	Very high	95.8	Very high	97 Å²	97	56.3 Å²	56.3	42%	0.422	26%	0.261	S	S	.	.	H	α-helix	trans	-63.2	-44.8	176.5	-75.3	-178	179.1	-173.6	0	112.4	V284 I457 M458 E459 M463 S464 N465	V284-K461 HydrophobicContact CB-CG 4.5Å; V284-K461 HydrophobicContact CG1-CB 4.46Å; V284-K461 HydrophobicContact CG1-CG 3.61Å; V284-K461 HydrophobicContact CG2-CD 4.46Å; V284-K461 HydrophobicContact CG2-CG 3.99Å; I457-K461 WeakPolarHBondContact O-CG 3.47Å; I457-K461 PolarHBondContact O-N 2.84Å; M458-K461 WeakPolarHBondContact O-CB 3.2Å; M458-K461 PolarHBondContact O-N 3.5Å; M458-K461 VanDerWaalsContact O-N 3.12Å; E459-K461 VanDerWaalsContact C-N 3.34Å; E459-K461 PolarHBondContact O-N 2.77Å; K461-M463 VanDerWaalsContact C-N 3.3Å; K461-M463 PolarHBondContact O-N 3.28Å; K461-S464 PolarHBondContact O-N 2.97Å; K461-N465 PolarHBondContact O-N 3.26Å
462	I	95.8	Very high	95.4	Very high	58 Å²	58	56.1 Å²	56.1	30%	0.297	26%	0.259	S	S	.	.	H	α-helix	trans	-59.1	-47.6	177.1	-67.2	165.8	0	0	0	109.2	M458 E459 S464 N465 R466	M458-I462 HydrophobicContact CE-CD1 4Å; M458-I462 HydrophobicContact CE-CG1 3.9Å; M458-I462 HydrophobicContact CG-CD1 4.05Å; M458-I462 HydrophobicContact CG-CG1 4.48Å; M458-I462 WeakPolarHBondContact O-CG1 3.37Å; M458-I462 PolarHBondContact O-N 3.33Å; E459-I462 PolarHBondContact O-N 3.46Å; I462-S464 PolarHBondContact O-N 2.98Å; I462-N465 PolarHBondContact O-N 2.83Å; I462-R466 WeakPolarHBondContact O-CG 3.46Å; I462-R466 PolarHBondContact O-N 3.11Å
463	M	96.8	Very high	94.7	Very high	5 Å²	5	49.9 Å²	49.9	3%	0.025	24%	0.237	C	C	.	.	H	α-helix	trans	-64.7	-40.7	179.3	-166.1	65.6	-112.5	0	0	112.7	S217 Q220 V224 L288 E459 L460 K461 N465 R466 L467	S217-M463 WeakPolarHBondContact O-CE 3.48Å; Q220-M463 HydrophobicContact CB-CE 4.31Å; Q220-M463 HydrophobicContact CB-SD 4.3Å; V224-M463 HydrophobicContact CB-CG 4.18Å; V224-M463 HydrophobicContact CB-SD 4.3Å; V224-M463 HydrophobicContact CG1-CB 4.13Å; V224-M463 HydrophobicContact CG1-CG 4.21Å; V224-M463 HydrophobicContact CG2-CG 4.45Å; V224-M463 HydrophobicContact CG2-SD 3.96Å; L288-M463 HydrophobicContact CD1-CB 4.38Å; L288-M463 HydrophobicContact CD1-CG 4.25Å; E459-M463 PolarHBondContact O-N 3.13Å; L460-M463 PolarHBondContact O-N 3.12Å; K461-M463 VanDerWaalsContact C-N 3.3Å; K461-M463 PolarHBondContact O-N 3.28Å; M463-N465 VanDerWaalsContact C-N 3.32Å; M463-N465 PolarHBondContact O-N 3.43Å; M463-R466 HydrophobicContact CE-CB 3.85Å; M463-R466 PolarHBondContact O-N 2.81Å; M463-L467 HydrophobicContact CE-CD1 4.38Å; M463-L467 HydrophobicContact CE-CD2 4.19Å; M463-L467 HydrophobicContact CE-CG 3.77Å; M463-L467 HydrophobicContact CG-CD1 4.42Å; M463-L467 WeakPolarHBondContact O-CG 3.3Å; M463-L467 PolarHBondContact O-N 3.47Å
