A0A093HBK0_STRCA Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A093HBK0, Species STRCA (Struthio camelus australis), Gene n/a, Length 465 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	42.2	Very low	52.4	Low	242 Å²	242	131.7 Å²	131.7	100%	1.192	84%	0.835	S	S	*	*				0	96.9	0	-75.6	176.7	170.7	0	0	107.9
2	A	41.9	Very low	54.4	Low	102 Å²	102	129.2 Å²	129.2	84%	0.843	81%	0.807	S	S	*	*			trans	-87	111.9	173.1	0	0	0	0	0	107.7	T4	A2-T4 PolarHBondContact O-N 3.45Å
3	M	46.1	Very low	56.6	Low	188 Å²	188	123.9 Å²	123.9	93%	0.926	78%	0.777	S	S	*	*			trans	-74.2	108.8	175.4	-71.6	-91.9	-100.6	0	0	108.4	G5	M3-G5 PolarHBondContact O-N 2.73Å; M3-G5 VanDerWaalsContact O-N 3.1Å
4	T	48.2	Very low	57.9	Low	139 Å²	139	123.3 Å²	123.3	85%	0.853	77%	0.766	S	S	*	*			trans	-70	98.1	168.3	45.1	0	0	0	0	108.8	A2	A2-T4 PolarHBondContact O-N 3.45Å
5	G	53.9	Low	59	Low	59 Å²	59	122.3 Å²	122.3	61%	0.608	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-61.5	144	167.3	0	0	0	0	0	110.4	M3 T7	M3-G5 PolarHBondContact O-N 2.73Å; M3-G5 VanDerWaalsContact O-N 3.1Å; G5-T7 PolarHBondContact O-N 2.61Å
6	P	50.8	Low	60.4	Low	130 Å²	130	118.3 Å²	118.3	84%	0.844	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-64.1	125.2	-178.8	26.7	-32	0	0	0	109.3
7	T	56.7	Low	61.3	Low	133 Å²	133	117.2 Å²	117.2	82%	0.816	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-56.4	132.4	172.7	-8.3	0	0	0	0	108.3	G5 C9	G5-T7 PolarHBondContact O-N 2.61Å; T7-C9 PolarHBondContact O-N 2.73Å
8	P	51.6	Low	61.9	Low	120 Å²	120	116.3 Å²	116.3	78%	0.779	69%	0.694	S	S	*	*			trans	-64.3	114.6	175	-6.3	19.8	0	0	0	107.2	S10	P8-S10 PolarHBondContact O-N 3.44Å
9	C	55.2	Low	62.9	Low	125 Å²	125	118.6 Å²	118.6	85%	0.845	69%	0.689	S	S	*	*			trans	-54.3	114.6	169.6	-168.8	0	0	0	0	106.9	T7 S11	T7-C9 PolarHBondContact O-N 2.73Å; C9-S11 PolarHBondContact O-N 3.24Å
10	S	61.2	Low	64	Low	104 Å²	104	116.8 Å²	116.8	73%	0.727	68%	0.68	S	S	*	*			trans	-56.9	114	-176.9	70.2	0	0	0	0	108.1	P8 M12	P8-S10 PolarHBondContact O-N 3.44Å; S10-M12 PolarHBondContact O-N 2.92Å
11	S	68.8	Low	64.5	Low	107 Å²	107	115.2 Å²	115.2	75%	0.748	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-58.8	120.1	179.2	65.4	0	0	0	0	108.1	C9 S13	C9-S11 PolarHBondContact O-N 3.24Å; S11-S13 PolarHBondContact O-N 3.49Å
12	M	75.9	Confident	66.1	Low	101 Å²	101	108.4 Å²	108.4	50%	0.498	64%	0.638	S	S	.	*	P	Polyproline II helix	trans	-49.7	133.6	178.8	-68.6	-179.2	67.8	0	0	110.4	S10 T16 K17	S10-M12 PolarHBondContact O-N 2.92Å; M12-T16 HydrophobicContact CE-CG2 3.46Å; M12-T16 VanDerWaalsContact CE-CG2 3.46Å; M12-K17 HydrophobicContact CB-CG 4.18Å; M12-K17 VanDerWaalsContact O-CE 3.26Å; M12-K17 WeakPolarHBondContact O-CE 3.41Å
13	S	82.9	Confident	68	Low	61 Å²	61	106.9 Å²	106.9	43%	0.427	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-60.6	150	178.6	74.5	0	0	0	0	110.7	S11 H15 T16 K17	S11-S13 PolarHBondContact O-N 3.49Å; S13-H15 PolarHBondContact O-N 3.28Å; S13-T16 PolarHBondContact O-N 3.41Å; S13-T16 VanDerWaalsContact O-N 3.07Å; S13-T16 PolarHBondContact OG-N 2.99Å; S13-T16 PolarHBondContact OG-OG1 2.93Å; S13-K17 PolarHBondContact O-N 3.15Å
14	N	74.6	Confident	69.7	Low	115 Å²	115	103.8 Å²	103.8	62%	0.615	60%	0.6	S	S	*	*	H	α-helix	trans	-58	-37.3	177.4	-70.7	-14.3	0	0	0	111.6	T16 K17 E18	N14-T16 PolarHBondContact O-N 3.03Å; N14-K17 PolarHBondContact O-N 2.83Å; N14-E18 WeakPolarHBondContact O-CG 3.38Å; N14-E18 PolarHBondContact O-N 2.89Å
15	H	75.3	Confident	71	Confident	108 Å²	108	99.3 Å²	99.3	50%	0.5	57%	0.572	S	S	.	*	H	α-helix	trans	-57.4	-45.7	173.5	-178.4	69.2	0	0	0	112.8	S13 E18 R19	S13-H15 PolarHBondContact O-N 3.28Å; H15-E18 PolarHBondContact O-N 3.29Å; H15-R19 WeakPolarHBondContact NE2-CD 3.48Å; H15-R19 WeakPolarHBondContact O-CG 3.44Å; H15-R19 PolarHBondContact O-N 2.98Å
16	T	81.6	Confident	72	Confident	59 Å²	59	99.6 Å²	99.6	36%	0.362	56%	0.562	S	S	.	*	H	α-helix	trans	-67.3	-39.9	178.2	-55.6	0	0	0	0	111.2	M12 S13 N14 R19 V20	M12-T16 HydrophobicContact CE-CG2 3.46Å; M12-T16 VanDerWaalsContact CE-CG2 3.46Å; S13-T16 PolarHBondContact O-N 3.41Å; S13-T16 VanDerWaalsContact O-N 3.07Å; S13-T16 PolarHBondContact OG-N 2.99Å; S13-T16 PolarHBondContact OG-OG1 2.93Å; N14-T16 PolarHBondContact O-N 3.03Å; T16-R19 PolarHBondContact O-N 2.78Å; T16-V20 VanDerWaalsContact O-CG2 3.31Å; T16-V20 WeakPolarHBondContact O-CG2 3.45Å; T16-V20 PolarHBondContact O-N 3.21Å
17	K	75.5	Confident	73.6	Confident	100 Å²	100	97.9 Å²	97.9	44%	0.435	55%	0.546	S	S	.	.	H	α-helix	trans	-60.8	-45.1	175.3	-68.7	174.9	-178.8	168.1	0	111.7	M12 S13 N14 V20 T21	M12-K17 HydrophobicContact CB-CG 4.18Å; M12-K17 VanDerWaalsContact O-CE 3.26Å; M12-K17 WeakPolarHBondContact O-CE 3.41Å; S13-K17 PolarHBondContact O-N 3.15Å; N14-K17 PolarHBondContact O-N 2.83Å; K17-V20 PolarHBondContact O-N 3.39Å; K17-T21 PolarHBondContact O-N 2.93Å; K17-T21 PolarHBondContact O-OG1 3.23Å; K17-T21 VanDerWaalsContact O-OG1 3.06Å
18	E	72.5	Confident	74.8	Confident	101 Å²	101	96.3 Å²	96.3	47%	0.472	53%	0.529	S	S	.	.	H	α-helix	trans	-61.9	-44.8	176.7	-75.7	168.7	-172.4	0	0	112.1	N14 H15 V20 T21 M22	N14-E18 WeakPolarHBondContact O-CG 3.38Å; N14-E18 PolarHBondContact O-N 2.89Å; H15-E18 PolarHBondContact O-N 3.29Å; E18-V20 VanDerWaalsContact C-N 3.33Å; E18-V20 PolarHBondContact O-N 2.72Å; E18-T21 PolarHBondContact O-N 3.42Å; E18-M22 WeakPolarHBondContact O-CB 3.15Å; E18-M22 PolarHBondContact O-N 3.38Å
19	R	80.2	Confident	75.8	Confident	159 Å²	159	92.5 Å²	92.5	60%	0.6	50%	0.502	S	S	*	.	H	α-helix	trans	-62.3	-38.4	176.2	-74.8	-166.6	66.6	-172.5	-1.3	112.9	H15 T16 T23	H15-R19 WeakPolarHBondContact NE2-CD 3.48Å; H15-R19 WeakPolarHBondContact O-CG 3.44Å; H15-R19 PolarHBondContact O-N 2.98Å; T16-R19 PolarHBondContact O-N 2.78Å; R19-T23 WeakPolarHBondContact O-CB 3.44Å; R19-T23 PolarHBondContact O-N 2.93Å; R19-T23 PolarHBondContact O-OG1 2.98Å
20	V	83.9	Confident	77	Confident	83 Å²	83	92 Å²	92	50%	0.503	49%	0.486	S	S	.	.	H	α-helix	trans	-64.4	-46.7	174.8	169.5	0	0	0	0	110.2	T16 K17 E18 M22 T23 K24	T16-V20 VanDerWaalsContact O-CG2 3.31Å; T16-V20 WeakPolarHBondContact O-CG2 3.45Å; T16-V20 PolarHBondContact O-N 3.21Å; K17-V20 PolarHBondContact O-N 3.39Å; E18-V20 VanDerWaalsContact C-N 3.33Å; E18-V20 PolarHBondContact O-N 2.72Å; V20-M22 PolarHBondContact O-N 3.4Å; V20-T23 PolarHBondContact O-N 3Å; V20-K24 WeakPolarHBondContact O-CB 3.47Å; V20-K24 PolarHBondContact O-N 2.88Å
21	T	76.1	Confident	78.2	Confident	84 Å²	84	93.8 Å²	93.8	52%	0.515	48%	0.477	S	S	.	.	H	α-helix	trans	-58.6	-47.8	175.7	-59.1	0	0	0	0	111.6	K17 E18 T23 K24 V25	K17-T21 PolarHBondContact O-N 2.93Å; K17-T21 PolarHBondContact O-OG1 3.23Å; K17-T21 VanDerWaalsContact O-OG1 3.06Å; E18-T21 PolarHBondContact O-N 3.42Å; T21-T23 VanDerWaalsContact C-N 3.35Å; T21-T23 PolarHBondContact O-N 3.22Å; T21-K24 PolarHBondContact O-N 3.29Å; T21-V25 HydrophobicContact CG2-CG2 4.5Å; T21-V25 WeakPolarHBondContact O-CG2 3.47Å; T21-V25 PolarHBondContact O-N 2.95Å
22	M	74.3	Confident	78.8	Confident	99 Å²	99	92.2 Å²	92.2	49%	0.488	47%	0.466	S	S	.	.	H	α-helix	trans	-60.2	-44	177.3	-171.8	-172.4	109.9	0	0	111.6	E18 V20 T26 I441	E18-M22 WeakPolarHBondContact O-CB 3.15Å; E18-M22 PolarHBondContact O-N 3.38Å; V20-M22 PolarHBondContact O-N 3.4Å; M22-T26 VanDerWaalsContact O-CB 3.3Å; M22-T26 WeakPolarHBondContact O-CB 3.35Å; M22-T26 PolarHBondContact O-N 3.22Å; M22-T26 PolarHBondContact O-OG1 2.68Å; M22-I441 HydrophobicContact CG-CD1 4.37Å
23	T	82.3	Confident	78.8	Confident	70 Å²	70	90.7 Å²	90.7	43%	0.429	46%	0.46	S	S	.	.	H	α-helix	trans	-64.2	-45.2	179	-56.1	0	0	0	0	110.9	R19 V20 T21 T26 L27	R19-T23 WeakPolarHBondContact O-CB 3.44Å; R19-T23 PolarHBondContact O-N 2.93Å; R19-T23 PolarHBondContact O-OG1 2.98Å; V20-T23 PolarHBondContact O-N 3Å; T21-T23 VanDerWaalsContact C-N 3.35Å; T21-T23 PolarHBondContact O-N 3.22Å; T23-T26 PolarHBondContact O-N 3.34Å; T23-L27 HydrophobicContact CG2-CD1 4.14Å; T23-L27 WeakPolarHBondContact O-CG 3.44Å; T23-L27 PolarHBondContact O-N 2.71Å
24	K	82.6	Confident	78.9	Confident	123 Å²	123	92.1 Å²	92.1	54%	0.535	46%	0.463	S	S	.	.	H	α-helix	trans	-57.6	-54.2	176.4	178.7	179.5	173.1	-179.1	0	111.1	V20 T21 T26 L27 E28	V20-K24 WeakPolarHBondContact O-CB 3.47Å; V20-K24 PolarHBondContact O-N 2.88Å; T21-K24 PolarHBondContact O-N 3.29Å; K24-T26 VanDerWaalsContact C-N 3.26Å; K24-T26 PolarHBondContact O-N 2.99Å; K24-L27 PolarHBondContact O-N 3.25Å; K24-L27 VanDerWaalsContact O-N 3.17Å; K24-E28 WeakPolarHBondContact CE-OE1 3.29Å; K24-E28 HydrophobicContact CG-CG 4.42Å; K24-E28 IonicContact NZ-OE1 3.88Å; K24-E28 WeakPolarHBondContact O-CG 3.27Å; K24-E28 PolarHBondContact O-N 3.29Å
25	V	74.4	Confident	79.4	Confident	45 Å²	45	91.3 Å²	91.3	27%	0.273	46%	0.457	S	S	.	.	H	α-helix	trans	-59.1	-39.4	179	170.8	0	0	0	0	111.1	T21 N29	T21-V25 HydrophobicContact CG2-CG2 4.5Å; T21-V25 WeakPolarHBondContact O-CG2 3.47Å; T21-V25 PolarHBondContact O-N 2.95Å; V25-N29 VanDerWaalsContact CG1-ND2 3.35Å; V25-N29 WeakPolarHBondContact CG1-ND2 3.21Å; V25-N29 WeakPolarHBondContact O-CB 3.46Å; V25-N29 PolarHBondContact O-N 3.31Å; V25-N29 PolarHBondContact O-ND2 3.06Å
26	T	75.7	Confident	79.7	Confident	64 Å²	64	87.9 Å²	87.9	39%	0.393	45%	0.448	S	S	.	.	H	α-helix	trans	-63.6	-44.4	177.8	-58.5	0	0	0	0	112	M22 T23 K24 F30	M22-T26 VanDerWaalsContact O-CB 3.3Å; M22-T26 WeakPolarHBondContact O-CB 3.35Å; M22-T26 PolarHBondContact O-N 3.22Å; M22-T26 PolarHBondContact O-OG1 2.68Å; T23-T26 PolarHBondContact O-N 3.34Å; K24-T26 VanDerWaalsContact C-N 3.26Å; K24-T26 PolarHBondContact O-N 2.99Å; T26-F30 WeakPolarHBondContact O-CB 3.43Å; T26-F30 PolarHBondContact O-N 3.46Å
27	L	85	Confident	79.7	Confident	95 Å²	95	88.5 Å²	88.5	50%	0.497	45%	0.447	S	S	.	.	H	α-helix	trans	-69.2	-44.7	179.5	-73.1	171.8	0	0	0	112.2	T23 K24 N29 F30 Y31	T23-L27 HydrophobicContact CG2-CD1 4.14Å; T23-L27 WeakPolarHBondContact O-CG 3.44Å; T23-L27 PolarHBondContact O-N 2.71Å; K24-L27 PolarHBondContact O-N 3.25Å; K24-L27 VanDerWaalsContact O-N 3.17Å; L27-N29 VanDerWaalsContact C-N 3.34Å; L27-N29 PolarHBondContact O-N 2.77Å; L27-F30 PolarHBondContact O-N 2.89Å; L27-Y31 WeakPolarHBondContact O-CD2 3.12Å; L27-Y31 PolarHBondContact O-N 3.44Å; L27-Y31 VanDerWaalsContact O-N 3.1Å
28	E	81.8	Confident	80.2	Confident	100 Å²	100	88.7 Å²	88.7	47%	0.467	45%	0.449	S	S	.	.	H	α-helix	trans	-57.4	-50.1	175.7	-73	173.8	165.1	0	0	110.1	K24 F30 Y31 S32	K24-E28 WeakPolarHBondContact CE-OE1 3.29Å; K24-E28 HydrophobicContact CG-CG 4.42Å; K24-E28 IonicContact NZ-OE1 3.88Å; K24-E28 WeakPolarHBondContact O-CG 3.27Å; K24-E28 PolarHBondContact O-N 3.29Å; E28-F30 VanDerWaalsContact C-N 3.33Å; E28-F30 PolarHBondContact O-N 3.11Å; E28-Y31 PolarHBondContact O-N 2.92Å; E28-S32 WeakPolarHBondContact O-CB 3.5Å; E28-S32 PolarHBondContact O-N 3.32Å; E28-S32 PolarHBondContact O-OG 3.19Å; E28-S32 VanDerWaalsContact O-OG 3.12Å
29	N	73.2	Confident	81	Confident	39 Å²	39	88.9 Å²	88.9	21%	0.209	45%	0.449	C	S	.	.	H	α-helix	trans	-60.2	-40.5	176.3	-74.8	-35.3	0	0	0	112.9	V25 L27 N33 I441 N442	V25-N29 VanDerWaalsContact CG1-ND2 3.35Å; V25-N29 WeakPolarHBondContact CG1-ND2 3.21Å; V25-N29 WeakPolarHBondContact O-CB 3.46Å; V25-N29 PolarHBondContact O-N 3.31Å; V25-N29 PolarHBondContact O-ND2 3.06Å; L27-N29 VanDerWaalsContact C-N 3.34Å; L27-N29 PolarHBondContact O-N 2.77Å; N29-N33 WeakPolarHBondContact O-CB 3.44Å; N29-N33 PolarHBondContact O-N 2.96Å; N29-N33 PolarHBondContact O-ND2 3.42Å; N29-I441 WeakPolarHBondContact ND2-CG2 2.99Å; N29-N442 PolarHBondContact ND2-ND2 2.96Å; N29-N442 VanDerWaalsContact ND2-ND2 3.18Å; N29-N442 PolarHBondContact OD1-ND2 3.39Å
30	F	80.3	Confident	81.2	Confident	116 Å²	116	85 Å²	85	51%	0.509	44%	0.438	S	S	.	.	H	α-helix	trans	-59.5	-51.1	179.2	175.8	-95.4	0	0	0	111.5	T26 L27 E28 L34	T26-F30 WeakPolarHBondContact O-CB 3.43Å; T26-F30 PolarHBondContact O-N 3.46Å; L27-F30 PolarHBondContact O-N 2.89Å; E28-F30 VanDerWaalsContact C-N 3.33Å; E28-F30 PolarHBondContact O-N 3.11Å; F30-L34 HydrophobicContact CE1-CD2 4.45Å; F30-L34 WeakPolarHBondContact O-CB 3.49Å; F30-L34 PolarHBondContact O-N 3.47Å
31	Y	85.6	Confident	81.3	Confident	140 Å²	140	86.5 Å²	86.5	55%	0.549	44%	0.435	S	S	.	.	H	α-helix	trans	-71.8	-39.6	-178.5	-76.2	-70.3	0	0	0	112.7	L27 E28 N33 L34 I35	L27-Y31 WeakPolarHBondContact O-CD2 3.12Å; L27-Y31 PolarHBondContact O-N 3.44Å; L27-Y31 VanDerWaalsContact O-N 3.1Å; E28-Y31 PolarHBondContact O-N 2.92Å; Y31-N33 VanDerWaalsContact C-N 3.35Å; Y31-N33 PolarHBondContact O-N 3.19Å; Y31-L34 HydrophobicContact CD1-CD2 4.41Å; Y31-L34 WeakPolarHBondContact O-CB 3.49Å; Y31-L34 PolarHBondContact O-N 3.03Å; Y31-I35 WeakPolarHBondContact O-CG1 3.48Å; Y31-I35 PolarHBondContact O-N 2.89Å
32	S	80.6	Confident	82	Confident	74 Å²	74	87.6 Å²	87.6	52%	0.517	43%	0.434	S	S	.	.	H	α-helix	trans	-59.6	-45.5	173.8	-66.2	0	0	0	0	111.6	E28 L34 I35 A36	E28-S32 WeakPolarHBondContact O-CB 3.5Å; E28-S32 PolarHBondContact O-N 3.32Å; E28-S32 PolarHBondContact O-OG 3.19Å; E28-S32 VanDerWaalsContact O-OG 3.12Å; S32-L34 VanDerWaalsContact C-N 3.34Å; S32-L34 PolarHBondContact O-N 2.91Å; S32-I35 PolarHBondContact O-N 3.46Å; S32-A36 WeakPolarHBondContact O-CB 3.33Å; S32-A36 PolarHBondContact O-N 3.04Å