464	S	96.6	Very high	94	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.007	26%	0.255	C	S	.	.	H	α-helix	trans	-59.1	-43.3	174.2	-69	0	0	0	0	111.9	L288 L460 K461 I462 L467 K468	L288-S464 WeakPolarHBondContact CA-OG 3.42Å; L288-S464 WeakPolarHBondContact CB-OG 2.93Å; L288-S464 WeakPolarHBondContact CD1-OG 3.4Å; L460-S464 WeakPolarHBondContact O-CB 3.5Å; L460-S464 PolarHBondContact O-N 3.28Å; L460-S464 PolarHBondContact O-OG 2.79Å; L460-S464 VanDerWaalsContact O-OG 3.08Å; K461-S464 PolarHBondContact O-N 2.97Å; I462-S464 PolarHBondContact O-N 2.98Å; S464-L467 PolarHBondContact O-N 3.21Å; S464-K468 WeakPolarHBondContact O-CG 3.02Å; S464-K468 PolarHBondContact O-N 3.39Å; S464-K468 VanDerWaalsContact O-N 3.12Å
465	N	95	Very high	93.1	Very high	86 Å²	86	50.1 Å²	50.1	46%	0.46	25%	0.245	S	C	.	.	H	α-helix	trans	-65.6	-47	177.1	-71.5	-16.6	0	0	0	111.4	K461 I462 M463 L467 K468 D469	K461-N465 PolarHBondContact O-N 3.26Å; I462-N465 PolarHBondContact O-N 2.83Å; M463-N465 VanDerWaalsContact C-N 3.32Å; M463-N465 PolarHBondContact O-N 3.43Å; N465-L467 VanDerWaalsContact C-N 3.26Å; N465-L467 PolarHBondContact O-N 3.29Å; N465-K468 WeakPolarHBondContact O-CA 3.4Å; N465-K468 WeakPolarHBondContact O-CB 3.5Å; N465-K468 PolarHBondContact O-N 2.97Å; N465-D469 PolarHBondContact O-N 3.05Å
466	R	94.1	Very high	91.7	Very high	71 Å²	71	46 Å²	46	27%	0.268	23%	0.227	S	C	.	.	H	α-helix	trans	-55.2	-40.6	175.5	-74.5	179.4	176.1	-178.2	-4.5	112.7	I462 M463 D469 A470 V476 D477 D480	I462-R466 WeakPolarHBondContact O-CG 3.46Å; I462-R466 PolarHBondContact O-N 3.11Å; M463-R466 HydrophobicContact CE-CB 3.85Å; M463-R466 PolarHBondContact O-N 2.81Å; R466-D469 PolarHBondContact O-N 2.78Å; R466-A470 VanDerWaalsContact O-CB 3.26Å; R466-A470 WeakPolarHBondContact O-CB 3.12Å; R466-A470 PolarHBondContact O-N 2.92Å; R466-V476 HydrophobicContact CG-CB 4.39Å; R466-V476 HydrophobicContact CG-CG1 4.4Å; R466-D477 IonicContact CZ-OD1 3.93Å; R466-D477 IonicContact NH1-OD1 3.26Å; R466-D480 IonicContact CZ-OD2 3.35Å; R466-D480 IonicContact NH2-OD2 2.95Å; R466-D480 PolarHBondContact NH2-OD2 2.97Å
467	L	96.1	Very high	90.1	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66.1	-37	175.5	-73.8	165.3	0	0	0	112.8	S217 L288 T291 M292 V295 M463 S464 N465 A470 L471	S217-L467 WeakPolarHBondContact O-CD2 3.37Å; L288-L467 HydrophobicContact CD1-CD1 3.51Å; T291-L467 HydrophobicContact CG2-CB 3.64Å; M292-L467 HydrophobicContact CG-CD1 3.6Å; V295-L467 HydrophobicContact CG2-CB 4.2Å; V295-L467 HydrophobicContact CG2-CD2 4.1Å; M463-L467 HydrophobicContact CE-CD1 4.38Å; M463-L467 HydrophobicContact CE-CD2 4.19Å; M463-L467 HydrophobicContact CE-CG 3.77Å; M463-L467 HydrophobicContact CG-CD1 4.42Å; M463-L467 WeakPolarHBondContact O-CG 3.3Å; M463-L467 PolarHBondContact O-N 3.47Å; S464-L467 PolarHBondContact O-N 3.21Å; N465-L467 VanDerWaalsContact C-N 3.26Å; N465-L467 PolarHBondContact O-N 3.29Å; L467-A470 PolarHBondContact O-N 2.9Å; L467-L471 PolarHBondContact O-N 3.22Å; L467-L471 VanDerWaalsContact O-N 3.12Å
468	K	95.1	Very high	88.1	Confident	72 Å²	72	49 Å²	49	31%	0.313	24%	0.241	S	C	.	.	H	α-helix	trans	-67	-44.8	175	-69.8	172.2	-173.8	173	0	111.3	E287 T291 S464 N465 A470 L471 E472	E287-K468 IonicContact OE1-NZ 3.96Å; E287-K468 PolarHBondContact OE1-NZ 3.19Å; T291-K468 HydrophobicContact CG2-CG 3.85Å; S464-K468 WeakPolarHBondContact O-CG 3.02Å; S464-K468 PolarHBondContact O-N 3.39Å; S464-K468 VanDerWaalsContact O-N 3.12Å; N465-K468 WeakPolarHBondContact O-CA 3.4Å; N465-K468 WeakPolarHBondContact O-CB 3.5Å; N465-K468 PolarHBondContact O-N 2.97Å; K468-A470 VanDerWaalsContact C-N 3.27Å; K468-A470 PolarHBondContact O-N 2.99Å; K468-L471 WeakPolarHBondContact O-CB 3.2Å; K468-L471 PolarHBondContact O-N 2.83Å; K468-L471 VanDerWaalsContact O-N 3.09Å; K468-E472 PolarHBondContact O-N 3.23Å
469	D	93	Very high	86.1	Confident	54 Å²	54	48.7 Å²	48.7	29%	0.289	24%	0.239	S	C	.	.	H	α-helix	trans	-61.2	-40.3	176.4	-62.7	-30.9	0	0	0	110.8	N465 R466 L471 E472 G473 N474 V476	N465-D469 PolarHBondContact O-N 3.05Å; R466-D469 PolarHBondContact O-N 2.78Å; D469-L471 VanDerWaalsContact C-N 3.3Å; D469-L471 PolarHBondContact O-N 2.79Å; D469-E472 WeakPolarHBondContact O-CB 3.24Å; D469-E472 PolarHBondContact O-N 3.36Å; D469-E472 VanDerWaalsContact O-N 3.12Å; D469-G473 PolarHBondContact O-N 2.97Å; D469-G473 VanDerWaalsContact O-N 3.14Å; D469-N474 HydrophobicContact CB-CB 4.25Å; D469-N474 PolarHBondContact O-N 2.87Å; D469-V476 HydrophobicContact CB-CG2 3.42Å; D469-V476 VanDerWaalsContact CB-CG2 3.42Å; D469-V476 WeakPolarHBondContact OD2-CG2 3.41Å
470	A	92.5	Very high	84	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-65.7	-26.7	175.7	0	0	0	0	0	114.1	V213 T214 S217 R466 L467 K468 E472 G473	V213-A470 HydrophobicContact CG1-CB 3.9Å; T214-A470 PolarHBondContact OG1-O 2.7Å; S217-A470 VanDerWaalsContact OG-CB 3.31Å; S217-A470 WeakPolarHBondContact OG-CB 3.39Å; R466-A470 VanDerWaalsContact O-CB 3.26Å; R466-A470 WeakPolarHBondContact O-CB 3.12Å; R466-A470 PolarHBondContact O-N 2.92Å; L467-A470 PolarHBondContact O-N 2.9Å; K468-A470 VanDerWaalsContact C-N 3.27Å; K468-A470 PolarHBondContact O-N 2.99Å; A470-E472 VanDerWaalsContact C-N 3.34Å; A470-G473 PolarHBondContact O-N 3.27Å
471	L	88.9	Confident	82	Confident	34 Å²	34	52.9 Å²	52.9	18%	0.178	27%	0.273	C	S	.	.	H	α-helix	trans	-68.5	-35.7	171.8	-78.9	169.7	0	0	0	112	R210 Q294 V295 L467 K468 D469 G473	R210-L471 PolarHBondContact NE-O 3.06Å; R210-L471 PolarHBondContact NH2-O 2.78Å; Q294-L471 HydrophobicContact CB-CD1 4.24Å; V295-L471 HydrophobicContact CB-CD2 4.35Å; V295-L471 HydrophobicContact CG2-CD1 3.96Å; V295-L471 HydrophobicContact CG2-CD2 3.8Å; V295-L471 HydrophobicContact CG2-CG 3.67Å; L467-L471 PolarHBondContact O-N 3.22Å; L467-L471 VanDerWaalsContact O-N 3.12Å; K468-L471 WeakPolarHBondContact O-CB 3.2Å; K468-L471 PolarHBondContact O-N 2.83Å; K468-L471 VanDerWaalsContact O-N 3.09Å; D469-L471 VanDerWaalsContact C-N 3.3Å; D469-L471 PolarHBondContact O-N 2.79Å; L471-G473 PolarHBondContact O-N 3.46Å