33	N	77.5	Confident	82.7	Confident	69 Å²	69	88.7 Å²	88.7	37%	0.369	44%	0.439	S	S	.	.	H	α-helix	trans	-64.5	-38.4	175.7	-73	-27.5	0	0	0	111.8	N29 Y31 I35 Q37	N29-N33 WeakPolarHBondContact O-CB 3.44Å; N29-N33 PolarHBondContact O-N 2.96Å; N29-N33 PolarHBondContact O-ND2 3.42Å; Y31-N33 VanDerWaalsContact C-N 3.35Å; Y31-N33 PolarHBondContact O-N 3.19Å; N33-I35 VanDerWaalsContact C-N 3.34Å; N33-I35 PolarHBondContact O-N 2.87Å; N33-Q37 VanDerWaalsContact O-CB 3.3Å; N33-Q37 WeakPolarHBondContact O-CB 3.4Å; N33-Q37 WeakPolarHBondContact O-CG 3.46Å; N33-Q37 PolarHBondContact O-N 3Å
34	L	83.3	Confident	83.1	Confident	92 Å²	92	87.6 Å²	87.6	48%	0.482	43%	0.427	S	S	.	.	H	α-helix	trans	-61.9	-43.4	178.5	-174.5	67.2	0	0	0	111.6	F30 Y31 S32 H38	F30-L34 HydrophobicContact CE1-CD2 4.45Å; F30-L34 WeakPolarHBondContact O-CB 3.49Å; F30-L34 PolarHBondContact O-N 3.47Å; Y31-L34 HydrophobicContact CD1-CD2 4.41Å; Y31-L34 WeakPolarHBondContact O-CB 3.49Å; Y31-L34 PolarHBondContact O-N 3.03Å; S32-L34 VanDerWaalsContact C-N 3.34Å; S32-L34 PolarHBondContact O-N 2.91Å; L34-H38 PolarHBondContact O-N 3.46Å
35	I	85.9	Confident	83.5	Confident	97 Å²	97	86.8 Å²	86.8	50%	0.497	43%	0.426	S	S	.	.	H	α-helix	trans	-65.6	-52.9	177.2	-66.2	165.9	0	0	0	110.4	Y31 S32 N33 Q37 H38 E39	Y31-I35 WeakPolarHBondContact O-CG1 3.48Å; Y31-I35 PolarHBondContact O-N 2.89Å; S32-I35 PolarHBondContact O-N 3.46Å; N33-I35 VanDerWaalsContact C-N 3.34Å; N33-I35 PolarHBondContact O-N 2.87Å; I35-Q37 PolarHBondContact O-N 3.37Å; I35-H38 WeakPolarHBondContact O-CA 3.12Å; I35-H38 WeakPolarHBondContact O-CB 3.34Å; I35-H38 PolarHBondContact O-N 3.45Å; I35-E39 HydrophobicContact CG2-CG 4.42Å; I35-E39 PolarHBondContact O-N 3.44Å
36	A	81.5	Confident	84.3	Confident	36 Å²	36	92 Å²	92	30%	0.298	45%	0.445	S	S	.	.	H	α-helix	trans	-56.5	-40.1	-180	0	0	0	0	0	112.1	S32 H38 E39 E40	S32-A36 WeakPolarHBondContact O-CB 3.33Å; S32-A36 PolarHBondContact O-N 3.04Å; A36-H38 VanDerWaalsContact C-N 3.31Å; A36-H38 PolarHBondContact O-N 2.94Å; A36-E39 PolarHBondContact O-N 2.94Å; A36-E40 WeakPolarHBondContact O-CB 3.39Å; A36-E40 VanDerWaalsContact O-CG 3.31Å; A36-E40 WeakPolarHBondContact O-CG 3.45Å; A36-E40 PolarHBondContact O-N 3.42Å
37	Q	82.1	Confident	85	Confident	73 Å²	73	95.6 Å²	95.6	34%	0.341	46%	0.455	S	S	.	.	H	α-helix	trans	-66.2	-32.5	177.3	-72.7	178.7	35.1	0	0	113.6	N33 I35 R41 K80	N33-Q37 VanDerWaalsContact O-CB 3.3Å; N33-Q37 WeakPolarHBondContact O-CB 3.4Å; N33-Q37 WeakPolarHBondContact O-CG 3.46Å; N33-Q37 PolarHBondContact O-N 3Å; I35-Q37 PolarHBondContact O-N 3.37Å; Q37-R41 WeakPolarHBondContact O-CB 3.42Å; Q37-R41 PolarHBondContact O-N 3.46Å; Q37-K80 VanDerWaalsContact CD-NZ 3.32Å; Q37-K80 VanDerWaalsContact CG-NZ 3.31Å
38	H	86.1	Confident	85.3	Confident	104 Å²	104	92.1 Å²	92.1	48%	0.481	44%	0.437	S	S	.	.	H	α-helix	trans	-69.1	-49.4	174.5	-178.9	58.1	0	0	0	110.4	L34 I35 A36 E40 R41 E42	L34-H38 PolarHBondContact O-N 3.46Å; I35-H38 WeakPolarHBondContact O-CA 3.12Å; I35-H38 WeakPolarHBondContact O-CB 3.34Å; I35-H38 PolarHBondContact O-N 3.45Å; A36-H38 VanDerWaalsContact C-N 3.31Å; A36-H38 PolarHBondContact O-N 2.94Å; H38-E40 PolarHBondContact O-N 3.12Å; H38-R41 WeakPolarHBondContact O-CB 3.26Å; H38-R41 PolarHBondContact O-N 3.07Å; H38-R41 VanDerWaalsContact O-N 3.11Å; H38-E42 IonicContact NE2-OE1 3.54Å; H38-E42 IonicContact NE2-OE2 3.92Å; H38-E42 PolarHBondContact O-N 2.99Å
39	E	88	Confident	85.8	Confident	104 Å²	104	90.1 Å²	90.1	49%	0.486	43%	0.427	S	S	.	.	H	α-helix	trans	-58.8	-46.4	177.8	-67.9	174.8	166.4	0	0	111.8	I35 A36 R41 E42 M43	I35-E39 HydrophobicContact CG2-CG 4.42Å; I35-E39 PolarHBondContact O-N 3.44Å; A36-E39 PolarHBondContact O-N 2.94Å; E39-R41 VanDerWaalsContact C-N 3.27Å; E39-R41 PolarHBondContact O-N 3.37Å; E39-E42 PolarHBondContact O-N 3.3Å; E39-M43 WeakPolarHBondContact O-CB 3.35Å; E39-M43 WeakPolarHBondContact O-CG 3.49Å; E39-M43 PolarHBondContact O-N 2.8Å
40	E	85.1	Confident	86.7	Confident	78 Å²	78	93.4 Å²	93.4	36%	0.364	44%	0.441	S	S	.	.	H	α-helix	trans	-56.6	-40.3	175.3	-82.2	179.8	-165.1	0	0	112.7	A36 H38 M43 R44	A36-E40 WeakPolarHBondContact O-CB 3.39Å; A36-E40 VanDerWaalsContact O-CG 3.31Å; A36-E40 WeakPolarHBondContact O-CG 3.45Å; A36-E40 PolarHBondContact O-N 3.42Å; H38-E40 PolarHBondContact O-N 3.12Å; E40-M43 PolarHBondContact O-N 3.41Å; E40-R44 WeakPolarHBondContact O-CG 3.41Å; E40-R44 PolarHBondContact O-N 2.92Å; E40-R44 IonicContact OE2-NH1 3.48Å; E40-R44 PolarHBondContact OE2-NH1 2.8Å
41	R	87.2	Confident	87.1	Confident	114 Å²	114	91.5 Å²	91.5	43%	0.43	44%	0.435	S	S	.	.	H	α-helix	trans	-68.7	-42.8	179.6	-178.9	177.3	178.3	-151.1	-2.5	111.2	Q37 H38 E39 R44 Q45 E73	Q37-R41 WeakPolarHBondContact O-CB 3.42Å; Q37-R41 PolarHBondContact O-N 3.46Å; H38-R41 WeakPolarHBondContact O-CB 3.26Å; H38-R41 PolarHBondContact O-N 3.07Å; H38-R41 VanDerWaalsContact O-N 3.11Å; E39-R41 VanDerWaalsContact C-N 3.27Å; E39-R41 PolarHBondContact O-N 3.37Å; R41-R44 PolarHBondContact O-N 3.38Å; R41-Q45 PolarHBondContact O-N 3.4Å; R41-E73 IonicContact NE-OE2 2.77Å
42	E	90.5	Very high	87.5	Confident	108 Å²	108	84.8 Å²	84.8	51%	0.505	41%	0.409	S	S	.	.	H	α-helix	trans	-63.6	-42.4	174.7	-67.9	-164.3	127.1	0	0	111.5	H38 E39 Q45 K46	H38-E42 IonicContact NE2-OE1 3.54Å; H38-E42 IonicContact NE2-OE2 3.92Å; H38-E42 PolarHBondContact O-N 2.99Å; E39-E42 PolarHBondContact O-N 3.3Å; E42-Q45 PolarHBondContact O-N 3.36Å; E42-K46 WeakPolarHBondContact O-CB 3.41Å; E42-K46 PolarHBondContact O-N 3.46Å
43	M	89.1	Confident	88	Confident	121 Å²	121	87.3 Å²	87.3	60%	0.596	41%	0.412	S	S	*	.	H	α-helix	trans	-61.5	-44.4	175.8	-75.8	-165.2	-72.5	0	0	112.3	E39 E40 Q45 K46 K47	E39-M43 WeakPolarHBondContact O-CB 3.35Å; E39-M43 WeakPolarHBondContact O-CG 3.49Å; E39-M43 PolarHBondContact O-N 2.8Å; E40-M43 PolarHBondContact O-N 3.41Å; M43-Q45 VanDerWaalsContact C-N 3.34Å; M43-Q45 PolarHBondContact O-N 2.71Å; M43-K46 PolarHBondContact O-N 2.57Å; M43-K47 WeakPolarHBondContact O-CB 3.4Å; M43-K47 PolarHBondContact O-N 2.85Å
44	R	90.3	Very high	88.7	Confident	47 Å²	47	90.6 Å²	90.6	18%	0.177	43%	0.425	C	S	.	.	H	α-helix	trans	-60.6	-43	175.5	-77.8	-170.5	-62.9	-85.4	-4.7	111.9	E40 R41 K47 L48 E73	E40-R44 WeakPolarHBondContact O-CG 3.41Å; E40-R44 PolarHBondContact O-N 2.92Å; E40-R44 IonicContact OE2-NH1 3.48Å; E40-R44 PolarHBondContact OE2-NH1 2.8Å; R41-R44 PolarHBondContact O-N 3.38Å; R44-K47 PolarHBondContact O-N 3.26Å; R44-L48 PolarHBondContact O-N 3.02Å; R44-E73 IonicContact CZ-OE1 2.62Å; R44-E73 IonicContact NE-OE1 3.98Å; R44-E73 PolarHBondContact NE-OE1 2.97Å; R44-E73 IonicContact NH2-OE1 3.96Å; R44-E73 PolarHBondContact NH2-OE1 3.03Å; R44-E73 IonicContact NH2-OE2 2.71Å
45	Q	90.1	Very high	89.1	Confident	106 Å²	106	90.4 Å²	90.4	50%	0.495	42%	0.422	S	S	.	.	H	α-helix	trans	-62.4	-45.3	175.5	-176.9	175.7	-3.2	0	0	111.5	R41 E42 M43 K47 L48 E49	R41-Q45 PolarHBondContact O-N 3.4Å; E42-Q45 PolarHBondContact O-N 3.36Å; M43-Q45 VanDerWaalsContact C-N 3.34Å; M43-Q45 PolarHBondContact O-N 2.71Å; Q45-K47 VanDerWaalsContact C-N 3.34Å; Q45-K47 PolarHBondContact O-N 2.6Å; Q45-L48 WeakPolarHBondContact O-CB 3.45Å; Q45-L48 PolarHBondContact O-N 3.12Å; Q45-E49 WeakPolarHBondContact O-CG 3.44Å; Q45-E49 PolarHBondContact O-N 3.1Å
46	K	92.4	Very high	89.3	Confident	156 Å²	156	88.7 Å²	88.7	68%	0.678	43%	0.428	S	S	*	.	H	α-helix	trans	-60.9	-42.9	177.6	-171.2	179	179.5	-177.2	0	112	E42 M43 L48 E49 Q50	E42-K46 WeakPolarHBondContact O-CB 3.41Å; E42-K46 PolarHBondContact O-N 3.46Å; M43-K46 PolarHBondContact O-N 2.57Å; K46-L48 VanDerWaalsContact C-N 3.34Å; K46-L48 PolarHBondContact O-N 3.24Å; K46-E49 PolarHBondContact O-N 3.04Å; K46-Q50 PolarHBondContact O-N 3.31Å
47	K	89.8	Confident	89.8	Confident	138 Å²	138	88.4 Å²	88.4	60%	0.6	42%	0.422	S	S	*	.	H	α-helix	trans	-62.4	-40.8	176.5	-170.3	174.5	-177.4	177.3	0	111.7	M43 R44 Q45 Q50 M51	M43-K47 WeakPolarHBondContact O-CB 3.4Å; M43-K47 PolarHBondContact O-N 2.85Å; R44-K47 PolarHBondContact O-N 3.26Å; Q45-K47 VanDerWaalsContact C-N 3.34Å; Q45-K47 PolarHBondContact O-N 2.6Å; K47-Q50 PolarHBondContact O-N 3.29Å; K47-M51 WeakPolarHBondContact O-CG 3.38Å; K47-M51 PolarHBondContact O-N 2.76Å
48	L	90.6	Very high	90.3	Very high	22 Å²	22	93 Å²	93	12%	0.115	44%	0.441	C	S	.	.	H	α-helix	trans	-59.3	-49.3	174.3	-176.3	75.3	0	0	0	111.5	R44 Q45 K46 Q50 M51 M52 R65 R66 H69	R44-L48 PolarHBondContact O-N 3.02Å; Q45-L48 WeakPolarHBondContact O-CB 3.45Å; Q45-L48 PolarHBondContact O-N 3.12Å; K46-L48 VanDerWaalsContact C-N 3.34Å; K46-L48 PolarHBondContact O-N 3.24Å; L48-Q50 VanDerWaalsContact C-N 3.33Å; L48-Q50 PolarHBondContact O-N 3.12Å; L48-M51 PolarHBondContact O-N 2.86Å; L48-M52 HydrophobicContact CD2-CE 4.27Å; L48-M52 HydrophobicContact CG-CE 4.02Å; L48-M52 HydrophobicContact CG-SD 4.27Å; L48-M52 VanDerWaalsContact O-CG 3.27Å; L48-M52 WeakPolarHBondContact O-CG 3.35Å; L48-M52 PolarHBondContact O-N 3.37Å; L48-R65 HydrophobicContact CD1-CG 4.01Å; L48-R66 HydrophobicContact CD2-CG 4.46Å; L48-H69 HydrophobicContact CD2-CB 3.48Å; L48-H69 VanDerWaalsContact CD2-CB 3.48Å
49	E	92.5	Very high	90.6	Very high	59 Å²	59	94.3 Å²	94.3	28%	0.276	45%	0.451	S	S	.	.	H	α-helix	trans	-60.9	-43.1	179.7	-65.2	-60.3	150.6	0	0	111.6	Q45 K46 M52 E53 R66	Q45-E49 WeakPolarHBondContact O-CG 3.44Å; Q45-E49 PolarHBondContact O-N 3.1Å; K46-E49 PolarHBondContact O-N 3.04Å; E49-M52 HydrophobicContact CG-CE 4.37Å; E49-M52 PolarHBondContact O-N 3.08Å; E49-M52 WeakPolarHBondContact OE1-CE 3.46Å; E49-M52 WeakPolarHBondContact OE2-CE 3.46Å; E49-E53 PolarHBondContact O-N 3.07Å; E49-E53 VanDerWaalsContact O-N 3.07Å; E49-R66 WeakPolarHBondContact OE1-CD 3.44Å; E49-R66 IonicContact OE1-CZ 3.41Å; E49-R66 IonicContact OE1-NE 3.25Å; E49-R66 PolarHBondContact OE1-NE 2.87Å; E49-R66 IonicContact OE1-NH2 2.71Å; E49-R66 IonicContact OE2-CZ 2.68Å; E49-R66 IonicContact OE2-NE 3.75Å; E49-R66 PolarHBondContact OE2-NE 3.01Å; E49-R66 IonicContact OE2-NH2 3.69Å; E49-R66 PolarHBondContact OE2-NH2 2.82Å
50	Q	92.2	Very high	90.8	Very high	108 Å²	108	93.9 Å²	93.9	51%	0.505	45%	0.449	S	S	.	.	H	α-helix	trans	-61.1	-49.2	176.3	-177.1	178.3	-7.9	0	0	112	K46 K47 L48 M52 E53 E54	K46-Q50 PolarHBondContact O-N 3.31Å; K47-Q50 PolarHBondContact O-N 3.29Å; L48-Q50 VanDerWaalsContact C-N 3.33Å; L48-Q50 PolarHBondContact O-N 3.12Å; Q50-M52 VanDerWaalsContact C-N 3.31Å; Q50-M52 PolarHBondContact O-N 2.83Å; Q50-E53 WeakPolarHBondContact O-CB 3.47Å; Q50-E53 PolarHBondContact O-N 3.46Å; Q50-E53 VanDerWaalsContact O-N 3.12Å; Q50-E54 HydrophobicContact CG-CG 4.47Å; Q50-E54 VanDerWaalsContact CG-OE1 3.3Å; Q50-E54 WeakPolarHBondContact CG-OE1 3.45Å; Q50-E54 PolarHBondContact NE2-OE1 3.23Å; Q50-E54 WeakPolarHBondContact O-CG 3.3Å; Q50-E54 PolarHBondContact O-N 3.28Å
51	M	89.9	Confident	91	Very high	75 Å²	75	95.4 Å²	95.4	37%	0.369	46%	0.456	S	S	.	.	H	α-helix	trans	-60.3	-40.5	178.1	-73.1	-177	71.8	0	0	112.3	K47 L48 E53 E54 E55	K47-M51 WeakPolarHBondContact O-CG 3.38Å; K47-M51 PolarHBondContact O-N 2.76Å; L48-M51 PolarHBondContact O-N 2.86Å; M51-E53 VanDerWaalsContact C-N 3.26Å; M51-E53 PolarHBondContact O-N 3.23Å; M51-E54 PolarHBondContact O-N 2.99Å; M51-E55 WeakPolarHBondContact O-CB 3.5Å; M51-E55 WeakPolarHBondContact O-CG 3.32Å; M51-E55 PolarHBondContact O-N 2.83Å
52	M	93	Very high	91.2	Very high	0 Å²	0	91 Å²	91	0%	0	44%	0.44	C	S	.	.	H	α-helix	trans	-67.1	-29	177.9	-70.2	-172.3	-57.8	0	0	112.8	L48 E49 Q50 G56 L57 K62 R65 R66	L48-M52 HydrophobicContact CD2-CE 4.27Å; L48-M52 HydrophobicContact CG-CE 4.02Å; L48-M52 HydrophobicContact CG-SD 4.27Å; L48-M52 VanDerWaalsContact O-CG 3.27Å; L48-M52 WeakPolarHBondContact O-CG 3.35Å; L48-M52 PolarHBondContact O-N 3.37Å; E49-M52 HydrophobicContact CG-CE 4.37Å; E49-M52 PolarHBondContact O-N 3.08Å; E49-M52 WeakPolarHBondContact OE1-CE 3.46Å; E49-M52 WeakPolarHBondContact OE2-CE 3.46Å; Q50-M52 VanDerWaalsContact C-N 3.31Å; Q50-M52 PolarHBondContact O-N 2.83Å; M52-G56 PolarHBondContact O-N 3.42Å; M52-L57 HydrophobicContact CB-CD1 4.07Å; M52-L57 HydrophobicContact CG-CD1 3.88Å; M52-L57 PolarHBondContact O-N 3.49Å; M52-K62 HydrophobicContact CB-CG 4.25Å; M52-K62 HydrophobicContact SD-CB 4.17Å; M52-K62 HydrophobicContact SD-CG 4.23Å; M52-R65 HydrophobicContact CG-CG 4.29Å; M52-R65 HydrophobicContact SD-CB 3.74Å; M52-R65 HydrophobicContact SD-CG 3.93Å; M52-R66 HydrophobicContact CE-CG 3.87Å; M52-R66 HydrophobicContact SD-CG 4.42Å
53	E	90.8	Very high	91.3	Very high	127 Å²	127	92.9 Å²	92.9	59%	0.593	44%	0.443	S	S	*	.	H	α-helix	trans	-75.1	-45.2	174.9	-164.4	62.5	-158	0	0	111.3	E49 Q50 M51 E55 G56 K62	E49-E53 PolarHBondContact O-N 3.07Å; E49-E53 VanDerWaalsContact O-N 3.07Å; Q50-E53 WeakPolarHBondContact O-CB 3.47Å; Q50-E53 PolarHBondContact O-N 3.46Å; Q50-E53 VanDerWaalsContact O-N 3.12Å; M51-E53 VanDerWaalsContact C-N 3.26Å; M51-E53 PolarHBondContact O-N 3.23Å; E53-E55 VanDerWaalsContact C-N 3.33Å; E53-E55 PolarHBondContact O-N 2.97Å; E53-G56 PolarHBondContact O-N 3.24Å; E53-K62 IonicContact OE2-NZ 2.78Å; E53-K62 PolarHBondContact OE2-NZ 2.85Å