472	E	86.4	Confident	79.5	Confident	143 Å²	143	51.1 Å²	51.1	67%	0.668	27%	0.273	S	S	*	.	H	α-helix	trans	-75.2	-13.3	174.9	-61.5	-175.9	176	0	0	112.2	K468 D469 A470 N474	K468-E472 PolarHBondContact O-N 3.23Å; D469-E472 WeakPolarHBondContact O-CB 3.24Å; D469-E472 PolarHBondContact O-N 3.36Å; D469-E472 VanDerWaalsContact O-N 3.12Å; A470-E472 VanDerWaalsContact C-N 3.34Å; E472-N474 PolarHBondContact OE2-ND2 2.97Å
473	G	80.5	Confident	77.1	Confident	19 Å²	19	54.8 Å²	54.8	20%	0.196	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.3	13.8	-179.5	0	0	0	0	0	113.8	D469 A470 L471	D469-G473 PolarHBondContact O-N 2.97Å; D469-G473 VanDerWaalsContact O-N 3.14Å; A470-G473 PolarHBondContact O-N 3.27Å; L471-G473 PolarHBondContact O-N 3.46Å
474	N	83.3	Confident	74.5	Confident	71 Å²	71	62.9 Å²	62.9	38%	0.38	33%	0.332	S	S	.	.			trans	-85.8	130.1	178.3	-60.1	-41	0	0	0	110.4	V213 D469 E472	V213-N474 WeakPolarHBondContact CG1-O 3.48Å; D469-N474 HydrophobicContact CB-CB 4.25Å; D469-N474 PolarHBondContact O-N 2.87Å; E472-N474 PolarHBondContact OE2-ND2 2.97Å
475	D	77.1	Confident	71.9	Confident	28 Å²	28	69.2 Å²	69.2	15%	0.15	36%	0.364	C	S	.	.			trans	-93.6	99.4	175.9	-170.7	-4.5	0	0	0	111.5	Y145 V213 D477 F478	Y145-D475 WeakPolarHBondContact CE2-OD2 3.47Å; Y145-D475 VanDerWaalsContact CZ-OD2 3.24Å; Y145-D475 PolarHBondContact OH-OD1 2.94Å; Y145-D475 PolarHBondContact OH-OD2 3.43Å; V213-D475 HydrophobicContact CG1-CB 4.45Å; V213-D475 HydrophobicContact CG2-CB 3.88Å; D475-D477 PolarHBondContact OD1-N 3.03Å; D475-D477 VanDerWaalsContact OD1-N 3.17Å; D475-F478 PolarHBondContact OD1-N 2.03Å
476	V	68.8	Low	69.4	Low	24 Å²	24	70.1 Å²	70.1	15%	0.145	38%	0.377	C	S	.	.	H	α-helix	trans	-79	-27.6	-178.4	-166.1	0	0	0	0	112.1	R466 D469 F478 Q479 D480	R466-V476 HydrophobicContact CG-CB 4.39Å; R466-V476 HydrophobicContact CG-CG1 4.4Å; D469-V476 HydrophobicContact CB-CG2 3.42Å; D469-V476 VanDerWaalsContact CB-CG2 3.42Å; D469-V476 WeakPolarHBondContact OD2-CG2 3.41Å; V476-F478 VanDerWaalsContact C-N 3.26Å; V476-F478 PolarHBondContact O-N 3.21Å; V476-Q479 PolarHBondContact O-N 3.32Å; V476-D480 PolarHBondContact O-N 3.4Å; V476-D480 VanDerWaalsContact O-N 3.11Å
477	D	63.7	Low	66.7	Low	29 Å²	29	70.5 Å²	70.5	16%	0.155	40%	0.403	C	S	.	.	H	α-helix	trans	-67.4	-29	-178.3	-85.9	-5.8	0	0	0	111.8	R216 Q220 R466 D475	R216-D477 IonicContact CZ-OD2 3.03Å; R216-D477 VanDerWaalsContact CZ-OD2 3.22Å; R216-D477 IonicContact NE-OD2 3.74Å; R216-D477 PolarHBondContact NE-OD2 3.42Å; R216-D477 IonicContact NH2-OD2 3.81Å; R216-D477 PolarHBondContact NH2-OD2 2.96Å; Q220-D477 PolarHBondContact NE2-OD2 3.45Å; Q220-D477 PolarHBondContact OE1-OD2 3.33Å; R466-D477 IonicContact CZ-OD1 3.93Å; R466-D477 IonicContact NH1-OD1 3.26Å; D475-D477 PolarHBondContact OD1-N 3.03Å; D475-D477 VanDerWaalsContact OD1-N 3.17Å