54	E	92.5	Very high	91.4	Very high	137 Å²	137	92 Å²	92	64%	0.64	44%	0.439	S	S	*	.	H	α-helix	trans	-61.3	-38.9	175.7	-71.6	170	-176	0	0	112.2	Q50 M51 G56	Q50-E54 HydrophobicContact CG-CG 4.47Å; Q50-E54 VanDerWaalsContact CG-OE1 3.3Å; Q50-E54 WeakPolarHBondContact CG-OE1 3.45Å; Q50-E54 PolarHBondContact NE2-OE1 3.23Å; Q50-E54 WeakPolarHBondContact O-CG 3.3Å; Q50-E54 PolarHBondContact O-N 3.28Å; M51-E54 PolarHBondContact O-N 2.99Å; E54-G56 PolarHBondContact O-N 3Å
55	E	91.6	Very high	91.3	Very high	88 Å²	88	93.9 Å²	93.9	41%	0.411	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-7.7	174.1	-73	176.7	-161.2	0	0	113	M51 E53 L57 R65	M51-E55 WeakPolarHBondContact O-CB 3.5Å; M51-E55 WeakPolarHBondContact O-CG 3.32Å; M51-E55 PolarHBondContact O-N 2.83Å; E53-E55 VanDerWaalsContact C-N 3.33Å; E53-E55 PolarHBondContact O-N 2.97Å; E55-L57 VanDerWaalsContact C-N 3.28Å; E55-L57 HydrophobicContact CB-CD1 4.42Å; E55-L57 HydrophobicContact CB-CD2 3.91Å; E55-L57 HydrophobicContact CB-CG 3.79Å; E55-L57 PolarHBondContact O-N 3.45Å; E55-R65 IonicContact OE1-CZ 3.74Å; E55-R65 IonicContact OE1-NH1 3.95Å; E55-R65 IonicContact OE1-NH2 3.4Å; E55-R65 PolarHBondContact OE1-NH2 3.09Å; E55-R65 IonicContact OE2-CZ 3.66Å; E55-R65 IonicContact OE2-NH1 3.63Å; E55-R65 PolarHBondContact OE2-NH1 3.44Å; E55-R65 IonicContact OE2-NH2 2.91Å; E55-R65 PolarHBondContact OE2-NH2 3.22Å
56	G	90.9	Very high	91.5	Very high	61 Å²	61	93.8 Å²	93.8	63%	0.629	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	31.7	178.6	0	0	0	0	0	114.1	M52 E53 E54	M52-G56 PolarHBondContact O-N 3.42Å; E53-G56 PolarHBondContact O-N 3.24Å; E54-G56 PolarHBondContact O-N 3Å
57	L	90.8	Very high	91.4	Very high	31 Å²	31	90 Å²	90	16%	0.162	44%	0.435	C	S	.	.			trans	-66.5	146.5	-172.1	-61.2	-178.2	0	0	0	112.6	M52 E55 E61 K62	M52-L57 HydrophobicContact CB-CD1 4.07Å; M52-L57 HydrophobicContact CG-CD1 3.88Å; M52-L57 PolarHBondContact O-N 3.49Å; E55-L57 VanDerWaalsContact C-N 3.28Å; E55-L57 HydrophobicContact CB-CD1 4.42Å; E55-L57 HydrophobicContact CB-CD2 3.91Å; E55-L57 HydrophobicContact CB-CG 3.79Å; E55-L57 PolarHBondContact O-N 3.45Å; L57-E61 HydrophobicContact CB-CB 4.28Å; L57-E61 HydrophobicContact CB-CG 4.48Å; L57-E61 HydrophobicContact CD1-CG 4.23Å; L57-E61 HydrophobicContact CD2-CG 4.21Å; L57-K62 HydrophobicContact CB-CG 3.89Å; L57-K62 WeakPolarHBondContact O-CE 3.35Å
58	K	92.8	Very high	91.3	Very high	170 Å²	170	85.6 Å²	85.6	74%	0.739	42%	0.424	S	S	*	.			trans	-70.4	156.7	172.7	-64.3	179.8	-177.7	176	0	111.2	E60 E61 K62	K58-E60 PolarHBondContact O-N 3.07Å; K58-E60 VanDerWaalsContact O-N 3.15Å; K58-E61 WeakPolarHBondContact O-CB 3.39Å; K58-E61 PolarHBondContact O-N 3.4Å; K58-K62 PolarHBondContact O-N 3.46Å
59	D	91.7	Very high	91.2	Very high	131 Å²	131	86 Å²	86	70%	0.701	43%	0.425	S	S	*	.	H	α-helix	trans	-55.2	-37.1	-177.2	-70.3	-24.8	0	0	0	114.3	K62 R63	D59-K62 PolarHBondContact O-N 3.44Å; D59-R63 WeakPolarHBondContact O-CB 3.18Å; D59-R63 PolarHBondContact O-N 2.87Å
60	E	92.6	Very high	91	Very high	94 Å²	94	85.7 Å²	85.7	44%	0.439	43%	0.433	S	S	.	.	H	α-helix	trans	-62.5	-46.6	176.1	-176	56.9	-141.8	0	0	111.6	K58 R63 I64	K58-E60 PolarHBondContact O-N 3.07Å; K58-E60 VanDerWaalsContact O-N 3.15Å; E60-R63 VanDerWaalsContact CD-CZ 3.5Å; E60-R63 WeakPolarHBondContact O-CB 3.31Å; E60-R63 PolarHBondContact O-N 2.76Å; E60-R63 IonicContact OE1-CZ 3.3Å; E60-R63 VanDerWaalsContact OE1-CZ 3.3Å; E60-R63 IonicContact OE1-NE 2.73Å; E60-R63 IonicContact OE1-NH1 3.88Å; E60-R63 IonicContact OE1-NH2 2.61Å; E60-R63 PolarHBondContact OE1-NH2 2.64Å; E60-R63 IonicContact OE2-CZ 2.98Å; E60-R63 IonicContact OE2-NH1 2.73Å; E60-R63 PolarHBondContact OE2-NH1 3.46Å; E60-R63 IonicContact OE2-NH2 2.73Å; E60-R63 PolarHBondContact OE2-NH2 3.27Å; E60-I64 HydrophobicContact CG-CD1 4.4Å; E60-I64 WeakPolarHBondContact O-CG1 3.38Å; E60-I64 PolarHBondContact O-N 3.3Å
61	E	90.5	Very high	90.7	Very high	110 Å²	110	86.4 Å²	86.4	51%	0.514	44%	0.436	S	S	.	.	H	α-helix	trans	-67.3	-40.9	179.4	-160.5	114.4	-154.9	0	0	111.1	L57 K58 R63 I64 R65	L57-E61 HydrophobicContact CB-CB 4.28Å; L57-E61 HydrophobicContact CB-CG 4.48Å; L57-E61 HydrophobicContact CD1-CG 4.23Å; L57-E61 HydrophobicContact CD2-CG 4.21Å; K58-E61 WeakPolarHBondContact O-CB 3.39Å; K58-E61 PolarHBondContact O-N 3.4Å; E61-R63 VanDerWaalsContact C-N 3.3Å; E61-R63 PolarHBondContact O-N 3.06Å; E61-I64 PolarHBondContact O-N 3.29Å; E61-R65 WeakPolarHBondContact O-CB 3.39Å; E61-R65 PolarHBondContact O-N 2.82Å
62	K	91.3	Very high	90.4	Very high	23 Å²	23	87.1 Å²	87.1	10%	0.1	44%	0.437	C	S	.	.	H	α-helix	trans	-57.2	-43.8	171.7	-69.7	-174.5	174.2	174.3	0	110.8	M52 E53 L57 K58 D59 R65 R66	M52-K62 HydrophobicContact CB-CG 4.25Å; M52-K62 HydrophobicContact SD-CB 4.17Å; M52-K62 HydrophobicContact SD-CG 4.23Å; E53-K62 IonicContact OE2-NZ 2.78Å; E53-K62 PolarHBondContact OE2-NZ 2.85Å; L57-K62 HydrophobicContact CB-CG 3.89Å; L57-K62 WeakPolarHBondContact O-CE 3.35Å; K58-K62 PolarHBondContact O-N 3.46Å; D59-K62 PolarHBondContact O-N 3.44Å; K62-R65 PolarHBondContact O-N 2.79Å; K62-R66 WeakPolarHBondContact O-CB 3.43Å; K62-R66 VanDerWaalsContact O-CG 3.29Å; K62-R66 WeakPolarHBondContact O-CG 3.43Å; K62-R66 PolarHBondContact O-N 3.22Å
63	R	92.4	Very high	90.1	Very high	147 Å²	147	87.3 Å²	87.3	56%	0.555	44%	0.438	S	S	*	.	H	α-helix	trans	-62.8	-45.2	177.7	-169.5	177.7	73.8	-131.3	6.1	112.1	D59 E60 E61 S67	D59-R63 WeakPolarHBondContact O-CB 3.18Å; D59-R63 PolarHBondContact O-N 2.87Å; E60-R63 VanDerWaalsContact CD-CZ 3.5Å; E60-R63 WeakPolarHBondContact O-CB 3.31Å; E60-R63 PolarHBondContact O-N 2.76Å; E60-R63 IonicContact OE1-CZ 3.3Å; E60-R63 VanDerWaalsContact OE1-CZ 3.3Å; E60-R63 IonicContact OE1-NE 2.73Å; E60-R63 IonicContact OE1-NH1 3.88Å; E60-R63 IonicContact OE1-NH2 2.61Å; E60-R63 PolarHBondContact OE1-NH2 2.64Å; E60-R63 IonicContact OE2-CZ 2.98Å; E60-R63 IonicContact OE2-NH1 2.73Å; E60-R63 PolarHBondContact OE2-NH1 3.46Å; E60-R63 IonicContact OE2-NH2 2.73Å; E60-R63 PolarHBondContact OE2-NH2 3.27Å; E61-R63 VanDerWaalsContact C-N 3.3Å; E61-R63 PolarHBondContact O-N 3.06Å; R63-S67 WeakPolarHBondContact O-CB 3.49Å; R63-S67 PolarHBondContact O-N 2.59Å
64	I	91.3	Very high	89.9	Confident	101 Å²	101	85.6 Å²	85.6	52%	0.518	44%	0.436	S	S	.	.	H	α-helix	trans	-60.1	-47.1	177.1	-67.8	167.7	0	0	0	110.3	E60 E61 S67 A68	E60-I64 HydrophobicContact CG-CD1 4.4Å; E60-I64 WeakPolarHBondContact O-CG1 3.38Å; E60-I64 PolarHBondContact O-N 3.3Å; E61-I64 PolarHBondContact O-N 3.29Å; I64-S67 WeakPolarHBondContact O-CB 3.47Å; I64-S67 PolarHBondContact O-N 3.34Å; I64-A68 PolarHBondContact O-N 3.12Å
65	R	88.8	Confident	89.3	Confident	87 Å²	87	81.3 Å²	81.3	33%	0.328	42%	0.416	S	S	.	.	H	α-helix	trans	-68.1	-38.2	-176.7	-164.3	147.7	179.9	173.8	-13.6	112.6	L48 M52 E55 E61 K62 H69	L48-R65 HydrophobicContact CD1-CG 4.01Å; M52-R65 HydrophobicContact CG-CG 4.29Å; M52-R65 HydrophobicContact SD-CB 3.74Å; M52-R65 HydrophobicContact SD-CG 3.93Å; E55-R65 IonicContact OE1-CZ 3.74Å; E55-R65 IonicContact OE1-NH1 3.95Å; E55-R65 IonicContact OE1-NH2 3.4Å; E55-R65 PolarHBondContact OE1-NH2 3.09Å; E55-R65 IonicContact OE2-CZ 3.66Å; E55-R65 IonicContact OE2-NH1 3.63Å; E55-R65 PolarHBondContact OE2-NH1 3.44Å; E55-R65 IonicContact OE2-NH2 2.91Å; E55-R65 PolarHBondContact OE2-NH2 3.22Å; E61-R65 WeakPolarHBondContact O-CB 3.39Å; E61-R65 PolarHBondContact O-N 2.82Å; K62-R65 PolarHBondContact O-N 2.79Å; R65-H69 WeakPolarHBondContact O-CB 3.43Å; R65-H69 PolarHBondContact O-N 2.84Å
66	R	92.5	Very high	88.8	Confident	104 Å²	104	77.3 Å²	77.3	39%	0.392	40%	0.398	S	S	.	.	H	α-helix	trans	-61.7	-43.9	169.5	-72.5	175.9	-172.6	133.2	2.5	112.4	L48 E49 M52 K62 H69 A70	L48-R66 HydrophobicContact CD2-CG 4.46Å; E49-R66 WeakPolarHBondContact OE1-CD 3.44Å; E49-R66 IonicContact OE1-CZ 3.41Å; E49-R66 IonicContact OE1-NE 3.25Å; E49-R66 PolarHBondContact OE1-NE 2.87Å; E49-R66 IonicContact OE1-NH2 2.71Å; E49-R66 IonicContact OE2-CZ 2.68Å; E49-R66 IonicContact OE2-NE 3.75Å; E49-R66 PolarHBondContact OE2-NE 3.01Å; E49-R66 IonicContact OE2-NH2 3.69Å; E49-R66 PolarHBondContact OE2-NH2 2.82Å; M52-R66 HydrophobicContact CE-CG 3.87Å; M52-R66 HydrophobicContact SD-CG 4.42Å; K62-R66 WeakPolarHBondContact O-CB 3.43Å; K62-R66 VanDerWaalsContact O-CG 3.29Å; K62-R66 WeakPolarHBondContact O-CG 3.43Å; K62-R66 PolarHBondContact O-N 3.22Å; R66-H69 PolarHBondContact O-N 2.87Å; R66-A70 WeakPolarHBondContact O-CB 3.41Å; R66-A70 PolarHBondContact O-N 2.84Å
67	S	91.5	Very high	88.3	Confident	78 Å²	78	77.7 Å²	77.7	55%	0.545	39%	0.385	S	S	.	.	H	α-helix	trans	-62.3	-46.5	178.3	-175.7	0	0	0	0	111.6	R63 I64 H69 A70 Q71	R63-S67 WeakPolarHBondContact O-CB 3.49Å; R63-S67 PolarHBondContact O-N 2.59Å; I64-S67 WeakPolarHBondContact O-CB 3.47Å; I64-S67 PolarHBondContact O-N 3.34Å; S67-H69 VanDerWaalsContact C-N 3.32Å; S67-H69 PolarHBondContact O-N 2.73Å; S67-A70 PolarHBondContact O-N 3.2Å; S67-Q71 PolarHBondContact O-N 3.45Å
68	A	87.6	Confident	87.8	Confident	45 Å²	45	83.3 Å²	83.3	37%	0.372	40%	0.404	S	S	.	.	H	α-helix	trans	-60.6	-40.4	175.2	0	0	0	0	0	112.2	I64 Q71 K72	I64-A68 PolarHBondContact O-N 3.12Å; A68-Q71 PolarHBondContact O-N 3.04Å; A68-K72 WeakPolarHBondContact O-CG 3.5Å; A68-K72 PolarHBondContact O-N 3.14Å
69	H	87.8	Confident	87.1	Confident	30 Å²	30	76.3 Å²	76.3	14%	0.139	38%	0.375	C	S	.	.	H	α-helix	trans	-64.5	-44.1	174.9	-175.4	-86.4	0	0	0	112.4	L48 R65 R66 S67 Q71 K72 E73	L48-H69 HydrophobicContact CD2-CB 3.48Å; L48-H69 VanDerWaalsContact CD2-CB 3.48Å; R65-H69 WeakPolarHBondContact O-CB 3.43Å; R65-H69 PolarHBondContact O-N 2.84Å; R66-H69 PolarHBondContact O-N 2.87Å; S67-H69 VanDerWaalsContact C-N 3.32Å; S67-H69 PolarHBondContact O-N 2.73Å; H69-Q71 VanDerWaalsContact C-N 3.28Å; H69-Q71 PolarHBondContact O-N 3.12Å; H69-K72 WeakPolarHBondContact O-CB 3.48Å; H69-K72 PolarHBondContact O-N 3.33Å; H69-E73 IonicContact CE1-OE1 2.63Å; H69-E73 PolarHBondContact O-N 2.88Å
70	A	88.1	Confident	86.3	Confident	53 Å²	53	72.9 Å²	72.9	44%	0.438	35%	0.353	S	S	.	.	H	α-helix	trans	-62.1	-36.6	176.9	0	0	0	0	0	112.3	R66 S67 T74	R66-A70 WeakPolarHBondContact O-CB 3.41Å; R66-A70 PolarHBondContact O-N 2.84Å; S67-A70 PolarHBondContact O-N 3.2Å; A70-T74 PolarHBondContact O-N 3.44Å; A70-T74 PolarHBondContact O-OG1 2.89Å
71	Q	86.4	Confident	85.5	Confident	122 Å²	122	77.5 Å²	77.5	57%	0.57	37%	0.367	S	S	*	.	H	α-helix	trans	-64.2	-47.1	173	-174	176.1	0.7	0	0	111.3	S67 A68 H69 E73 T74 E75	S67-Q71 PolarHBondContact O-N 3.45Å; A68-Q71 PolarHBondContact O-N 3.04Å; H69-Q71 VanDerWaalsContact C-N 3.28Å; H69-Q71 PolarHBondContact O-N 3.12Å; Q71-E73 PolarHBondContact O-N 2.64Å; Q71-T74 PolarHBondContact O-N 3.43Å; Q71-E75 WeakPolarHBondContact O-CG 3.3Å; Q71-E75 PolarHBondContact O-N 3.11Å
72	K	84.1	Confident	84.9	Confident	90 Å²	90	75.5 Å²	75.5	39%	0.391	36%	0.362	S	S	.	.	H	α-helix	trans	-58	-44.6	175.6	-73.6	-179.8	179.8	-177.2	0	112.4	A68 H69 T74 E75 F76 F448 T452	A68-K72 WeakPolarHBondContact O-CG 3.5Å; A68-K72 PolarHBondContact O-N 3.14Å; H69-K72 WeakPolarHBondContact O-CB 3.48Å; H69-K72 PolarHBondContact O-N 3.33Å; K72-T74 VanDerWaalsContact C-N 3.34Å; K72-T74 PolarHBondContact O-N 3.35Å; K72-E75 PolarHBondContact O-N 3.23Å; K72-F76 WeakPolarHBondContact O-CB 3.28Å; K72-F76 PolarHBondContact O-N 3.23Å; K72-F448 HydrophobicContact CB-CZ 4Å; K72-T452 HydrophobicContact CD-CG2 4.24Å
73	E	86.4	Confident	84.3	Confident	4 Å²	4	85.3 Å²	85.3	2%	0.019	40%	0.398	C	S	.	.	H	α-helix	trans	-60.8	-42.1	175.9	-78.5	-69	167	0	0	112.2	R41 R44 H69 Q71 F76 L77 F448	R41-E73 IonicContact NE-OE2 2.77Å; R44-E73 IonicContact CZ-OE1 2.62Å; R44-E73 IonicContact NE-OE1 3.98Å; R44-E73 PolarHBondContact NE-OE1 2.97Å; R44-E73 IonicContact NH2-OE1 3.96Å; R44-E73 PolarHBondContact NH2-OE1 3.03Å; R44-E73 IonicContact NH2-OE2 2.71Å; H69-E73 IonicContact CE1-OE1 2.63Å; H69-E73 PolarHBondContact O-N 2.88Å; Q71-E73 PolarHBondContact O-N 2.64Å; E73-F76 WeakPolarHBondContact O-CB 3.41Å; E73-F76 PolarHBondContact O-N 3.26Å; E73-L77 WeakPolarHBondContact O-CG 3.36Å; E73-L77 PolarHBondContact O-N 2.86Å; E73-F448 HydrophobicContact CG-CE2 4.23Å; E73-F448 HydrophobicContact CG-CZ 4.22Å; E73-F448 WeakPolarHBondContact OE1-CE2 3.43Å
74	T	85.6	Confident	83.8	Confident	91 Å²	91	79.2 Å²	79.2	56%	0.558	38%	0.377	S	S	*	.	H	α-helix	trans	-63.9	-44.5	177.1	-57.7	0	0	0	0	111.6	A70 Q71 K72 F76 L77 R78	A70-T74 PolarHBondContact O-N 3.44Å; A70-T74 PolarHBondContact O-OG1 2.89Å; Q71-T74 PolarHBondContact O-N 3.43Å; K72-T74 VanDerWaalsContact C-N 3.34Å; K72-T74 PolarHBondContact O-N 3.35Å; T74-F76 VanDerWaalsContact C-N 3.31Å; T74-F76 PolarHBondContact O-N 3.28Å; T74-L77 PolarHBondContact O-N 2.95Å; T74-R78 PolarHBondContact O-N 3.03Å; T74-R78 VanDerWaalsContact O-N 3.08Å