478	F	56.8	Low	63.8	Low	59 Å²	59	76 Å²	76	26%	0.259	44%	0.442	S	S	.	.	H	α-helix	trans	-78.9	-35.2	172.9	-177.9	-102.3	0	0	0	112.8	N152 D475 V476 A481 S482	N152-F478 HydrophobicContact CB-CD2 4.12Å; N152-F478 HydrophobicContact CB-CE1 4.2Å; N152-F478 HydrophobicContact CB-CE2 3.65Å; N152-F478 HydrophobicContact CB-CZ 3.69Å; D475-F478 PolarHBondContact OD1-N 2.03Å; V476-F478 VanDerWaalsContact C-N 3.26Å; V476-F478 PolarHBondContact O-N 3.21Å; F478-A481 PolarHBondContact O-N 3.04Å; F478-S482 PolarHBondContact O-N 3.47Å; F478-S482 VanDerWaalsContact O-N 3.12Å; F478-S482 PolarHBondContact O-OG 3.16Å
479	Q	55.6	Low	61	Low	100 Å²	100	76 Å²	76	47%	0.467	46%	0.463	S	S	.	.	H	α-helix	trans	-63.3	-44.2	177.6	-68.6	177.7	3.9	0	0	110.9	V476 A481 S482 E483	V476-Q479 PolarHBondContact O-N 3.32Å; Q479-A481 VanDerWaalsContact C-N 3.29Å; Q479-A481 PolarHBondContact O-N 2.94Å; Q479-S482 PolarHBondContact O-N 3.32Å; Q479-S482 PolarHBondContact O-OG 3.49Å; Q479-E483 WeakPolarHBondContact O-CG 3.35Å; Q479-E483 PolarHBondContact O-N 2.89Å
480	D	53.3	Low	58.3	Low	92 Å²	92	79.1 Å²	79.1	49%	0.492	49%	0.489	S	S	.	.	H	α-helix	trans	-65.8	-26.6	177	-74.5	-16.2	0	0	0	113.3	R466 V476	R466-D480 IonicContact CZ-OD2 3.35Å; R466-D480 IonicContact NH2-OD2 2.95Å; R466-D480 PolarHBondContact NH2-OD2 2.97Å; V476-D480 PolarHBondContact O-N 3.4Å; V476-D480 VanDerWaalsContact O-N 3.11Å
481	A	54.4	Low	55.6	Low	68 Å²	68	82.2 Å²	82.2	56%	0.562	52%	0.52	S	S	*	.	H	α-helix	trans	-86.4	-17.6	179.1	0	0	0	0	0	113.8	A150 F478 Q479	A150-A481 HydrophobicContact CB-CB 4.24Å; F478-A481 PolarHBondContact O-N 3.04Å; Q479-A481 VanDerWaalsContact C-N 3.29Å; Q479-A481 PolarHBondContact O-N 2.94Å
482	S	46.8	Very low	53	Low	60 Å²	60	89 Å²	89	42%	0.42	55%	0.553	S	S	.	*	H	α-helix	trans	-101.2	-6.7	-179.5	54.4	0	0	0	0	113.4	F478 Q479 D484	F478-S482 PolarHBondContact O-N 3.47Å; F478-S482 VanDerWaalsContact O-N 3.12Å; F478-S482 PolarHBondContact O-OG 3.16Å; Q479-S482 PolarHBondContact O-N 3.32Å; Q479-S482 PolarHBondContact O-OG 3.49Å; S482-D484 PolarHBondContact O-N 3.12Å; S482-D484 VanDerWaalsContact O-N 3.08Å
483	E	43.7	Very low	50.9	Low	134 Å²	134	87.6 Å²	87.6	63%	0.626	56%	0.558	S	S	*	*			trans	-84.7	72.3	176.4	-75.5	-168.3	177.8	0	0	113.7	Q479 I485	Q479-E483 WeakPolarHBondContact O-CG 3.35Å; Q479-E483 PolarHBondContact O-N 2.89Å; E483-I485 HydrophobicContact CG-CG2 4.45Å
484	D	43.3	Very low	48.9	Very low	176 Å²	176	93.9 Å²	93.9	94%	0.941	59%	0.586	S	S	*	*			trans	-91.3	33.7	137.8	-107.4	-20.4	0	0	0	109.4	S482 S486	S482-D484 PolarHBondContact O-N 3.12Å; S482-D484 VanDerWaalsContact O-N 3.08Å; D484-S486 PolarHBondContact O-N 2.93Å