75	E	81.4	Confident	83.7	Confident	48 Å²	48	74.9 Å²	74.9	22%	0.224	36%	0.357	C	S	.	.	H	α-helix	trans	-63.5	-37.2	175.6	-69.8	-170.2	155.8	0	0	111.8	Q71 K72 R78 L79 L451 R454	Q71-E75 WeakPolarHBondContact O-CG 3.3Å; Q71-E75 PolarHBondContact O-N 3.11Å; K72-E75 PolarHBondContact O-N 3.23Å; E75-R78 WeakPolarHBondContact O-CB 3.37Å; E75-R78 PolarHBondContact O-N 3.3Å; E75-L79 PolarHBondContact O-N 3.37Å; E75-L451 HydrophobicContact CB-CD2 4.08Å; E75-R454 IonicContact OE1-NH2 2.77Å
76	F	80.3	Confident	83.8	Confident	4 Å²	4	73 Å²	73	2%	0.018	35%	0.353	C	S	.	.	H	α-helix	trans	-63.6	-46.3	175.4	-171.1	-129.6	0	0	0	113.3	K72 E73 T74 R78 L79 K80 K446 F448 L451	K72-F76 WeakPolarHBondContact O-CB 3.28Å; K72-F76 PolarHBondContact O-N 3.23Å; E73-F76 WeakPolarHBondContact O-CB 3.41Å; E73-F76 PolarHBondContact O-N 3.26Å; T74-F76 VanDerWaalsContact C-N 3.31Å; T74-F76 PolarHBondContact O-N 3.28Å; F76-R78 PolarHBondContact O-N 3.11Å; F76-L79 PolarHBondContact O-N 3.01Å; F76-L79 VanDerWaalsContact O-N 3.12Å; F76-K80 HydrophobicContact CD1-CD 4.19Å; F76-K80 HydrophobicContact CE1-CD 3.86Å; F76-K80 HydrophobicContact CE1-CG 4.46Å; F76-K80 VanDerWaalsContact CE1-NZ 3.32Å; F76-K80 HydrophobicContact CE2-CG 4.36Å; F76-K80 HydrophobicContact CZ-CD 4.09Å; F76-K80 HydrophobicContact CZ-CG 4.31Å; F76-K80 PolarHBondContact O-N 3.49Å; F76-K446 WeakPolarHBondContact CE2-O 3.39Å; F76-F448 HydrophobicContact CB-CD2 3.78Å; F76-F448 HydrophobicContact CB-CE2 3.73Å; F76-F448 AromaticContact CD1-CD2 3.44Å; F76-F448 HydrophobicContact CD1-CD2 3.44Å; F76-F448 VanDerWaalsContact CD1-CD2 3.44Å; F76-F448 AromaticContact CD1-CE2 3.96Å; F76-F448 HydrophobicContact CD1-CE2 3.96Å; F76-F448 HydrophobicContact CD2-CB 4.48Å; F76-F448 AromaticContact CD2-CD2 3.88Å; F76-F448 HydrophobicContact CD2-CD2 3.88Å; F76-F448 HydrophobicContact CE1-CB 4.42Å; F76-F448 AromaticContact CE1-CD2 3.79Å; F76-F448 HydrophobicContact CE1-CD2 3.79Å; F76-F448 VanDerWaalsContact CE2-CA 3.47Å; F76-F448 HydrophobicContact CE2-CB 4.16Å; F76-F448 HydrophobicContact CE2-CD2 4.25Å; F76-F448 AromaticContact CG-CD2 3.44Å; F76-F448 HydrophobicContact CG-CD2 3.44Å; F76-F448 VanDerWaalsContact CG-CD2 3.44Å; F76-F448 AromaticContact CG-CE2 3.91Å; F76-F448 HydrophobicContact CG-CE2 3.91Å; F76-F448 HydrophobicContact CZ-CB 4.08Å; F76-F448 HydrophobicContact CZ-CD2 4.18Å; F76-L451 VanDerWaalsContact CA-CD1 3.47Å; F76-L451 HydrophobicContact CB-CD1 3.46Å; F76-L451 VanDerWaalsContact CB-CD1 3.46Å; F76-L451 HydrophobicContact CD2-CD1 3.81Å; F76-L451 HydrophobicContact CD2-CG 4.47Å; F76-L451 HydrophobicContact CG-CD1 4.06Å
77	L	81.4	Confident	83.8	Confident	68 Å²	68	74.1 Å²	74.1	36%	0.356	36%	0.363	S	S	.	.	H	α-helix	trans	-62.8	-30.6	175.8	-69.1	172.9	0	0	0	111.6	E73 T74 R81	E73-L77 WeakPolarHBondContact O-CG 3.36Å; E73-L77 PolarHBondContact O-N 2.86Å; T74-L77 PolarHBondContact O-N 2.95Å; L77-R81 WeakPolarHBondContact O-CG 3.49Å; L77-R81 PolarHBondContact O-N 3.24Å; L77-R81 PolarHBondContact O-NE 2.97Å
78	R	80.2	Confident	83.8	Confident	149 Å²	149	72.6 Å²	72.6	56%	0.562	35%	0.349	S	S	*	.	H	α-helix	trans	-69	-48.4	170.5	-167.8	178.6	71.1	-173.5	1.3	111.1	T74 E75 F76 K80 R81 T82	T74-R78 PolarHBondContact O-N 3.03Å; T74-R78 VanDerWaalsContact O-N 3.08Å; E75-R78 WeakPolarHBondContact O-CB 3.37Å; E75-R78 PolarHBondContact O-N 3.3Å; F76-R78 PolarHBondContact O-N 3.11Å; R78-K80 VanDerWaalsContact C-N 3.31Å; R78-K80 PolarHBondContact O-N 2.88Å; R78-R81 WeakPolarHBondContact O-CB 3.11Å; R78-R81 PolarHBondContact O-N 3.45Å; R78-T82 PolarHBondContact O-N 3.35Å; R78-T82 VanDerWaalsContact O-N 3.12Å; R78-T82 PolarHBondContact O-OG1 2.94Å
79	L	76.6	Confident	84.1	Confident	24 Å²	24	71 Å²	71	13%	0.126	33%	0.333	C	S	.	.	H	α-helix	trans	-58.5	-41.5	178.3	179.2	66.6	0	0	0	111.9	E75 F76 R81 T82 L84 Y154 K446 L451	E75-L79 PolarHBondContact O-N 3.37Å; F76-L79 PolarHBondContact O-N 3.01Å; F76-L79 VanDerWaalsContact O-N 3.12Å; L79-R81 PolarHBondContact O-N 3.41Å; L79-T82 WeakPolarHBondContact O-CB 3.42Å; L79-T82 PolarHBondContact O-N 2.84Å; L79-L84 HydrophobicContact CD1-CD1 4.48Å; L79-Y154 HydrophobicContact CD2-CE1 4.3Å; L79-K446 HydrophobicContact CD1-CD 4.41Å; L79-K446 HydrophobicContact CD2-CD 4.41Å; L79-K446 HydrophobicContact CG-CD 3.9Å; L79-K446 PolarHBondContact O-NZ 3.49Å; L79-L451 HydrophobicContact CB-CD2 3.97Å; L79-L451 HydrophobicContact CD2-CD2 3.76Å; L79-L451 HydrophobicContact CD2-CG 4.05Å; L79-L451 HydrophobicContact CG-CD2 4.42Å
80	K	75.1	Confident	84.4	Confident	59 Å²	59	74.6 Å²	74.6	26%	0.257	35%	0.35	S	S	.	.	H	α-helix	trans	-60.5	-31.4	175.4	-83.8	-176.1	162.3	173.2	0	113.1	Q37 F76 R78	Q37-K80 VanDerWaalsContact CD-NZ 3.32Å; Q37-K80 VanDerWaalsContact CG-NZ 3.31Å; F76-K80 HydrophobicContact CD1-CD 4.19Å; F76-K80 HydrophobicContact CE1-CD 3.86Å; F76-K80 HydrophobicContact CE1-CG 4.46Å; F76-K80 VanDerWaalsContact CE1-NZ 3.32Å; F76-K80 HydrophobicContact CE2-CG 4.36Å; F76-K80 HydrophobicContact CZ-CD 4.09Å; F76-K80 HydrophobicContact CZ-CG 4.31Å; F76-K80 PolarHBondContact O-N 3.49Å; R78-K80 VanDerWaalsContact C-N 3.31Å; R78-K80 PolarHBondContact O-N 2.88Å
81	R	76.5	Confident	84.8	Confident	190 Å²	190	74.4 Å²	74.4	72%	0.717	35%	0.345	S	S	*	.	H	α-helix	trans	-77.9	-30.8	176.4	-72.8	-179.9	-76.1	172.9	-3	112.9	L77 R78 L79	L77-R81 WeakPolarHBondContact O-CG 3.49Å; L77-R81 PolarHBondContact O-N 3.24Å; L77-R81 PolarHBondContact O-NE 2.97Å; R78-R81 WeakPolarHBondContact O-CB 3.11Å; R78-R81 PolarHBondContact O-N 3.45Å; L79-R81 PolarHBondContact O-N 3.41Å
82	T	76.8	Confident	85.1	Confident	68 Å²	68	71.8 Å²	71.8	42%	0.417	34%	0.335	S	S	.	.	S	Bend	trans	-64.3	137.1	173.8	-51.4	0	0	0	0	109.5	R78 L79 K446	R78-T82 PolarHBondContact O-N 3.35Å; R78-T82 VanDerWaalsContact O-N 3.12Å; R78-T82 PolarHBondContact O-OG1 2.94Å; L79-T82 WeakPolarHBondContact O-CB 3.42Å; L79-T82 PolarHBondContact O-N 2.84Å; T82-K446 PolarHBondContact O-NZ 2.85Å
83	R	79.5	Confident	85.5	Confident	229 Å²	229	70.5 Å²	70.5	86%	0.864	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-85.1	118.3	165.3	-77.9	-179.2	160.6	-175	-6.2	107.5
84	L	83.1	Confident	85.8	Confident	20 Å²	20	70.8 Å²	70.8	11%	0.105	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-82.7	135.1	169.9	-81.1	166.9	0	0	0	107.7	L79 D88 Y154 K446	L79-L84 HydrophobicContact CD1-CD1 4.48Å; L84-D88 VanDerWaalsContact CA-OD2 3.28Å; L84-D88 WeakPolarHBondContact CA-OD2 3.4Å; L84-D88 HydrophobicContact CD2-CB 4.18Å; L84-D88 WeakPolarHBondContact CD2-OD2 3.36Å; L84-Y154 HydrophobicContact CD1-CD1 3.69Å; L84-Y154 HydrophobicContact CD1-CD2 4.32Å; L84-Y154 HydrophobicContact CD1-CE1 4.15Å; L84-Y154 HydrophobicContact CD1-CG 3.81Å; L84-K446 HydrophobicContact CD1-CD 3.97Å; L84-K446 HydrophobicContact CD1-CG 4.39Å
85	G	88.4	Confident	86.1	Confident	9 Å²	9	67 Å²	67	9%	0.093	31%	0.308	C	S	.	.			trans	-135.2	177.8	177	0	0	0	0	0	111.7	E87 D88 F89	G85-E87 VanDerWaalsContact C-OE2 3.32Å; G85-E87 WeakPolarHBondContact CA-OE2 3.49Å; G85-E87 PolarHBondContact O-N 3.03Å; G85-D88 PolarHBondContact N-OD2 3.36Å; G85-D88 WeakPolarHBondContact O-CB 3.1Å; G85-D88 PolarHBondContact O-N 3.27Å; G85-F89 WeakPolarHBondContact O-CD2 3.46Å
86	L	90.8	Very high	86.3	Confident	48 Å²	48	65.4 Å²	65.4	25%	0.251	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-62.2	-31.1	178.3	-176.9	65.2	0	0	0	111.4	D88 F89 M117 F156 Y163 L419	L86-D88 PolarHBondContact O-N 2.77Å; L86-F89 PolarHBondContact O-N 2.87Å; L86-F89 VanDerWaalsContact O-N 3.09Å; L86-F89 VanDerWaalsContact O-O 3.12Å; L86-M117 HydrophobicContact CD1-CE 3.66Å; L86-M117 HydrophobicContact CD1-SD 3.91Å; L86-F156 HydrophobicContact CB-CE2 4.44Å; L86-Y163 HydrophobicContact CD1-CD1 4.4Å; L86-Y163 HydrophobicContact CD1-CE1 3.89Å; L86-L419 HydrophobicContact CD1-CD2 4.16Å; L86-L419 HydrophobicContact CD2-CD2 3.89Å
87	E	91.6	Very high	86.3	Confident	128 Å²	128	69.3 Å²	69.3	60%	0.598	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-62.6	-20.9	178.3	65.9	-84.5	-161.3	0	0	114.3	G85 F89 K109	G85-E87 VanDerWaalsContact C-OE2 3.32Å; G85-E87 WeakPolarHBondContact CA-OE2 3.49Å; G85-E87 PolarHBondContact O-N 3.03Å; E87-F89 PolarHBondContact O-N 3.49Å; E87-K109 WeakPolarHBondContact O-CD 3.39Å; E87-K109 VanDerWaalsContact O-CE 3.31Å; E87-K109 WeakPolarHBondContact O-CE 3.3Å; E87-K109 PolarHBondContact O-NZ 2.77Å
88	D	91.3	Very high	85.8	Confident	46 Å²	46	68.1 Å²	68.1	25%	0.246	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-77.5	-9.7	176.7	-64.6	-55	0	0	0	112.7	L84 G85 L86 K109	L84-D88 VanDerWaalsContact CA-OD2 3.28Å; L84-D88 WeakPolarHBondContact CA-OD2 3.4Å; L84-D88 HydrophobicContact CD2-CB 4.18Å; L84-D88 WeakPolarHBondContact CD2-OD2 3.36Å; G85-D88 PolarHBondContact N-OD2 3.36Å; G85-D88 WeakPolarHBondContact O-CB 3.1Å; G85-D88 PolarHBondContact O-N 3.27Å; L86-D88 PolarHBondContact O-N 2.77Å; D88-K109 PolarHBondContact O-N 2.68Å
89	F	94.6	Very high	85.3	Confident	11 Å²	11	62.5 Å²	62.5	5%	0.048	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	143.9	-176.5	-60.1	-89.3	0	0	0	111	G85 L86 E87 V106 Q107 K108 Y115 Y154 F156 I165	G85-F89 WeakPolarHBondContact O-CD2 3.46Å; L86-F89 PolarHBondContact O-N 2.87Å; L86-F89 VanDerWaalsContact O-N 3.09Å; L86-F89 VanDerWaalsContact O-O 3.12Å; E87-F89 PolarHBondContact O-N 3.49Å; F89-V106 HydrophobicContact CB-CB 4.32Å; F89-V106 HydrophobicContact CB-CG2 4.45Å; F89-V106 HydrophobicContact CD1-CG2 3.86Å; F89-V106 HydrophobicContact CG-CG2 4.45Å; F89-Q107 CarbonylContact C-O 3.48Å; F89-Q107 WeakPolarHBondContact CA-O 3.21Å; F89-K108 HydrophobicContact CD1-CB 3.97Å; F89-K108 HydrophobicContact CD1-CG 4.13Å; F89-K108 HydrophobicContact CE1-CB 3.86Å; F89-K108 HydrophobicContact CE1-CD 4.28Å; F89-K108 HydrophobicContact CE1-CG 3.77Å; F89-K108 HydrophobicContact CZ-CG 4.24Å; F89-Y115 HydrophobicContact CE1-CD2 4.16Å; F89-Y115 HydrophobicContact CE1-CE2 4.47Å; F89-Y154 HydrophobicContact CZ-CD2 4.09Å; F89-Y154 HydrophobicContact CZ-CE2 4.39Å; F89-F156 HydrophobicContact CD2-CE1 4.36Å; F89-F156 HydrophobicContact CD2-CZ 4.22Å; F89-F156 AromaticContact CE2-CE1 3.79Å; F89-F156 HydrophobicContact CE2-CE1 3.79Å; F89-F156 HydrophobicContact CE2-CZ 4.1Å; F89-I165 HydrophobicContact CE1-CD1 4.19Å; F89-I165 HydrophobicContact CE1-CG1 4.34Å; F89-I165 HydrophobicContact CE1-CG2 4.16Å; F89-I165 HydrophobicContact CE2-CD1 4.32Å; F89-I165 HydrophobicContact CE2-CG1 4.38Å; F89-I165 HydrophobicContact CZ-CD1 4.09Å; F89-I165 HydrophobicContact CZ-CG1 3.94Å; F89-I165 HydrophobicContact CZ-CG2 4.4Å
90	E	95.3	Very high	85	Confident	105 Å²	105	63.6 Å²	63.6	49%	0.491	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	125.5	169.8	-177.4	171.6	179.4	0	0	108.7	L92 V106 Q107 K109	E90-L92 HydrophobicContact CG-CD2 4.4Å; E90-L92 PolarHBondContact O-N 3.24Å; E90-V106 CarbonylContact O-C 3.58Å; E90-V106 WeakPolarHBondContact O-CA 3.47Å; E90-V106 WeakPolarHBondContact O-CB 3.39Å; E90-Q107 PolarHBondContact N-O 2.96Å; E90-Q107 PolarHBondContact O-N 2.79Å; E90-K109 HydrophobicContact CB-CG 4.47Å
91	S	94.9	Very high	85.3	Confident	49 Å²	49	61.2 Å²	61.2	34%	0.343	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	118.4	177.7	171.7	0	0	0	0	109.7	R104	S91-R104 WeakPolarHBondContact OG-CD 3.43Å; S91-R104 PolarHBondContact OG-NH1 3.07Å
92	L	93.5	Very high	85.8	Confident	67 Å²	67	52.4 Å²	52.4	35%	0.351	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-53.1	179.7	-57.9	-177.6	0	0	0	111.9	E90 L105 Q107	E90-L92 HydrophobicContact CG-CD2 4.4Å; E90-L92 PolarHBondContact O-N 3.24Å; L92-L105 HydrophobicContact CB-CB 4.45Å; L92-L105 HydrophobicContact CB-CD2 4.38Å; L92-L105 HydrophobicContact CB-CG 4.43Å; L92-L105 WeakPolarHBondContact CB-O 3.36Å; L92-L105 HydrophobicContact CD1-CD2 4.12Å; L92-L105 HydrophobicContact CD1-CG 4.23Å; L92-L105 PolarHBondContact N-O 3.01Å; L92-Q107 HydrophobicContact CD1-CB 4.13Å; L92-Q107 HydrophobicContact CD2-CB 4.36Å; L92-Q107 HydrophobicContact CG-CB 4.31Å
93	K	93.3	Very high	86.6	Confident	64 Å²	64	50.9 Å²	50.9	28%	0.278	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	148.3	-175.8	-168.6	175	172.2	-178	0	111.8	R104 L105 T407	K93-R104 CarbonylContact O-C 3.56Å; K93-R104 VanDerWaalsContact O-CA 3.28Å; K93-R104 WeakPolarHBondContact O-CA 3.49Å; K93-L105 PolarHBondContact N-O 2.86Å; K93-L105 PolarHBondContact O-N 2.76Å; K93-T407 HydrophobicContact CD-CG2 4.16Å; K93-T407 VanDerWaalsContact CD-OG1 3.28Å; K93-T407 WeakPolarHBondContact CD-OG1 3.49Å; K93-T407 PolarHBondContact NZ-OG1 2.89Å
94	V	92.6	Very high	87.3	Confident	9 Å²	9	41.1 Å²	41.1	6%	0.055	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	121.9	167.2	-177.1	0	0	0	0	108.5	R97 R104 F413	V94-R97 HydrophobicContact CG1-CG 4.34Å; V94-R104 HydrophobicContact CG2-CG 4.26Å; V94-F413 HydrophobicContact CB-CB 4.1Å; V94-F413 HydrophobicContact CG1-CB 3.8Å; V94-F413 HydrophobicContact CG1-CG 4.25Å
95	I	90.7	Very high	87.9	Confident	12 Å²	12	40.3 Å²	40.3	6%	0.062	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	-9.9	-176.5	59.2	173.3	0	0	0	113.2	V103 L105 A116 F168 T407 F410 F413	I95-V103 HydrophobicContact CD1-CG1 3.97Å; I95-V103 HydrophobicContact CG1-CB 4.21Å; I95-V103 HydrophobicContact CG1-CG1 3.87Å; I95-V103 WeakPolarHBondContact CG1-O 3.16Å; I95-V103 PolarHBondContact N-O 3.31Å; I95-L105 HydrophobicContact CD1-CB 4.47Å; I95-L105 HydrophobicContact CG2-CB 3.94Å; I95-A116 HydrophobicContact CD1-CB 4.32Å; I95-F168 HydrophobicContact CD1-CD2 3.94Å; I95-F168 HydrophobicContact CD1-CE2 3.83Å; I95-T407 HydrophobicContact CG2-CG2 3.67Å; I95-F410 HydrophobicContact CB-CD1 3.93Å; I95-F410 HydrophobicContact CB-CE1 4.32Å; I95-F410 HydrophobicContact CB-CG 4.16Å; I95-F410 HydrophobicContact CD1-CE1 4.37Å; I95-F410 HydrophobicContact CG2-CG 4.47Å; I95-F410 WeakPolarHBondContact O-CD1 3.45Å; I95-F413 WeakPolarHBondContact O-CE2 3.5Å
96	G	85.6	Confident	88.3	Confident	15 Å²	15	39.9 Å²	39.9	16%	0.155	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	155.5	175	0	0	0	0	0	112.2	E102 V103	G96-E102 WeakPolarHBondContact O-CA 3.28Å; G96-E102 WeakPolarHBondContact O-CB 3.33Å; G96-V103 PolarHBondContact N-O 3.44Å; G96-V103 VanDerWaalsContact N-O 3.14Å; G96-V103 PolarHBondContact O-N 3.09Å
97	R	81	Confident	88.5	Confident	86 Å²	86	40.6 Å²	40.6	33%	0.325	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	136.2	171.4	-71.7	-174.5	179.5	-171	-1.8	109.1	V94 E102 F280 F413 P414 E415	V94-R97 HydrophobicContact CG1-CG 4.34Å; R97-E102 HydrophobicContact CG-CB 4.17Å; R97-F280 HydrophobicContact CB-CD1 4.27Å; R97-F280 HydrophobicContact CB-CE1 4.29Å; R97-F280 WeakPolarHBondContact O-CD1 3.27Å; R97-F280 WeakPolarHBondContact O-CE1 3.39Å; R97-F413 HydrophobicContact CB-CD1 4.31Å; R97-F413 HydrophobicContact CB-CE1 4.19Å; R97-F413 HydrophobicContact CG-CD1 3.83Å; R97-F413 HydrophobicContact CG-CE1 4.21Å; R97-F413 HydrophobicContact CG-CG 4.43Å; R97-P414 PolarHBondContact NH2-O 3.43Å; R97-E415 PolarHBondContact NH2-O 2.93Å
98	G	71.1	Confident	88.5	Confident	43 Å²	43	35 Å²	35	44%	0.443	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	173.5	175.1	0	0	0	0	0	111.3	F100 G101	G98-F100 PolarHBondContact O-N 3.38Å; G98-G101 PolarHBondContact N-O 2.83Å; G98-G101 PolarHBondContact O-N 3.19Å
99	A	68.4	Low	88.5	Confident	30 Å²	30	38.8 Å²	38.8	25%	0.248	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-18.9	177.6	0	0	0	0	0	114.8	T282	A99-T282 HydrophobicContact CB-CG2 3.7Å
100	F	71.4	Confident	88.1	Confident	48 Å²	48	43.8 Å²	43.8	21%	0.211	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129	3.7	-168.5	-55.4	-72.8	0	0	0	113.8	G98 L120 R121 M125 K128 Q130	G98-F100 PolarHBondContact O-N 3.38Å; F100-L120 HydrophobicContact CB-CD2 4.23Å; F100-R121 PolarHBondContact O-N 3.03Å; F100-M125 HydrophobicContact CB-CE 3.38Å; F100-M125 HydrophobicContact CD1-CE 3.18Å; F100-M125 HydrophobicContact CD2-CE 4.23Å; F100-M125 HydrophobicContact CE1-CE 3.93Å; F100-M125 HydrophobicContact CG-CE 3.35Å; F100-K128 HydrophobicContact CD1-CD 4.03Å; F100-K128 HydrophobicContact CE1-CB 4.36Å; F100-K128 HydrophobicContact CE1-CD 3.48Å; F100-K128 VanDerWaalsContact CE1-CD 3.48Å; F100-Q130 HydrophobicContact CE1-CG 3.86Å; F100-Q130 HydrophobicContact CZ-CG 3.98Å
101	G	81	Confident	87.7	Confident	9 Å²	9	41.7 Å²	41.7	9%	0.093	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.4	-166.4	-162.5	0	0	0	0	0	114.1	G98 I119	G98-G101 PolarHBondContact N-O 2.83Å; G98-G101 PolarHBondContact O-N 3.19Å; G101-I119 CarbonylContact C-O 3.54Å; G101-I119 WeakPolarHBondContact CA-O 3.28Å
102	E	88.1	Confident	87.3	Confident	5 Å²	5	40.8 Å²	40.8	2%	0.023	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	162.3	176.5	67.6	-172.1	-141.8	0	0	111.3	G96 R97 R104 I119 S416 I418	G96-E102 WeakPolarHBondContact O-CA 3.28Å; G96-E102 WeakPolarHBondContact O-CB 3.33Å; R97-E102 HydrophobicContact CG-CB 4.17Å; E102-R104 HydrophobicContact CG-CG 4.48Å; E102-R104 IonicContact OE1-CZ 3.44Å; E102-R104 IonicContact OE1-NE 3.98Å; E102-R104 PolarHBondContact OE1-NE 2.96Å; E102-R104 IonicContact OE1-NH2 3.92Å; E102-R104 PolarHBondContact OE1-NH2 3.5Å; E102-I119 HydrophobicContact CG-CD1 4.07Å; E102-I119 PolarHBondContact N-O 2.93Å; E102-I119 VanDerWaalsContact N-O 3.12Å; E102-I119 PolarHBondContact O-N 3.27Å; E102-S416 WeakPolarHBondContact OE2-CB 3.33Å; E102-S416 PolarHBondContact OE2-OG 3.22Å; E102-I418 HydrophobicContact CG-CB 4.49Å; E102-I418 HydrophobicContact CG-CD1 4.01Å; E102-I418 HydrophobicContact CG-CG2 3.77Å; E102-I418 WeakPolarHBondContact OE1-CG2 3.43Å
103	V	91.6	Very high	87.1	Confident	36 Å²	36	40.3 Å²	40.3	22%	0.218	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	128	178	-171.6	0	0	0	0	108.2	I95 G96 A116 M117 K118	I95-V103 HydrophobicContact CD1-CG1 3.97Å; I95-V103 HydrophobicContact CG1-CB 4.21Å; I95-V103 HydrophobicContact CG1-CG1 3.87Å; I95-V103 WeakPolarHBondContact CG1-O 3.16Å; I95-V103 PolarHBondContact N-O 3.31Å; G96-V103 PolarHBondContact N-O 3.44Å; G96-V103 VanDerWaalsContact N-O 3.14Å; G96-V103 PolarHBondContact O-N 3.09Å; V103-A116 HydrophobicContact CG1-CB 4.23Å; V103-M117 CarbonylContact C-O 3.59Å; V103-M117 WeakPolarHBondContact CA-O 3.38Å; V103-K118 HydrophobicContact CG2-CB 4.2Å; V103-K118 HydrophobicContact CG2-CG 4.13Å
104	R	94.7	Very high	87.1	Confident	23 Å²	23	37.9 Å²	37.9	9%	0.087	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	141.4	178.6	-60.4	-166.1	178.8	-149.8	-3.6	111.2	S91 K93 V94 E102 V106 A116 M117 I119 S416 L419	S91-R104 WeakPolarHBondContact OG-CD 3.43Å; S91-R104 PolarHBondContact OG-NH1 3.07Å; K93-R104 CarbonylContact O-C 3.56Å; K93-R104 VanDerWaalsContact O-CA 3.28Å; K93-R104 WeakPolarHBondContact O-CA 3.49Å; V94-R104 HydrophobicContact CG2-CG 4.26Å; E102-R104 HydrophobicContact CG-CG 4.48Å; E102-R104 IonicContact OE1-CZ 3.44Å; E102-R104 IonicContact OE1-NE 3.98Å; E102-R104 PolarHBondContact OE1-NE 2.96Å; E102-R104 IonicContact OE1-NH2 3.92Å; E102-R104 PolarHBondContact OE1-NH2 3.5Å; R104-V106 HydrophobicContact CB-CG1 4.03Å; R104-A116 CarbonylContact O-C 3.59Å; R104-A116 WeakPolarHBondContact O-CA 3.35Å; R104-M117 PolarHBondContact N-O 3.09Å; R104-M117 PolarHBondContact O-N 2.95Å; R104-I119 HydrophobicContact CG-CD1 3.96Å; R104-S416 PolarHBondContact NH2-O 2.9Å; R104-L419 VanDerWaalsContact CZ-CD1 3.43Å
105	L	95.9	Very high	87.3	Confident	3 Å²	3	37.5 Å²	37.5	2%	0.016	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	125.9	159.2	-169.9	68.8	0	0	0	108.2	L92 K93 I95 V114 F168 D405 T407	L92-L105 HydrophobicContact CB-CB 4.45Å; L92-L105 HydrophobicContact CB-CD2 4.38Å; L92-L105 HydrophobicContact CB-CG 4.43Å; L92-L105 WeakPolarHBondContact CB-O 3.36Å; L92-L105 HydrophobicContact CD1-CD2 4.12Å; L92-L105 HydrophobicContact CD1-CG 4.23Å; L92-L105 PolarHBondContact N-O 3.01Å; K93-L105 PolarHBondContact N-O 2.86Å; K93-L105 PolarHBondContact O-N 2.76Å; I95-L105 HydrophobicContact CD1-CB 4.47Å; I95-L105 HydrophobicContact CG2-CB 3.94Å; L105-V114 HydrophobicContact CD1-CG1 3.25Å; L105-V114 HydrophobicContact CD2-CG1 4.31Å; L105-V114 HydrophobicContact CG-CG1 3.82Å; L105-F168 HydrophobicContact CD1-CB 4.01Å; L105-F168 HydrophobicContact CD1-CD1 3.55Å; L105-F168 HydrophobicContact CD1-CD2 3.48Å; L105-F168 VanDerWaalsContact CD1-CD2 3.48Å; L105-F168 HydrophobicContact CD1-CE1 3.78Å; L105-F168 HydrophobicContact CD1-CE2 3.74Å; L105-F168 HydrophobicContact CD1-CG 3.38Å; L105-F168 HydrophobicContact CD1-CZ 3.87Å; L105-D405 HydrophobicContact CD2-CB 3.96Å; L105-T407 HydrophobicContact CD2-CG2 3.73Å
106	V	96.1	Very high	87.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	151.8	-179.1	-56.5	0	0	0	0	111.4	F89 E90 R104 V114 Y115 M117	F89-V106 HydrophobicContact CB-CB 4.32Å; F89-V106 HydrophobicContact CB-CG2 4.45Å; F89-V106 HydrophobicContact CD1-CG2 3.86Å; F89-V106 HydrophobicContact CG-CG2 4.45Å; E90-V106 CarbonylContact O-C 3.58Å; E90-V106 WeakPolarHBondContact O-CA 3.47Å; E90-V106 WeakPolarHBondContact O-CB 3.39Å; R104-V106 HydrophobicContact CB-CG1 4.03Å; V106-V114 CarbonylContact O-C 3.55Å; V106-V114 WeakPolarHBondContact O-CA 3.48Å; V106-Y115 PolarHBondContact N-O 3.27Å; V106-Y115 PolarHBondContact O-N 2.79Å; V106-M117 HydrophobicContact CB-CB 4.44Å; V106-M117 HydrophobicContact CG1-CB 3.65Å; V106-M117 HydrophobicContact CG1-CE 3.61Å; V106-M117 HydrophobicContact CG1-CG 4.46Å; V106-M117 HydrophobicContact CG1-SD 4.1Å; V106-M117 HydrophobicContact CG2-CB 3.84Å
107	Q	95	Very high	87.9	Confident	64 Å²	64	36.6 Å²	36.6	30%	0.299	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	129.8	172	-168.3	174.5	38.6	0	0	110	F89 E90 L92 G112 H113	F89-Q107 CarbonylContact C-O 3.48Å; F89-Q107 WeakPolarHBondContact CA-O 3.21Å; E90-Q107 PolarHBondContact N-O 2.96Å; E90-Q107 PolarHBondContact O-N 2.79Å; L92-Q107 HydrophobicContact CD1-CB 4.13Å; L92-Q107 HydrophobicContact CD2-CB 4.36Å; L92-Q107 HydrophobicContact CG-CB 4.31Å; Q107-G112 WeakPolarHBondContact CG-O 3.29Å; Q107-G112 PolarHBondContact NE2-O 3.36Å; Q107-H113 CarbonylContact C-O 3.55Å; Q107-H113 WeakPolarHBondContact CA-O 3.36Å
108	K	92.8	Very high	88.4	Confident	9 Å²	9	33.9 Å²	33.9	4%	0.039	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	125	174.7	-164.1	-172.2	-172	-67.6	0	109.6	F89 D110 T111 G112 H113 Y115	F89-K108 HydrophobicContact CD1-CB 3.97Å; F89-K108 HydrophobicContact CD1-CG 4.13Å; F89-K108 HydrophobicContact CE1-CB 3.86Å; F89-K108 HydrophobicContact CE1-CD 4.28Å; F89-K108 HydrophobicContact CE1-CG 3.77Å; F89-K108 HydrophobicContact CZ-CG 4.24Å; K108-D110 WeakPolarHBondContact CD-OD1 3.47Å; K108-D110 VanDerWaalsContact CG-OD1 3.26Å; K108-D110 WeakPolarHBondContact CG-OD1 3.47Å; K108-D110 IonicContact NZ-OD1 3.45Å; K108-D110 PolarHBondContact NZ-OD1 2.96Å; K108-D110 IonicContact NZ-OD2 3.58Å; K108-D110 PolarHBondContact NZ-OD2 3.28Å; K108-D110 PolarHBondContact O-N 2.74Å; K108-T111 PolarHBondContact O-N 2.77Å; K108-G112 WeakPolarHBondContact O-CA 3.48Å; K108-G112 PolarHBondContact O-N 3.24Å; K108-H113 PolarHBondContact N-O 3.34Å; K108-Y115 HydrophobicContact CB-CD2 4.22Å; K108-Y115 HydrophobicContact CB-CE2 3.74Å; K108-Y115 HydrophobicContact CD-CE2 4.29Å
109	K	92	Very high	89.4	Confident	127 Å²	127	31.8 Å²	31.8	55%	0.552	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-35.6	-165.7	-68.9	178.7	-178.6	168.7	0	115.1	E87 D88 E90	E87-K109 WeakPolarHBondContact O-CD 3.39Å; E87-K109 VanDerWaalsContact O-CE 3.31Å; E87-K109 WeakPolarHBondContact O-CE 3.3Å; E87-K109 PolarHBondContact O-NZ 2.77Å; D88-K109 PolarHBondContact O-N 2.68Å; E90-K109 HydrophobicContact CB-CG 4.47Å
110	D	85.2	Confident	90.3	Very high	116 Å²	116	30.9 Å²	30.9	62%	0.62	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-27.1	-177.5	63.8	-24.2	0	0	0	113.6	K108	K108-D110 WeakPolarHBondContact CD-OD1 3.47Å; K108-D110 VanDerWaalsContact CG-OD1 3.26Å; K108-D110 WeakPolarHBondContact CG-OD1 3.47Å; K108-D110 IonicContact NZ-OD1 3.45Å; K108-D110 PolarHBondContact NZ-OD1 2.96Å; K108-D110 IonicContact NZ-OD2 3.58Å; K108-D110 PolarHBondContact NZ-OD2 3.28Å; K108-D110 PolarHBondContact O-N 2.74Å
111	T	85.9	Confident	90.9	Very high	61 Å²	61	33.8 Å²	33.8	37%	0.374	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-19.4	-177.5	63.4	0	0	0	0	114	K108 H113	K108-T111 PolarHBondContact O-N 2.77Å; T111-H113 PolarHBondContact O-N 3.15Å; T111-H113 WeakPolarHBondContact OG1-CB 3.29Å; T111-H113 PolarHBondContact OG1-N 2.78Å
112	G	87.5	Confident	91.1	Very high	30 Å²	30	33.7 Å²	33.7	31%	0.309	17%	0.17	S	C	.	.			trans	69.1	7.3	-170.6	0	0	0	0	0	114	Q107 K108	Q107-G112 WeakPolarHBondContact CG-O 3.29Å; Q107-G112 PolarHBondContact NE2-O 3.36Å; K108-G112 WeakPolarHBondContact O-CA 3.48Å; K108-G112 PolarHBondContact O-N 3.24Å
113	H	89.3	Confident	90.8	Very high	56 Å²	56	35 Å²	35	26%	0.259	18%	0.181	S	C	.	.			trans	-76.6	143.1	-177.7	-160.7	84.9	0	0	0	111.4	Q107 K108 T111 Y115 A453	Q107-H113 CarbonylContact C-O 3.55Å; Q107-H113 WeakPolarHBondContact CA-O 3.36Å; K108-H113 PolarHBondContact N-O 3.34Å; T111-H113 PolarHBondContact O-N 3.15Å; T111-H113 WeakPolarHBondContact OG1-CB 3.29Å; T111-H113 PolarHBondContact OG1-N 2.78Å; H113-Y115 HydrophobicContact CB-CE2 3.76Å; H113-Y115 AromaticContact CD2-CE1 3.55Å; H113-Y115 AromaticContact CD2-CE2 3.67Å; H113-Y115 AromaticContact CD2-CZ 3.3Å; H113-Y115 PolarHBondContact CD2-OH 3.46Å; H113-Y115 AromaticContact CG-CZ 3.92Å; H113-Y115 WeakPolarHBondContact O-CD2 3.32Å; H113-Y115 WeakPolarHBondContact O-CE2 3.31Å; H113-A453 PolarHBondContact ND1-O 3.49Å; H113-A453 VanDerWaalsContact ND1-O 3.1Å
114	V	93.7	Very high	90.1	Very high	13 Å²	13	34.7 Å²	34.7	8%	0.079	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	138.3	-175.6	179.3	0	0	0	0	110.3	L105 V106 F168 I404 D405	L105-V114 HydrophobicContact CD1-CG1 3.25Å; L105-V114 HydrophobicContact CD2-CG1 4.31Å; L105-V114 HydrophobicContact CG-CG1 3.82Å; V106-V114 CarbonylContact O-C 3.55Å; V106-V114 WeakPolarHBondContact O-CA 3.48Å; V114-F168 HydrophobicContact CG1-CB 4.39Å; V114-F168 HydrophobicContact CG1-CD1 4.18Å; V114-F168 HydrophobicContact CG1-CG 4.5Å; V114-I404 HydrophobicContact CG2-CD1 4.14Å; V114-I404 HydrophobicContact CG2-CG1 4.45Å; V114-D405 HydrophobicContact CG2-CB 4.37Å