485	I	42.1	Very low	46.9	Very low	133 Å²	133	96.2 Å²	96.2	68%	0.682	61%	0.608	S	S	*	*			trans	-94.2	91.2	-178.2	-114.5	164.9	0	0	0	110.2	E483 G487	E483-I485 HydrophobicContact CG-CG2 4.45Å; I485-G487 PolarHBondContact O-N 3.36Å
486	S	42.4	Very low	45.5	Very low	105 Å²	105	98.3 Å²	98.3	73%	0.734	64%	0.637	S	S	*	*			trans	10.8	100.5	148.8	-177.4	0	0	0	0	116.1	D484 S488	D484-S486 PolarHBondContact O-N 2.93Å; S486-S488 PolarHBondContact O-N 2.98Å
487	G	37.8	Very low	44.4	Very low	79 Å²	79	106.5 Å²	106.5	81%	0.814	67%	0.673	S	S	*	*			trans	-49.7	107.9	171.5	0	0	0	0	0	112.8	I485 G489	I485-G487 PolarHBondContact O-N 3.36Å; G487-G489 PolarHBondContact O-N 2.97Å; G487-G489 VanDerWaalsContact O-N 3.14Å
488	S	35	Very low	43	Very low	115 Å²	115	110.7 Å²	110.7	80%	0.804	70%	0.704	S	S	*	*			trans	-84.9	83.4	172.1	-134.7	0	0	0	0	108.7	S486 S490	S486-S488 PolarHBondContact O-N 2.98Å; S488-S490 PolarHBondContact O-N 3.44Å
489	G	35.6	Very low	42	Very low	74 Å²	74	112.7 Å²	112.7	76%	0.763	73%	0.731	S	S	*	*			trans	-61.6	103.3	167.4	0	0	0	0	0	109.4	G487 G491	G487-G489 PolarHBondContact O-N 2.97Å; G487-G489 VanDerWaalsContact O-N 3.14Å; G489-G491 VanDerWaalsContact C-N 3.27Å; G489-G491 PolarHBondContact O-N 3.24Å
490	S	35.7	Very low	41.2	Very low	119 Å²	119	119.4 Å²	119.4	83%	0.832	75%	0.752	S	S	*	*			trans	-71	84	173	-67	0	0	0	0	109.9	S488 M492	S488-S490 PolarHBondContact O-N 3.44Å; S490-M492 PolarHBondContact O-N 3.01Å
491	G	36.5	Very low	40.1	Very low	64 Å²	64	121 Å²	121	66%	0.66	77%	0.77	S	S	*	*			trans	-80	100.7	165.5	0	0	0	0	0	109.9	G489 C493	G489-G491 VanDerWaalsContact C-N 3.27Å; G489-G491 PolarHBondContact O-N 3.24Å; G491-C493 PolarHBondContact O-N 3.21Å; G491-C493 VanDerWaalsContact O-N 3.13Å
492	M	35.2	Very low	38.9	Very low	176 Å²	176	129.2 Å²	129.2	87%	0.867	79%	0.787	S	S	*	*			trans	-61.2	111.2	168.3	-81.6	-163.9	-89.4	0	0	110	S490	S490-M492 PolarHBondContact O-N 3.01Å
493	C	41.3	Very low	38.9	Very low	115 Å²	115	132.1 Å²	132.1	78%	0.777	80%	0.804	S	S	*	*			trans	-94.2	100.6	165.3	-69.4	0	0	0	0	108.8	G491	G491-C493 PolarHBondContact O-N 3.21Å; G491-C493 VanDerWaalsContact O-N 3.13Å
494	L	39.2	Very low	38.1	Very low	150 Å²	150	129.3 Å²	129.3	79%	0.785	81%	0.811	S	S	*	*			trans	-98.7	128.7	163.6	-91.1	151.7	0	0	0	108.7
495	S	41.2	Very low	37.4	Very low	120 Å²	120	127.8 Å²	127.8	84%	0.839	80%	0.802	S	S	*	*	S	Bend	trans	81.8	81.2	176	-51.4	0	0	0	0	116.6
496	G	46.8	Very low	36.8	Very low	72 Å²	72	131.4 Å²	131.4	74%	0.742	81%	0.809	S	S	*	*	S	Bend	trans	48.8	83.1	132.6	0	0	0	0	0	119.2
497	Q	45.3	Very low	36.2	Very low	196 Å²	196	130 Å²	130	92%	0.916	80%	0.804	S	S	*	*				169.5	96.7	128.8	-93.1	163.4	39.6	0	0	109.2
498	C	36.3	Very low	35.8	Very low	118 Å²	118	137.1 Å²	137.1	80%	0.797	81%	0.808	S	S	*	*			trans	-109.8	99.7	162.9	-72.5	0	0	0	0	108.2