115	Y	95.5	Very high	89.4	Confident	1 Å²	1	33.8 Å²	33.8	0%	0.004	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	160.3	-178.9	-59.6	-84.4	0	0	0	111	F89 V106 K108 H113 F153 Y154 I165 M166	F89-Y115 HydrophobicContact CE1-CD2 4.16Å; F89-Y115 HydrophobicContact CE1-CE2 4.47Å; V106-Y115 PolarHBondContact N-O 3.27Å; V106-Y115 PolarHBondContact O-N 2.79Å; K108-Y115 HydrophobicContact CB-CD2 4.22Å; K108-Y115 HydrophobicContact CB-CE2 3.74Å; K108-Y115 HydrophobicContact CD-CE2 4.29Å; H113-Y115 HydrophobicContact CB-CE2 3.76Å; H113-Y115 AromaticContact CD2-CE1 3.55Å; H113-Y115 AromaticContact CD2-CE2 3.67Å; H113-Y115 AromaticContact CD2-CZ 3.3Å; H113-Y115 PolarHBondContact CD2-OH 3.46Å; H113-Y115 AromaticContact CG-CZ 3.92Å; H113-Y115 WeakPolarHBondContact O-CD2 3.32Å; H113-Y115 WeakPolarHBondContact O-CE2 3.31Å; Y115-F153 AromaticContact CD1-CD2 3.68Å; Y115-F153 HydrophobicContact CD1-CD2 3.68Å; Y115-F153 HydrophobicContact CD1-CE2 4.06Å; Y115-F153 HydrophobicContact CD1-CG 4.48Å; Y115-F153 HydrophobicContact CE1-CB 4.44Å; Y115-F153 AromaticContact CE1-CD2 3.53Å; Y115-F153 HydrophobicContact CE1-CD2 3.53Å; Y115-F153 AromaticContact CE1-CE2 3.85Å; Y115-F153 HydrophobicContact CE1-CE2 3.85Å; Y115-F153 AromaticContact CE1-CG 3.99Å; Y115-F153 HydrophobicContact CE1-CG 3.99Å; Y115-Y154 HydrophobicContact CE1-CE2 4.41Å; Y115-I165 HydrophobicContact CD1-CG2 3.68Å; Y115-I165 HydrophobicContact CD2-CG2 4.23Å; Y115-I165 HydrophobicContact CE1-CG2 4.41Å; Y115-I165 HydrophobicContact CG-CG2 3.57Å; Y115-M166 WeakPolarHBondContact CA-O 3.3Å; Y115-M166 WeakPolarHBondContact CB-O 3.48Å
116	A	95.5	Very high	88.3	Confident	8 Å²	8	35.5 Å²	35.5	7%	0.066	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	127.8	161.4	0	0	0	0	0	109.3	I95 V103 R104 M166	I95-A116 HydrophobicContact CD1-CB 4.32Å; V103-A116 HydrophobicContact CG1-CB 4.23Å; R104-A116 CarbonylContact O-C 3.59Å; R104-A116 WeakPolarHBondContact O-CA 3.35Å; A116-M166 PolarHBondContact N-O 2.81Å; A116-M166 PolarHBondContact O-N 2.73Å
117	M	94.8	Very high	87.2	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	110.1	177.1	179.2	169.6	76.4	0	0	110	L86 V103 R104 V106 I119 Y163 L164 I165 L419	L86-M117 HydrophobicContact CD1-CE 3.66Å; L86-M117 HydrophobicContact CD1-SD 3.91Å; V103-M117 CarbonylContact C-O 3.59Å; V103-M117 WeakPolarHBondContact CA-O 3.38Å; R104-M117 PolarHBondContact N-O 3.09Å; R104-M117 PolarHBondContact O-N 2.95Å; V106-M117 HydrophobicContact CB-CB 4.44Å; V106-M117 HydrophobicContact CG1-CB 3.65Å; V106-M117 HydrophobicContact CG1-CE 3.61Å; V106-M117 HydrophobicContact CG1-CG 4.46Å; V106-M117 HydrophobicContact CG1-SD 4.1Å; V106-M117 HydrophobicContact CG2-CB 3.84Å; M117-I119 HydrophobicContact CE-CD1 3.83Å; M117-I119 HydrophobicContact CE-CG1 4.01Å; M117-I119 HydrophobicContact CG-CG1 4.05Å; M117-Y163 HydrophobicContact CG-CD1 4.33Å; M117-Y163 HydrophobicContact SD-CD1 3.95Å; M117-L164 CarbonylContact C-O 3.57Å; M117-L164 VanDerWaalsContact CA-O 3.31Å; M117-L164 WeakPolarHBondContact CA-O 3.48Å; M117-I165 HydrophobicContact CB-CD1 3.79Å; M117-I165 HydrophobicContact CG-CD1 3.59Å; M117-I165 HydrophobicContact SD-CD1 3.82Å; M117-L419 HydrophobicContact CE-CD1 4.48Å
118	K	92	Very high	85.9	Confident	28 Å²	28	43.5 Å²	43.5	12%	0.122	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	124.7	171.3	-175.2	173.6	-177.5	-178.2	0	108.7	V103 L120 E137 Y163 L164 M166 D230	V103-K118 HydrophobicContact CG2-CB 4.2Å; V103-K118 HydrophobicContact CG2-CG 4.13Å; K118-L120 HydrophobicContact CG-CD2 4.33Å; K118-L120 HydrophobicContact CG-CG 4.41Å; K118-E137 IonicContact NZ-OE1 3.51Å; K118-E137 PolarHBondContact NZ-OE1 2.9Å; K118-E137 IonicContact NZ-OE2 3.8Å; K118-E137 PolarHBondContact NZ-OE2 2.95Å; K118-Y163 WeakPolarHBondContact O-CA 3.27Å; K118-L164 HydrophobicContact CB-CB 4.24Å; K118-L164 HydrophobicContact CB-CD1 4.4Å; K118-L164 HydrophobicContact CD-CD1 4.1Å; K118-L164 HydrophobicContact CG-CD1 4.42Å; K118-L164 PolarHBondContact N-O 2.77Å; K118-L164 PolarHBondContact O-N 3.22Å; K118-M166 HydrophobicContact CB-CE 3.73Å; K118-M166 HydrophobicContact CD-CE 4.4Å; K118-D230 IonicContact NZ-OD1 3.8Å; K118-D230 PolarHBondContact NZ-OD1 3.17Å
119	I	91.4	Very high	84.9	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	121.7	-176.8	-51.8	158.3	0	0	0	107.6	G101 E102 R104 M117 N161 L162 Y163 I418 L419	G101-I119 CarbonylContact C-O 3.54Å; G101-I119 WeakPolarHBondContact CA-O 3.28Å; E102-I119 HydrophobicContact CG-CD1 4.07Å; E102-I119 PolarHBondContact N-O 2.93Å; E102-I119 VanDerWaalsContact N-O 3.12Å; E102-I119 PolarHBondContact O-N 3.27Å; R104-I119 HydrophobicContact CG-CD1 3.96Å; M117-I119 HydrophobicContact CE-CD1 3.83Å; M117-I119 HydrophobicContact CE-CG1 4.01Å; M117-I119 HydrophobicContact CG-CG1 4.05Å; I119-N161 HydrophobicContact CG2-CB 3.98Å; I119-L162 WeakPolarHBondContact CA-O 3.45Å; I119-Y163 HydrophobicContact CG1-CD1 4.02Å; I119-Y163 HydrophobicContact CG1-CE1 4.11Å; I119-Y163 HydrophobicContact CG2-CD1 4.24Å; I119-Y163 HydrophobicContact CG2-CE1 3.85Å; I119-I418 HydrophobicContact CD1-CG2 3.92Å; I119-I418 HydrophobicContact CG2-CD1 4.37Å; I119-I418 HydrophobicContact CG2-CG2 4.38Å; I119-L419 HydrophobicContact CD1-CD2 3.63Å; I119-L419 HydrophobicContact CD1-CG 4.15Å; I119-L419 HydrophobicContact CG1-CD2 4.46Å
120	L	87.3	Confident	83.9	Confident	11 Å²	11	46.5 Å²	46.5	6%	0.058	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	130.3	-179	-58.7	169.6	0	0	0	110.2	F100 K118 I134 N161 L162 L164	F100-L120 HydrophobicContact CB-CD2 4.23Å; K118-L120 HydrophobicContact CG-CD2 4.33Å; K118-L120 HydrophobicContact CG-CG 4.41Å; L120-I134 HydrophobicContact CD1-CG1 4.36Å; L120-N161 CarbonylContact O-C 3.24Å; L120-N161 VanDerWaalsContact O-CA 3.28Å; L120-N161 WeakPolarHBondContact O-CA 3.45Å; L120-L162 HydrophobicContact CB-CB 4.29Å; L120-L162 PolarHBondContact N-O 3.36Å; L120-L162 PolarHBondContact O-N 3.43Å; L120-L164 HydrophobicContact CD1-CD1 4.27Å
121	R	84.8	Confident	83.4	Confident	108 Å²	108	42.2 Å²	42.2	41%	0.408	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	124.5	-179	-57.9	-179.8	-151.1	179.6	3.5	110.5	F100 A123 D124 M125 I418	F100-R121 PolarHBondContact O-N 3.03Å; R121-A123 VanDerWaalsContact C-N 3.26Å; R121-A123 PolarHBondContact O-N 3.4Å; R121-D124 HydrophobicContact CB-CB 4.27Å; R121-D124 WeakPolarHBondContact CD-OD2 3.28Å; R121-D124 IonicContact NE-OD2 3.08Å; R121-D124 PolarHBondContact O-N 2.65Å; R121-M125 VanDerWaalsContact O-CG 3.24Å; R121-M125 WeakPolarHBondContact O-CG 3.5Å; R121-M125 PolarHBondContact O-N 3.13Å; R121-I418 HydrophobicContact CG-CD1 4.08Å; R121-I418 HydrophobicContact CG-CG1 4.27Å
122	K	84.8	Confident	82.6	Confident	7 Å²	7	41.8 Å²	41.8	3%	0.03	22%	0.222	C	C	.	.	H	α-helix	trans	-59.2	-37.1	-179.8	-73.6	-179.6	168.2	-173.5	0	112.9	M125 L126 Q157 D158 L160 L162 D437 F440	K122-M125 PolarHBondContact O-N 3.05Å; K122-L126 WeakPolarHBondContact O-CG 3.31Å; K122-L126 PolarHBondContact O-N 3.47Å; K122-L126 VanDerWaalsContact O-N 3.08Å; K122-Q157 VanDerWaalsContact CE-OE1 3.28Å; K122-D158 VanDerWaalsContact CE-O 3.3Å; K122-D158 WeakPolarHBondContact CE-O 3.34Å; K122-D158 PolarHBondContact NZ-O 3.16Å; K122-L160 WeakPolarHBondContact CB-O 3.23Å; K122-L160 PolarHBondContact N-O 3.31Å; K122-L162 HydrophobicContact CD-CD2 4.43Å; K122-L162 VanDerWaalsContact CE-CD2 3.5Å; K122-L162 HydrophobicContact CG-CD2 4.08Å; K122-L162 HydrophobicContact CG-CG 3.99Å; K122-D437 IonicContact NZ-OD1 2.77Å; K122-D437 PolarHBondContact NZ-OD1 3.02Å; K122-D437 IonicContact NZ-OD2 3.13Å; K122-F440 HydrophobicContact CB-CE2 4.12Å; K122-F440 HydrophobicContact CB-CZ 4.46Å; K122-F440 HydrophobicContact CD-CD2 4.12Å; K122-F440 HydrophobicContact CD-CE2 4.12Å; K122-F440 HydrophobicContact CG-CD2 4.28Å; K122-F440 HydrophobicContact CG-CE2 3.91Å; K122-F440 HydrophobicContact CG-CZ 4.32Å
123	A	81.9	Confident	81.9	Confident	32 Å²	32	42.1 Å²	42.1	26%	0.264	22%	0.216	S	C	.	.	H	α-helix	trans	-59.2	-52	178.6	0	0	0	0	0	111.4	R121 M125 L126 E127 Y433	R121-A123 VanDerWaalsContact C-N 3.26Å; R121-A123 PolarHBondContact O-N 3.4Å; A123-M125 PolarHBondContact O-N 3.42Å; A123-L126 PolarHBondContact O-N 3.26Å; A123-L126 VanDerWaalsContact O-N 3.14Å; A123-E127 WeakPolarHBondContact O-CB 3.06Å; A123-E127 PolarHBondContact O-N 2.97Å; A123-Y433 HydrophobicContact CB-CE1 3.87Å
124	D	77.3	Confident	81.2	Confident	31 Å²	31	39.8 Å²	39.8	17%	0.166	21%	0.205	C	C	.	.	H	α-helix	trans	-61	-34.2	179.5	-57.7	3.3	0	0	0	111.9	R121 K128	R121-D124 HydrophobicContact CB-CB 4.27Å; R121-D124 WeakPolarHBondContact CD-OD2 3.28Å; R121-D124 IonicContact NE-OD2 3.08Å; R121-D124 PolarHBondContact O-N 2.65Å; D124-K128 VanDerWaalsContact O-CB 3.3Å; D124-K128 WeakPolarHBondContact O-CB 3.3Å; D124-K128 WeakPolarHBondContact O-CG 3.46Å; D124-K128 PolarHBondContact O-N 3.02Å; D124-K128 VanDerWaalsContact O-N 3.12Å
125	M	78	Confident	80.4	Confident	4 Å²	4	45.1 Å²	45.1	2%	0.02	22%	0.224	C	C	.	.	H	α-helix	trans	-69.8	-36.7	178	-61.4	-65.6	86.6	0	0	113.4	F100 R121 K122 A123 E129 Q130 I134 F440	F100-M125 HydrophobicContact CB-CE 3.38Å; F100-M125 HydrophobicContact CD1-CE 3.18Å; F100-M125 HydrophobicContact CD2-CE 4.23Å; F100-M125 HydrophobicContact CE1-CE 3.93Å; F100-M125 HydrophobicContact CG-CE 3.35Å; R121-M125 VanDerWaalsContact O-CG 3.24Å; R121-M125 WeakPolarHBondContact O-CG 3.5Å; R121-M125 PolarHBondContact O-N 3.13Å; K122-M125 PolarHBondContact O-N 3.05Å; A123-M125 PolarHBondContact O-N 3.42Å; M125-E129 PolarHBondContact O-N 3.11Å; M125-Q130 HydrophobicContact CE-CB 3.92Å; M125-Q130 HydrophobicContact CE-CG 4.16Å; M125-Q130 PolarHBondContact O-N 3.24Å; M125-Q130 HydrophobicContact SD-CB 3.9Å; M125-I134 HydrophobicContact CB-CD1 3.7Å; M125-I134 HydrophobicContact CG-CD1 3.33Å; M125-I134 HydrophobicContact CG-CG1 4.4Å; M125-I134 HydrophobicContact SD-CD1 3.17Å; M125-I134 WeakPolarHBondContact SD-CD1 3.37Å; M125-I134 HydrophobicContact SD-CG1 3.63Å; M125-F440 HydrophobicContact CB-CZ 4.3Å
126	L	74.3	Confident	79.2	Confident	39 Å²	39	46 Å²	46	20%	0.204	23%	0.231	C	C	.	.	H	α-helix	trans	-76.6	-47.1	176.8	-71.6	170.4	0	0	0	111.2	K122 A123 K128 E129 V131 Y433 K436 V439 F440	K122-L126 WeakPolarHBondContact O-CG 3.31Å; K122-L126 PolarHBondContact O-N 3.47Å; K122-L126 VanDerWaalsContact O-N 3.08Å; A123-L126 PolarHBondContact O-N 3.26Å; A123-L126 VanDerWaalsContact O-N 3.14Å; L126-K128 VanDerWaalsContact C-N 3.28Å; L126-K128 PolarHBondContact O-N 3.22Å; L126-E129 PolarHBondContact O-N 3.49Å; L126-V131 HydrophobicContact CD2-CG2 4.02Å; L126-Y433 HydrophobicContact CD1-CD1 4.39Å; L126-K436 HydrophobicContact CD1-CB 4.16Å; L126-K436 HydrophobicContact CD2-CB 4.29Å; L126-K436 HydrophobicContact CD2-CD 4.46Å; L126-V439 HydrophobicContact CD2-CG2 3.95Å; L126-F440 HydrophobicContact CD1-CE2 4.4Å; L126-F440 HydrophobicContact CD2-CE2 4.4Å; L126-F440 HydrophobicContact CD2-CZ 4.33Å; L126-F440 HydrophobicContact CG-CE2 4.3Å; L126-F440 HydrophobicContact CG-CZ 4.24Å
127	E	72.2	Confident	78.5	Confident	151 Å²	151	46 Å²	46	71%	0.706	23%	0.23	S	C	*	.	H	α-helix	trans	-61.2	-38.3	-178.1	-174	-178.7	-179.2	0	0	111.8	A123	A123-E127 WeakPolarHBondContact O-CB 3.06Å; A123-E127 PolarHBondContact O-N 2.97Å
128	K	68.2	Low	77.7	Confident	80 Å²	80	47.2 Å²	47.2	35%	0.348	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	12	-177.8	-58.5	176.7	177.7	-179.3	0	113.5	F100 D124 L126 Q130	F100-K128 HydrophobicContact CD1-CD 4.03Å; F100-K128 HydrophobicContact CE1-CB 4.36Å; F100-K128 HydrophobicContact CE1-CD 3.48Å; F100-K128 VanDerWaalsContact CE1-CD 3.48Å; D124-K128 VanDerWaalsContact O-CB 3.3Å; D124-K128 WeakPolarHBondContact O-CB 3.3Å; D124-K128 WeakPolarHBondContact O-CG 3.46Å; D124-K128 PolarHBondContact O-N 3.02Å; D124-K128 VanDerWaalsContact O-N 3.12Å; L126-K128 VanDerWaalsContact C-N 3.28Å; L126-K128 PolarHBondContact O-N 3.22Å; K128-Q130 VanDerWaalsContact C-N 3.26Å; K128-Q130 HydrophobicContact CB-CG 3.93Å; K128-Q130 WeakPolarHBondContact O-CG 3.26Å; K128-Q130 PolarHBondContact O-N 3.21Å; K128-Q130 PolarHBondContact O-NE2 2.9Å
129	E	70.9	Confident	77	Confident	172 Å²	172	48.6 Å²	48.6	80%	0.804	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.6	33.7	178.4	-56.8	-173.3	167.8	0	0	114.8	M125 L126 V131	M125-E129 PolarHBondContact O-N 3.11Å; L126-E129 PolarHBondContact O-N 3.49Å; E129-V131 PolarHBondContact O-N 2.84Å
130	Q	72.4	Confident	76.4	Confident	28 Å²	28	48.6 Å²	48.6	13%	0.131	24%	0.243	C	C	.	.			trans	-90.3	7.6	-175.5	-57.5	-61.9	-69.6	0	0	113.8	F100 M125 K128 G132 H133 I134	F100-Q130 HydrophobicContact CE1-CG 3.86Å; F100-Q130 HydrophobicContact CZ-CG 3.98Å; M125-Q130 HydrophobicContact CE-CB 3.92Å; M125-Q130 HydrophobicContact CE-CG 4.16Å; M125-Q130 PolarHBondContact O-N 3.24Å; M125-Q130 HydrophobicContact SD-CB 3.9Å; K128-Q130 VanDerWaalsContact C-N 3.26Å; K128-Q130 HydrophobicContact CB-CG 3.93Å; K128-Q130 WeakPolarHBondContact O-CG 3.26Å; K128-Q130 PolarHBondContact O-N 3.21Å; K128-Q130 PolarHBondContact O-NE2 2.9Å; Q130-G132 VanDerWaalsContact C-N 3.29Å; Q130-G132 PolarHBondContact O-N 2.94Å; Q130-H133 VanDerWaalsContact O-CB 3.32Å; Q130-H133 WeakPolarHBondContact O-CB 3.11Å; Q130-H133 PolarHBondContact O-N 3.47Å; Q130-H133 VanDerWaalsContact O-N 3.14Å; Q130-H133 PolarHBondContact OE1-CE1 2.66Å; Q130-H133 PolarHBondContact OE1-ND1 2.67Å; Q130-I134 WeakPolarHBondContact O-CG1 3.35Å; Q130-I134 PolarHBondContact O-N 2.68Å