499	A	34.5	Very low	35.9	Very low	100 Å²	100	135.7 Å²	135.7	83%	0.826	80%	0.803	S	S	*	*			trans	-70.5	124.9	171.6	0	0	0	0	0	109.6	S501	A499-S501 PolarHBondContact O-N 3.42Å
500	R	38.8	Very low	36.1	Very low	242 Å²	242	137.5 Å²	137.5	91%	0.913	80%	0.801	S	S	*	*			trans	-62.7	124.5	166.6	-83.4	178.7	170.1	165.8	-3.1	109
501	S	31	Very low	35.9	Very low	125 Å²	125	139.7 Å²	139.7	87%	0.874	80%	0.798	S	S	*	*			trans	-161.9	124.4	154.8	-75.8	0	0	0	0	111.5	A499	A499-S501 PolarHBondContact O-N 3.42Å
502	R	28.6	Very low	35.6	Very low	241 Å²	241	141.9 Å²	141.9	91%	0.909	80%	0.799	S	S	*	*			trans	-122.7	165.6	156	-121.1	-166.5	-177.4	-175.6	1.8	105.3
503	P	46.1	Very low	35.5	Very low	121 Å²	121	142.5 Å²	142.5	79%	0.786	80%	0.797	S	S	*	*			cis	-123.6	167.9	-45.4	29.7	-11.5	0	0	0	110.8
504	G	27	Very low	35.6	Very low	75 Å²	75	142.3 Å²	142.3	77%	0.773	79%	0.794	S	S	*	*			trans	-174.1	135.5	173	0	0	0	0	0	115.6
505	L	29.6	Very low	35.4	Very low	143 Å²	143	142.2 Å²	142.2	75%	0.749	80%	0.799	S	S	*	*			trans	-64.1	165.3	-176	-78.2	68.7	0	0	0	115.4
506	Y	29.1	Very low	34.8	Very low	209 Å²	209	139.8 Å²	139.8	82%	0.82	79%	0.794	S	S	*	*			trans	99.5	111	152.4	-66.3	-72.9	0	0	0	119.6
507	A	30.3	Very low	34	Very low	77 Å²	77	140.2 Å²	140.2	64%	0.636	80%	0.798	S	S	*	*			trans	15.1	123.1	132.1	0	0	0	0	0	119.5
508	Y	29.3	Very low	33.2	Very low	227 Å²	227	135.6 Å²	135.6	89%	0.89	79%	0.793	S	S	*	*				168	132.3	108.8	-106	-91.2	0	0	0	108.2
509	A	36.5	Very low	32.8	Very low	86 Å²	86	134.3 Å²	134.3	71%	0.711	79%	0.791	S	S	*	*			trans	-88.9	152.3	151.8	0	0	0	0	0	107
510	P	40.3	Very low	32.9	Very low	111 Å²	111	135.9 Å²	135.9	72%	0.721	79%	0.791	S	S	*	*				-155.3	156.1	86.9	39.8	-19.8	0	0	0	117.1
511	E	30.2	Very low	33.3	Very low	166 Å²	166	130.4 Å²	130.4	78%	0.776	79%	0.786	S	S	*	*				70.7	134.2	129.6	-79.3	-167.8	164.9	0	0	125.3
512	T	30.7	Very low	33.2	Very low	109 Å²	109	127.6 Å²	127.6	67%	0.669	78%	0.777	S	S	*	*			trans	78.8	139.4	141.3	65.9	0	0	0	0	117.2
513	K	33.2	Very low	33.4	Very low	190 Å²	190	124.7 Å²	124.7	83%	0.826	78%	0.778	S	S	*	*			cis	-166.6	174.5	7.5	-117.7	173.5	-176.4	179.3	0	108.1
514	P	44.8	Very low	32.6	Very low	111 Å²	111	122.3 Å²	122.3	72%	0.721	78%	0.776	S	S	*	*			trans	-97.9	162.9	-161.2	39.4	-36.5	0	0	0	114.3
515	V	33.9	Very low	33	Very low	147 Å²	147	125.2 Å²	125.2	89%	0.891	78%	0.778	S	S	*	*			trans	-152.9	132.8	157.8	-175.4	0	0	0	0	105.6
516	G	28.5	Very low	33.8	Very low	70 Å²	70	123.4 Å²	123.4	72%	0.722	78%	0.775	S	S	*	*			cis	120.8	90.9	13.1	0	0	0	0	0	110.9
517	G	29.3	Very low	33.9	Very low	81 Å²	81	120.4 Å²	120.4	84%	0.835	77%	0.772	S	S	*	*			trans	84.2	156.7	160.2	0	0	0	0	0	117.2
518	A	28.9	Very low	33.9	Very low	99 Å²	99	124.5 Å²	124.5	82%	0.818	78%	0.783	S	S	*	*			cis	-171.7	152.6	-8.6	0	0	0	0	0	108.2