131	V	73.6	Confident	76.1	Confident	26 Å²	26	48.2 Å²	48.2	16%	0.158	24%	0.241	C	C	.	.	H	α-helix	trans	-60.7	-38.2	-177.1	-179.3	0	0	0	0	112.1	L126 E129 H133 I134 R135 V439 F440	L126-V131 HydrophobicContact CD2-CG2 4.02Å; E129-V131 PolarHBondContact O-N 2.84Å; V131-H133 VanDerWaalsContact C-N 3.33Å; V131-H133 PolarHBondContact O-N 3.14Å; V131-I134 PolarHBondContact O-N 2.88Å; V131-R135 WeakPolarHBondContact O-CG 3.16Å; V131-R135 PolarHBondContact O-N 2.85Å; V131-V439 HydrophobicContact CG1-CB 4.16Å; V131-V439 HydrophobicContact CG1-CG2 4Å; V131-V439 HydrophobicContact CG2-CG2 4.12Å; V131-F440 HydrophobicContact CG1-CD1 4.48Å; V131-F440 HydrophobicContact CG1-CE1 4.09Å; V131-F440 HydrophobicContact CG2-CE1 3.98Å; V131-F440 HydrophobicContact CG2-CZ 4.02Å
132	G	70.4	Confident	75.8	Confident	51 Å²	51	45.2 Å²	45.2	53%	0.526	23%	0.234	S	C	.	.	H	α-helix	trans	-62.4	-40.4	176.8	0	0	0	0	0	112.7	Q130 R135 A136	Q130-G132 VanDerWaalsContact C-N 3.29Å; Q130-G132 PolarHBondContact O-N 2.94Å; G132-R135 PolarHBondContact O-N 3.29Å; G132-A136 PolarHBondContact O-N 2.6Å
133	H	72.4	Confident	75.2	Confident	38 Å²	38	50.8 Å²	50.8	18%	0.176	26%	0.261	C	S	.	.	H	α-helix	trans	-61.7	-45.1	177.6	-71.5	165.2	0	0	0	112.2	Q130 V131 R135 A136 E137 G232	Q130-H133 VanDerWaalsContact O-CB 3.32Å; Q130-H133 WeakPolarHBondContact O-CB 3.11Å; Q130-H133 PolarHBondContact O-N 3.47Å; Q130-H133 VanDerWaalsContact O-N 3.14Å; Q130-H133 PolarHBondContact OE1-CE1 2.66Å; Q130-H133 PolarHBondContact OE1-ND1 2.67Å; V131-H133 VanDerWaalsContact C-N 3.33Å; V131-H133 PolarHBondContact O-N 3.14Å; H133-R135 VanDerWaalsContact C-N 3.33Å; H133-R135 PolarHBondContact O-N 2.54Å; H133-A136 PolarHBondContact O-N 3.1Å; H133-E137 PolarHBondContact O-N 3.17Å; H133-G232 CarbonylContact C-O 3.59Å; H133-G232 WeakPolarHBondContact CA-O 3.42Å; H133-G232 WeakPolarHBondContact CB-O 3.4Å; H133-G232 PolarHBondContact CD2-O 3.3Å; H133-G232 VanDerWaalsContact CD2-O 3.31Å
134	I	74.6	Confident	74.7	Confident	7 Å²	7	49.5 Å²	49.5	4%	0.036	25%	0.25	C	C	.	.	H	α-helix	trans	-62.9	-40.5	176.6	-59.9	163	0	0	0	111.9	L120 M125 Q130 V131 E137 R138 L162 F440 Y443	L120-I134 HydrophobicContact CD1-CG1 4.36Å; M125-I134 HydrophobicContact CB-CD1 3.7Å; M125-I134 HydrophobicContact CG-CD1 3.33Å; M125-I134 HydrophobicContact CG-CG1 4.4Å; M125-I134 HydrophobicContact SD-CD1 3.17Å; M125-I134 WeakPolarHBondContact SD-CD1 3.37Å; M125-I134 HydrophobicContact SD-CG1 3.63Å; Q130-I134 WeakPolarHBondContact O-CG1 3.35Å; Q130-I134 PolarHBondContact O-N 2.68Å; V131-I134 PolarHBondContact O-N 2.88Å; I134-E137 PolarHBondContact O-N 3.33Å; I134-R138 WeakPolarHBondContact O-CB 3.43Å; I134-R138 PolarHBondContact O-N 2.82Å; I134-L162 HydrophobicContact CD1-CD1 3.69Å; I134-L162 HydrophobicContact CG2-CD1 3.99Å; I134-F440 HydrophobicContact CD1-CE1 4.16Å; I134-Y443 HydrophobicContact CG2-CD2 4.26Å; I134-Y443 HydrophobicContact CG2-CE2 3.56Å
135	R	75.8	Confident	74.4	Confident	125 Å²	125	53.3 Å²	53.3	47%	0.472	27%	0.27	S	S	.	.	H	α-helix	trans	-64.8	-44.3	179.2	-68.6	177.5	94.8	-178.5	8.7	110.2	V131 G132 H133 R138 D139	V131-R135 WeakPolarHBondContact O-CG 3.16Å; V131-R135 PolarHBondContact O-N 2.85Å; G132-R135 PolarHBondContact O-N 3.29Å; H133-R135 VanDerWaalsContact C-N 3.33Å; H133-R135 PolarHBondContact O-N 2.54Å; R135-R138 PolarHBondContact O-N 3Å; R135-D139 WeakPolarHBondContact O-CB 3.5Å; R135-D139 PolarHBondContact O-N 2.85Å
136	A	71.5	Confident	74.7	Confident	19 Å²	19	54.4 Å²	54.4	16%	0.157	28%	0.279	C	S	.	.	H	α-helix	trans	-61.7	-45.1	175.6	0	0	0	0	0	112.3	G132 H133 R138 D139 I140 C234	G132-A136 PolarHBondContact O-N 2.6Å; H133-A136 PolarHBondContact O-N 3.1Å; A136-R138 PolarHBondContact O-N 3.24Å; A136-D139 PolarHBondContact O-N 2.8Å; A136-I140 WeakPolarHBondContact O-CG1 3.33Å; A136-I140 PolarHBondContact O-N 2.86Å; A136-C234 WeakPolarHBondContact CB-O 3.49Å
137	E	78.9	Confident	75.4	Confident	7 Å²	7	57.8 Å²	57.8	3%	0.033	30%	0.296	C	S	.	.	H	α-helix	trans	-57.9	-48.9	176.8	-177.8	177.9	-169.6	0	0	111.3	K118 H133 I134 L141 F231	K118-E137 IonicContact NZ-OE1 3.51Å; K118-E137 PolarHBondContact NZ-OE1 2.9Å; K118-E137 IonicContact NZ-OE2 3.8Å; K118-E137 PolarHBondContact NZ-OE2 2.95Å; H133-E137 PolarHBondContact O-N 3.17Å; I134-E137 PolarHBondContact O-N 3.33Å; E137-L141 HydrophobicContact CG-CD1 3.89Å; E137-L141 WeakPolarHBondContact O-CB 3.47Å; E137-L141 WeakPolarHBondContact O-CG 3.29Å; E137-L141 PolarHBondContact O-N 2.87Å; E137-F231 HydrophobicContact CB-CB 4.26Å; E137-F231 HydrophobicContact CG-CB 4.14Å
138	R	78.9	Confident	76.5	Confident	28 Å²	28	52 Å²	52	11%	0.106	27%	0.268	C	S	.	.	H	α-helix	trans	-61.6	-48.2	177.5	-175.8	-157.6	65.2	-174.9	-4.1	111.4	I134 R135 A136 I140 L141 V142 M152 N442	I134-R138 WeakPolarHBondContact O-CB 3.43Å; I134-R138 PolarHBondContact O-N 2.82Å; R135-R138 PolarHBondContact O-N 3Å; A136-R138 PolarHBondContact O-N 3.24Å; R138-I140 PolarHBondContact O-N 2.87Å; R138-L141 CarbonylContact O-C 3.57Å; R138-L141 PolarHBondContact O-N 3.41Å; R138-V142 HydrophobicContact CG-CG2 4.31Å; R138-V142 VanDerWaalsContact O-CG2 3.29Å; R138-V142 WeakPolarHBondContact O-CG2 3.48Å; R138-V142 PolarHBondContact O-N 3.36Å; R138-M152 HydrophobicContact CG-CE 4.32Å; R138-N442 PolarHBondContact NH1-O 3.11Å
139	D	77.2	Confident	77.7	Confident	57 Å²	57	48.3 Å²	48.3	31%	0.305	25%	0.252	S	S	.	.	H	α-helix	trans	-63.9	-43	-174	-67	-11.2	0	0	0	110.8	R135 A136 L141 V142 E143	R135-D139 WeakPolarHBondContact O-CB 3.5Å; R135-D139 PolarHBondContact O-N 2.85Å; A136-D139 PolarHBondContact O-N 2.8Å; D139-L141 PolarHBondContact O-N 3.09Å; D139-V142 PolarHBondContact O-N 3.08Å; D139-E143 WeakPolarHBondContact O-CB 3.4Å; D139-E143 WeakPolarHBondContact O-CG 3.44Å; D139-E143 PolarHBondContact O-N 3.27Å
140	I	78.1	Confident	78.7	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60	-47.9	172.3	-68.5	166.1	0	0	0	110.6	A136 R138 V142 E143 A144 F208 F231 C234	A136-I140 WeakPolarHBondContact O-CG1 3.33Å; A136-I140 PolarHBondContact O-N 2.86Å; R138-I140 PolarHBondContact O-N 2.87Å; I140-V142 PolarHBondContact O-N 3.02Å; I140-E143 PolarHBondContact O-N 3.03Å; I140-A144 HydrophobicContact CG2-CB 4.43Å; I140-A144 WeakPolarHBondContact O-CA 3.41Å; I140-A144 WeakPolarHBondContact O-CB 3.39Å; I140-A144 PolarHBondContact O-N 3.42Å; I140-F208 HydrophobicContact CD1-CB 4.04Å; I140-F208 HydrophobicContact CD1-CD1 3.54Å; I140-F208 HydrophobicContact CD1-CD2 4.44Å; I140-F208 HydrophobicContact CD1-CE1 4.07Å; I140-F208 HydrophobicContact CD1-CG 3.75Å; I140-F208 HydrophobicContact CG1-CB 4.36Å; I140-F208 HydrophobicContact CG1-CD1 3.4Å; I140-F208 HydrophobicContact CG1-CD2 3.84Å; I140-F208 HydrophobicContact CG1-CE1 3.46Å; I140-F208 VanDerWaalsContact CG1-CE1 3.46Å; I140-F208 HydrophobicContact CG1-CE2 3.9Å; I140-F208 HydrophobicContact CG1-CG 3.59Å; I140-F208 HydrophobicContact CG1-CZ 3.72Å; I140-F231 HydrophobicContact CB-CB 4.42Å; I140-F231 HydrophobicContact CB-CG 4.35Å; I140-F231 HydrophobicContact CD1-CB 3.9Å; I140-F231 HydrophobicContact CD1-CD1 4.23Å; I140-F231 HydrophobicContact CD1-CG 4.28Å; I140-F231 HydrophobicContact CG2-CB 4.43Å; I140-F231 HydrophobicContact CG2-CD1 3.85Å; I140-F231 HydrophobicContact CG2-CD2 4.11Å; I140-F231 HydrophobicContact CG2-CE1 4.14Å; I140-F231 HydrophobicContact CG2-CE2 4.4Å; I140-F231 HydrophobicContact CG2-CG 3.85Å; I140-F231 HydrophobicContact CG2-CZ 4.41Å; I140-C234 HydrophobicContact CD1-CB 3.26Å
141	L	82	Confident	79.5	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.016	22%	0.219	C	C	.	.	H	α-helix	trans	-67.7	-18.9	180	-72.9	174.2	0	0	0	113.5	E137 R138 D139 V149 V150 M152 M166 F231 R447	E137-L141 HydrophobicContact CG-CD1 3.89Å; E137-L141 WeakPolarHBondContact O-CB 3.47Å; E137-L141 WeakPolarHBondContact O-CG 3.29Å; E137-L141 PolarHBondContact O-N 2.87Å; R138-L141 CarbonylContact O-C 3.57Å; R138-L141 PolarHBondContact O-N 3.41Å; D139-L141 PolarHBondContact O-N 3.09Å; L141-V149 HydrophobicContact CD2-CG1 3.95Å; L141-V150 WeakPolarHBondContact CD2-O 3.31Å; L141-M152 HydrophobicContact CB-CB 3.76Å; L141-M152 HydrophobicContact CB-CE 4.06Å; L141-M152 HydrophobicContact CB-CG 4.49Å; L141-M152 HydrophobicContact CB-SD 4.06Å; L141-M152 HydrophobicContact CD1-CB 4.32Å; L141-M152 HydrophobicContact CD1-SD 4.35Å; L141-M152 HydrophobicContact CG-CB 4.44Å; L141-M166 HydrophobicContact CD1-SD 4.34Å; L141-F231 HydrophobicContact CD2-CD2 3.91Å; L141-F231 HydrophobicContact CD2-CE2 3.8Å; L141-F231 HydrophobicContact CG-CD2 4.06Å; L141-F231 HydrophobicContact CG-CE2 4.44Å; L141-R447 PolarHBondContact O-NH2 3.33Å
142	V	77.8	Confident	80.2	Confident	44 Å²	44	40.1 Å²	40.1	27%	0.267	21%	0.212	S	C	.	.	H	α-helix	trans	-82.5	-47.2	172.4	169.2	0	0	0	0	110.5	R138 D139 I140 M152 Y445	R138-V142 HydrophobicContact CG-CG2 4.31Å; R138-V142 VanDerWaalsContact O-CG2 3.29Å; R138-V142 WeakPolarHBondContact O-CG2 3.48Å; R138-V142 PolarHBondContact O-N 3.36Å; D139-V142 PolarHBondContact O-N 3.08Å; I140-V142 PolarHBondContact O-N 3.02Å; V142-M152 HydrophobicContact CB-CE 4.38Å; V142-M152 HydrophobicContact CG2-CE 3.3Å; V142-Y445 HydrophobicContact CB-CE2 4.28Å; V142-Y445 HydrophobicContact CG1-CD2 4.11Å; V142-Y445 HydrophobicContact CG1-CE2 3.53Å; V142-Y445 HydrophobicContact CG2-CD1 3.91Å; V142-Y445 HydrophobicContact CG2-CD2 3.73Å; V142-Y445 HydrophobicContact CG2-CE1 3.96Å; V142-Y445 HydrophobicContact CG2-CE2 3.8Å; V142-Y445 HydrophobicContact CG2-CG 3.77Å
143	E	72.6	Confident	81.1	Confident	124 Å²	124	38.5 Å²	38.5	58%	0.579	19%	0.19	S	C	*	.	H	α-helix	trans	-78.8	-34	-173.8	-69.6	-179.8	-173.3	0	0	112.9	D139 I140 D145	D139-E143 WeakPolarHBondContact O-CB 3.4Å; D139-E143 WeakPolarHBondContact O-CG 3.44Å; D139-E143 PolarHBondContact O-N 3.27Å; I140-E143 PolarHBondContact O-N 3.03Å; E143-D145 PolarHBondContact O-N 3.34Å
144	A	71	Confident	81.8	Confident	5 Å²	5	36.9 Å²	36.9	4%	0.041	18%	0.182	C	C	.	.			trans	-73.7	99.6	177.4	0	0	0	0	0	110.1	I140 S146 V149 L206 R447	I140-A144 HydrophobicContact CG2-CB 4.43Å; I140-A144 WeakPolarHBondContact O-CA 3.41Å; I140-A144 WeakPolarHBondContact O-CB 3.39Å; I140-A144 PolarHBondContact O-N 3.42Å; A144-S146 VanDerWaalsContact C-N 3.27Å; A144-V149 HydrophobicContact CB-CB 4.14Å; A144-V149 HydrophobicContact CB-CG1 4.04Å; A144-V149 HydrophobicContact CB-CG2 4.2Å; A144-L206 HydrophobicContact CB-CD1 4.15Å; A144-R447 PolarHBondContact O-NH2 3.27Å
145	D	72.3	Confident	82.6	Confident	111 Å²	111	36.6 Å²	36.6	59%	0.594	18%	0.181	S	C	*	.			trans	-97.8	57.2	155.2	-159.3	42.8	0	0	0	108.8	E143 K151 R447	E143-D145 PolarHBondContact O-N 3.34Å; D145-K151 IonicContact OD1-NZ 3.46Å; D145-K151 PolarHBondContact OD1-NZ 3.45Å; D145-R447 IonicContact OD1-NH1 3.68Å; D145-R447 PolarHBondContact OD1-NH1 3.09Å; D145-R447 VanDerWaalsContact OD1-NH1 3.13Å
146	S	83.1	Confident	83.2	Confident	28 Å²	28	31 Å²	31	20%	0.196	16%	0.16	C	C	.	.			trans	-101.7	140.9	178.8	177.5	0	0	0	0	110.1	A144 W148 V149 S202	A144-S146 VanDerWaalsContact C-N 3.27Å; S146-W148 PolarHBondContact O-N 2.97Å; S146-W148 PolarHBondContact OG-N 2.78Å; S146-V149 PolarHBondContact O-N 3.45Å; S146-S202 PolarHBondContact OG-OG 3.28Å
147	L	90.6	Very high	84.1	Confident	109 Å²	109	32.6 Å²	32.6	57%	0.571	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-25.6	171.7	-68	173.2	0	0	0	112.1	K227	L147-K227 VanDerWaalsContact O-CE 3.3Å; L147-K227 WeakPolarHBondContact O-CE 3.19Å; L147-K227 WeakPolarHBondContact O-CG 3.35Å; L147-K227 PolarHBondContact O-NZ 3.41Å
148	W	94.1	Very high	84.4	Confident	31 Å²	31	35.1 Å²	35.1	12%	0.117	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-3.7	-172.6	-56.7	109.3	0	0	0	114.8	S146 E195 L198 A199 K227 L228 I390 R391	S146-W148 PolarHBondContact O-N 2.97Å; S146-W148 PolarHBondContact OG-N 2.78Å; W148-E195 HydrophobicContact CH2-CB 4.31Å; W148-E195 HydrophobicContact CH2-CG 4.17Å; W148-E195 HydrophobicContact CZ3-CB 3.76Å; W148-E195 HydrophobicContact CZ3-CG 3.97Å; W148-L198 HydrophobicContact CD2-CB 4.23Å; W148-L198 HydrophobicContact CH2-CB 4.09Å; W148-L198 HydrophobicContact CH2-CD1 3.81Å; W148-L198 HydrophobicContact CZ2-CB 3.64Å; W148-L198 HydrophobicContact CZ2-CD1 3.5Å; W148-L198 VanDerWaalsContact CZ2-CD1 3.5Å; W148-L198 HydrophobicContact CZ2-CG 4.22Å; W148-A199 HydrophobicContact CB-CB 3.66Å; W148-A199 HydrophobicContact CD2-CB 4.19Å; W148-A199 HydrophobicContact CE3-CB 4.02Å; W148-A199 HydrophobicContact CG-CB 4.07Å; W148-K227 CarbonylContact O-C 3.5Å; W148-K227 WeakPolarHBondContact O-CA 3.42Å; W148-L228 PolarHBondContact O-N 3.37Å; W148-I390 HydrophobicContact CH2-CG2 4.22Å; W148-R391 HydrophobicContact CH2-CB 4.11Å; W148-R391 HydrophobicContact CH2-CG 4.25Å; W148-R391 HydrophobicContact CZ2-CB 4.48Å