519	A	29.1	Very low	33.9	Very low	90 Å²	90	121.2 Å²	121.2	74%	0.744	78%	0.78	S	S	*	*			trans	49.3	116.7	146.2	0	0	0	0	0	122.8
520	T	35.5	Very low	34.3	Very low	134 Å²	134	121.8 Å²	121.8	82%	0.822	78%	0.776	S	S	*	*				2.3	168.9	128.2	58.8	0	0	0	0	119.8
521	P	46.6	Very low	33.8	Very low	127 Å²	127	124.9 Å²	124.9	83%	0.825	78%	0.778	S	S	*	*			cis	-151.4	-172.9	25.6	39.4	-15.2	0	0	0	117.8
522	G	29.1	Very low	33.9	Very low	66 Å²	66	122.3 Å²	122.3	68%	0.68	77%	0.774	S	S	*	*			trans	144	86.7	159.8	0	0	0	0	0	113.5
523	I	33.3	Very low	34.1	Very low	179 Å²	179	123.9 Å²	123.9	92%	0.918	78%	0.783	S	S	*	*				63.8	119.2	89.4	-57.6	173.8	0	0	0	114.4
524	G	29.8	Very low	34.2	Very low	72 Å²	72	121.5 Å²	121.5	74%	0.742	78%	0.779	S	S	*	*			trans	164.6	85.6	161.7	0	0	0	0	0	115.4
525	V	35.5	Very low	33.6	Very low	136 Å²	136	124.5 Å²	124.5	82%	0.824	79%	0.788	S	S	*	*			trans	-121.6	141.8	161.2	-178.8	0	0	0	0	103
526	P	46.7	Very low	33.6	Very low	105 Å²	105	123.9 Å²	123.9	68%	0.682	78%	0.779	S	S	*	*				-161.8	172.7	64.3	43.9	-20.5	0	0	0	120.9
527	L	31.4	Very low	33.9	Very low	146 Å²	146	129.5 Å²	129.5	76%	0.764	79%	0.786	S	S	*	*			trans	65.3	120.5	138.7	-104.9	102.9	0	0	0	121.7
528	L	30.3	Very low	34.1	Very low	163 Å²	163	141 Å²	141	85%	0.853	81%	0.805	S	S	*	*				161	123	112	-86.4	158.6	0	0	0	113.4
529	L	29	Very low	34.4	Very low	158 Å²	158	143.2 Å²	143.2	83%	0.827	80%	0.804	S	S	*	*			trans	-69.5	-179.4	152.2	-80.1	158.6	0	0	0	109.7
530	P	44.8	Very low	34.7	Very low	98 Å²	98	145.9 Å²	145.9	64%	0.636	81%	0.807	S	S	*	*			cis	-145.5	-168.7	12.7	21.2	8.8	0	0	0	116.2
531	F	29.9	Very low	34.6	Very low	176 Å²	176	146.6 Å²	146.6	77%	0.772	81%	0.806	S	S	*	*			trans	117.2	102.4	147.1	-82.6	-82.1	0	0	0	119.7
532	T	31.8	Very low	33.9	Very low	111 Å²	111	147.8 Å²	147.8	68%	0.681	81%	0.805	S	S	*	*				39.1	130.8	127.6	63.5	0	0	0	0	121.6
533	V	34.9	Very low	34.2	Very low	143 Å²	143	152.9 Å²	152.9	87%	0.867	81%	0.813	S	S	*	*			trans	-146.3	131.8	131.5	171.8	0	0	0	0	109.9
534	L	35.3	Very low	34.3	Very low	140 Å²	140	151.1 Å²	151.1	73%	0.733	81%	0.806	S	S	*	*			trans	-60	157	169.3	-78.4	121.8	0	0	0	113.2
535	L	32.3	Very low	34.6	Very low	173 Å²	173	156.8 Å²	156.8	91%	0.906	81%	0.811	S	S	*	*				-168.6	132.6	121.1	-100.6	158	0	0	0	113.1
536	L	33.9	Very low	34.6	Very low	134 Å²	134	158.4 Å²	158.4	70%	0.702	81%	0.81	S	S	*	*			trans	-77	170.2	170.7	-95.1	103.7	0	0	0	112.4
537	Q	34.4	Very low	33.5	Very low	188 Å²	188	162.8 Å²	162.8	88%	0.879	82%	0.82	S	S	*	*			trans	88	113.3	165.7	-53	-176.3	-18.9	0	0	112.4
538	R	34.6	Very low	33.7	Very low	324 Å²	324	164.4 Å²	164.4	100%	1.223	83%	0.825	S	S	*	*				-159.4	0	52.8	-143.9	176.8	-175.8	173.1	0.1	112.6

Retrieved 538 of 538 residues in 630.8 ms (Link to these results)

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