149	V	92.6	Very high	84.8	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.012	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-117	143.1	-179.1	175	0	0	0	0	109	L141 A144 S146 K151 I203 K227 F231	L141-V149 HydrophobicContact CD2-CG1 3.95Å; A144-V149 HydrophobicContact CB-CB 4.14Å; A144-V149 HydrophobicContact CB-CG1 4.04Å; A144-V149 HydrophobicContact CB-CG2 4.2Å; S146-V149 PolarHBondContact O-N 3.45Å; V149-K151 PolarHBondContact O-N 3.02Å; V149-I203 HydrophobicContact CG2-CG2 3.67Å; V149-K227 PolarHBondContact O-NZ 3.02Å; V149-K227 VanDerWaalsContact O-NZ 3.15Å; V149-F231 HydrophobicContact CB-CZ 4.21Å; V149-F231 HydrophobicContact CG1-CE2 3.46Å; V149-F231 VanDerWaalsContact CG1-CE2 3.46Å; V149-F231 HydrophobicContact CG1-CZ 3.47Å; V149-F231 VanDerWaalsContact CG1-CZ 3.47Å; V149-F231 HydrophobicContact CG2-CZ 3.89Å
150	V	92.1	Very high	85.2	Confident	6 Å²	6	44.1 Å²	44.1	4%	0.036	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-57.8	128.4	171.7	172.5	0	0	0	0	109.8	L141 M152 M166 E167 L169 L219 K227 L228	L141-V150 WeakPolarHBondContact CD2-O 3.31Å; V150-M152 PolarHBondContact O-N 3.02Å; V150-M166 HydrophobicContact CG1-CB 3.82Å; V150-M166 HydrophobicContact CG1-CG 4.26Å; V150-M166 HydrophobicContact CG1-SD 4.14Å; V150-E167 HydrophobicContact CG1-CG 4.04Å; V150-L169 HydrophobicContact CG2-CD1 3.78Å; V150-L219 HydrophobicContact CG2-CD1 3.89Å; V150-K227 HydrophobicContact CG2-CB 4.25Å; V150-L228 WeakPolarHBondContact CG2-O 3.43Å; V150-L228 PolarHBondContact N-O 2.86Å
151	K	89.6	Confident	85.7	Confident	47 Å²	47	44.6 Å²	44.6	20%	0.204	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-77.5	121.9	179.8	-166.3	160.4	-173.7	132.7	0	111.1	D145 V149 F153 M166 E167 R447	D145-K151 IonicContact OD1-NZ 3.46Å; D145-K151 PolarHBondContact OD1-NZ 3.45Å; V149-K151 PolarHBondContact O-N 3.02Å; K151-F153 HydrophobicContact CD-CE1 4.32Å; K151-F153 HydrophobicContact CD-CZ 4.31Å; K151-F153 HydrophobicContact CG-CE1 4.4Å; K151-F153 HydrophobicContact CG-CZ 4.31Å; K151-M166 CarbonylContact O-C 3.54Å; K151-M166 VanDerWaalsContact O-CA 3.29Å; K151-M166 WeakPolarHBondContact O-CA 3.2Å; K151-E167 HydrophobicContact CB-CB 4.48Å; K151-E167 HydrophobicContact CB-CG 4.08Å; K151-E167 VanDerWaalsContact CB-OE1 3.27Å; K151-E167 WeakPolarHBondContact CB-OE1 3.32Å; K151-E167 PolarHBondContact N-OE1 2.92Å; K151-E167 PolarHBondContact O-N 3.26Å; K151-R447 VanDerWaalsContact CE-CD 3.5Å
152	M	89.3	Confident	86	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	127.3	170.5	-176	-170.4	63.8	0	0	111.2	R138 L141 V142 V150 L164 M166 Y445 R447	R138-M152 HydrophobicContact CG-CE 4.32Å; L141-M152 HydrophobicContact CB-CB 3.76Å; L141-M152 HydrophobicContact CB-CE 4.06Å; L141-M152 HydrophobicContact CB-CG 4.49Å; L141-M152 HydrophobicContact CB-SD 4.06Å; L141-M152 HydrophobicContact CD1-CB 4.32Å; L141-M152 HydrophobicContact CD1-SD 4.35Å; L141-M152 HydrophobicContact CG-CB 4.44Å; V142-M152 HydrophobicContact CB-CE 4.38Å; V142-M152 HydrophobicContact CG2-CE 3.3Å; V150-M152 PolarHBondContact O-N 3.02Å; M152-L164 HydrophobicContact SD-CD2 3.57Å; M152-L164 VanDerWaalsContact SD-CD2 3.57Å; M152-M166 HydrophobicContact CB-CG 4.33Å; M152-M166 HydrophobicContact CG-CG 4.39Å; M152-Y445 HydrophobicContact CE-CD1 3.44Å; M152-Y445 VanDerWaalsContact CE-CD1 3.44Å; M152-Y445 HydrophobicContact CE-CE1 3.77Å; M152-Y445 HydrophobicContact CE-CG 4.2Å; M152-R447 WeakPolarHBondContact O-CD 3.49Å; M152-R447 PolarHBondContact O-NE 2.58Å
153	F	88.1	Confident	86.7	Confident	17 Å²	17	42.4 Å²	42.4	8%	0.075	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-45.8	178.8	-66.4	-75.8	0	0	0	113	Y115 K151 I165 E167 R447	Y115-F153 AromaticContact CD1-CD2 3.68Å; Y115-F153 HydrophobicContact CD1-CD2 3.68Å; Y115-F153 HydrophobicContact CD1-CE2 4.06Å; Y115-F153 HydrophobicContact CD1-CG 4.48Å; Y115-F153 HydrophobicContact CE1-CB 4.44Å; Y115-F153 AromaticContact CE1-CD2 3.53Å; Y115-F153 HydrophobicContact CE1-CD2 3.53Å; Y115-F153 AromaticContact CE1-CE2 3.85Å; Y115-F153 HydrophobicContact CE1-CE2 3.85Å; Y115-F153 AromaticContact CE1-CG 3.99Å; Y115-F153 HydrophobicContact CE1-CG 3.99Å; K151-F153 HydrophobicContact CD-CE1 4.32Å; K151-F153 HydrophobicContact CD-CZ 4.31Å; K151-F153 HydrophobicContact CG-CE1 4.4Å; K151-F153 HydrophobicContact CG-CZ 4.31Å; F153-I165 PolarHBondContact N-O 3.19Å; F153-E167 HydrophobicContact CE2-CB 3.88Å; F153-R447 WeakPolarHBondContact O-CB 3.42Å; F153-R447 PolarHBondContact O-N 3.17Å
154	Y	88.8	Confident	87.6	Confident	4 Å²	4	36.6 Å²	36.6	2%	0.016	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	153.1	-175.3	-38.2	-67.5	0	0	0	110.4	L79 L84 F89 Y115 I165 Y445 K446 G450	L79-Y154 HydrophobicContact CD2-CE1 4.3Å; L84-Y154 HydrophobicContact CD1-CD1 3.69Å; L84-Y154 HydrophobicContact CD1-CD2 4.32Å; L84-Y154 HydrophobicContact CD1-CE1 4.15Å; L84-Y154 HydrophobicContact CD1-CG 3.81Å; F89-Y154 HydrophobicContact CZ-CD2 4.09Å; F89-Y154 HydrophobicContact CZ-CE2 4.39Å; Y115-Y154 HydrophobicContact CE1-CE2 4.41Å; Y154-I165 HydrophobicContact CD2-CB 3.72Å; Y154-I165 HydrophobicContact CD2-CG1 4.05Å; Y154-I165 HydrophobicContact CD2-CG2 3.68Å; Y154-I165 HydrophobicContact CE2-CG2 4.24Å; Y154-I165 HydrophobicContact CG-CB 4.34Å; Y154-I165 PolarHBondContact N-O 3.31Å; Y154-I165 PolarHBondContact O-N 3.48Å; Y154-Y445 WeakPolarHBondContact CA-O 3.37Å; Y154-K446 HydrophobicContact CD1-CB 4.27Å; Y154-K446 HydrophobicContact CD1-CG 4.32Å; Y154-G450 PolarHBondContact OH-O 2.69Å
155	S	89.9	Confident	88.6	Confident	2 Å²	2	36.3 Å²	36.3	1%	0.014	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	144.6	160.7	60.4	0	0	0	0	109.3	Y163 Y443 T444 Y445	S155-Y163 CarbonylContact C-O 3.57Å; S155-Y163 WeakPolarHBondContact CA-O 3.47Å; S155-Y163 WeakPolarHBondContact CB-O 3.17Å; S155-Y443 PolarHBondContact OG-O 2.77Å; S155-T444 VanDerWaalsContact O-CA 3.23Å; S155-T444 WeakPolarHBondContact O-CA 3.24Å; S155-T444 WeakPolarHBondContact O-CG2 3.45Å; S155-Y445 PolarHBondContact N-O 2.72Å; S155-Y445 PolarHBondContact O-N 3.05Å; S155-Y445 VanDerWaalsContact OG-CB 3.27Å; S155-Y445 WeakPolarHBondContact OG-CB 3.47Å; S155-Y445 PolarHBondContact OG-N 3.1Å
156	F	89.6	Confident	89.6	Confident	6 Å²	6	32 Å²	32	3%	0.026	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	172.8	177.8	60	-90.4	0	0	0	110	L86 F89 Y163 I165 Y443	L86-F156 HydrophobicContact CB-CE2 4.44Å; F89-F156 HydrophobicContact CD2-CE1 4.36Å; F89-F156 HydrophobicContact CD2-CZ 4.22Å; F89-F156 AromaticContact CE2-CE1 3.79Å; F89-F156 HydrophobicContact CE2-CE1 3.79Å; F89-F156 HydrophobicContact CE2-CZ 4.1Å; F156-Y163 AromaticContact CD2-CD2 3.5Å; F156-Y163 HydrophobicContact CD2-CD2 3.5Å; F156-Y163 VanDerWaalsContact CD2-CD2 3.5Å; F156-Y163 HydrophobicContact CD2-CE2 4.29Å; F156-Y163 AromaticContact CD2-CG 3.87Å; F156-Y163 HydrophobicContact CD2-CG 3.87Å; F156-Y163 HydrophobicContact CE2-CD1 4.07Å; F156-Y163 AromaticContact CE2-CD2 3.35Å; F156-Y163 HydrophobicContact CE2-CD2 3.35Å; F156-Y163 AromaticContact CE2-CE2 4Å; F156-Y163 HydrophobicContact CE2-CE2 4Å; F156-Y163 AromaticContact CE2-CG 3.39Å; F156-Y163 HydrophobicContact CE2-CG 3.39Å; F156-Y163 HydrophobicContact CG-CD2 4.45Å; F156-Y163 HydrophobicContact CZ-CD1 4.26Å; F156-Y163 HydrophobicContact CZ-CD2 4.22Å; F156-Y163 AromaticContact CZ-CG 3.79Å; F156-Y163 HydrophobicContact CZ-CG 3.79Å; F156-Y163 PolarHBondContact N-O 3.46Å; F156-Y163 WeakPolarHBondContact O-CB 3.16Å; F156-Y163 PolarHBondContact O-N 3.22Å; F156-I165 HydrophobicContact CD1-CG1 4.44Å; F156-I165 HydrophobicContact CE1-CD1 3.93Å; F156-I165 HydrophobicContact CE1-CG1 3.74Å; F156-I165 HydrophobicContact CZ-CD1 4.41Å; F156-Y443 WeakPolarHBondContact O-CD1 3.47Å; F156-Y443 WeakPolarHBondContact O-CE1 3.09Å
157	Q	88.9	Confident	90.1	Very high	54 Å²	54	32.9 Å²	32.9	25%	0.252	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	154.8	-177.1	64.2	-176.1	-62.4	0	0	110.3	K122 N161 L162 F440 Y443	K122-Q157 VanDerWaalsContact CE-OE1 3.28Å; Q157-N161 WeakPolarHBondContact CA-O 3.48Å; Q157-L162 HydrophobicContact CB-CD2 3.65Å; Q157-F440 PolarHBondContact NE2-O 2.95Å; Q157-Y443 HydrophobicContact CB-CD1 4.18Å
158	D	87	Confident	90.3	Very high	60 Å²	60	28.8 Å²	28.8	32%	0.321	13%	0.134	S	C	.	.			trans	-120.2	-158.2	165.7	67.1	28.8	0	0	0	110.3	K122 L160 N161 Y163	K122-D158 VanDerWaalsContact CE-O 3.3Å; K122-D158 WeakPolarHBondContact CE-O 3.34Å; K122-D158 PolarHBondContact NZ-O 3.16Å; D158-L160 VanDerWaalsContact C-N 3.33Å; D158-L160 WeakPolarHBondContact OD1-CA 3.38Å; D158-L160 PolarHBondContact OD1-N 2.92Å; D158-N161 PolarHBondContact N-O 3.18Å; D158-N161 PolarHBondContact OD1-N 3.36Å; D158-Y163 HydrophobicContact CB-CE2 4.23Å; D158-Y163 VanDerWaalsContact OD2-CE2 3.29Å; D158-Y163 WeakPolarHBondContact OD2-CE2 3.33Å; D158-Y163 VanDerWaalsContact OD2-CZ 3.3Å; D158-Y163 PolarHBondContact OD2-OH 3.27Å
159	K	85.6	Confident	90.4	Very high	185 Å²	185	27.7 Å²	27.7	80%	0.804	13%	0.131	S	C	*	.	S	Bend	trans	-69.4	-29.1	179.6	-66.9	-177.8	-179.2	176.2	0	113.5
160	L	86.1	Confident	90.5	Very high	89 Å²	89	28.1 Å²	28.1	47%	0.466	13%	0.134	S	C	.	.	S	Bend	trans	-108.8	-35.1	-170.8	-61.8	179.6	0	0	0	112.3	K122 D158	K122-L160 WeakPolarHBondContact CB-O 3.23Å; K122-L160 PolarHBondContact N-O 3.31Å; D158-L160 VanDerWaalsContact C-N 3.33Å; D158-L160 WeakPolarHBondContact OD1-CA 3.38Å; D158-L160 PolarHBondContact OD1-N 2.92Å
161	N	88.6	Confident	90.7	Very high	9 Å²	9	28.2 Å²	28.2	5%	0.048	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	155.5	-163.8	-62.5	-40.9	0	0	0	112.9	I119 L120 Q157 D158 Y163	I119-N161 HydrophobicContact CG2-CB 3.98Å; L120-N161 CarbonylContact O-C 3.24Å; L120-N161 VanDerWaalsContact O-CA 3.28Å; L120-N161 WeakPolarHBondContact O-CA 3.45Å; Q157-N161 WeakPolarHBondContact CA-O 3.48Å; D158-N161 PolarHBondContact N-O 3.18Å; D158-N161 PolarHBondContact OD1-N 3.36Å; N161-Y163 HydrophobicContact CB-CD2 4.47Å; N161-Y163 HydrophobicContact CB-CE1 4.18Å; N161-Y163 HydrophobicContact CB-CE2 3.69Å; N161-Y163 WeakPolarHBondContact CB-OH 3.23Å; N161-Y163 PolarHBondContact ND2-OH 3.34Å
162	L	89.6	Confident	90.9	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	142.8	164.6	-55.2	177.2	0	0	0	108.9	I119 L120 K122 I134 Q157 F440 Y443	I119-L162 WeakPolarHBondContact CA-O 3.45Å; L120-L162 HydrophobicContact CB-CB 4.29Å; L120-L162 PolarHBondContact N-O 3.36Å; L120-L162 PolarHBondContact O-N 3.43Å; K122-L162 HydrophobicContact CD-CD2 4.43Å; K122-L162 VanDerWaalsContact CE-CD2 3.5Å; K122-L162 HydrophobicContact CG-CD2 4.08Å; K122-L162 HydrophobicContact CG-CG 3.99Å; I134-L162 HydrophobicContact CD1-CD1 3.69Å; I134-L162 HydrophobicContact CG2-CD1 3.99Å; Q157-L162 HydrophobicContact CB-CD2 3.65Å; L162-F440 HydrophobicContact CD1-CD1 3.73Å; L162-F440 HydrophobicContact CD1-CE1 3.67Å; L162-F440 HydrophobicContact CD1-CZ 4.42Å; L162-F440 HydrophobicContact CD2-CB 4.23Å; L162-F440 HydrophobicContact CD2-CD1 4.01Å; L162-F440 HydrophobicContact CD2-CG 4.03Å; L162-F440 HydrophobicContact CG-CD1 4.45Å; L162-Y443 HydrophobicContact CB-CE1 3.78Å; L162-Y443 HydrophobicContact CB-CE2 4.31Å; L162-Y443 HydrophobicContact CD1-CD2 4.45Å; L162-Y443 HydrophobicContact CD1-CE2 4.1Å; L162-Y443 HydrophobicContact CD2-CD1 3.99Å; L162-Y443 HydrophobicContact CD2-CD2 4.38Å; L162-Y443 HydrophobicContact CD2-CE1 4.12Å; L162-Y443 HydrophobicContact CD2-CG 4.11Å; L162-Y443 HydrophobicContact CG-CE1 4.45Å
163	Y	91.4	Very high	91.2	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.008	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	129.5	-175.3	-56.9	-89.4	0	0	0	110.7	L86 M117 K118 I119 S155 F156 D158 N161 L419 Y443	L86-Y163 HydrophobicContact CD1-CD1 4.4Å; L86-Y163 HydrophobicContact CD1-CE1 3.89Å; M117-Y163 HydrophobicContact CG-CD1 4.33Å; M117-Y163 HydrophobicContact SD-CD1 3.95Å; K118-Y163 WeakPolarHBondContact O-CA 3.27Å; I119-Y163 HydrophobicContact CG1-CD1 4.02Å; I119-Y163 HydrophobicContact CG1-CE1 4.11Å; I119-Y163 HydrophobicContact CG2-CD1 4.24Å; I119-Y163 HydrophobicContact CG2-CE1 3.85Å; S155-Y163 CarbonylContact C-O 3.57Å; S155-Y163 WeakPolarHBondContact CA-O 3.47Å; S155-Y163 WeakPolarHBondContact CB-O 3.17Å; F156-Y163 AromaticContact CD2-CD2 3.5Å; F156-Y163 HydrophobicContact CD2-CD2 3.5Å; F156-Y163 VanDerWaalsContact CD2-CD2 3.5Å; F156-Y163 HydrophobicContact CD2-CE2 4.29Å; F156-Y163 AromaticContact CD2-CG 3.87Å; F156-Y163 HydrophobicContact CD2-CG 3.87Å; F156-Y163 HydrophobicContact CE2-CD1 4.07Å; F156-Y163 AromaticContact CE2-CD2 3.35Å; F156-Y163 HydrophobicContact CE2-CD2 3.35Å; F156-Y163 AromaticContact CE2-CE2 4Å; F156-Y163 HydrophobicContact CE2-CE2 4Å; F156-Y163 AromaticContact CE2-CG 3.39Å; F156-Y163 HydrophobicContact CE2-CG 3.39Å; F156-Y163 HydrophobicContact CG-CD2 4.45Å; F156-Y163 HydrophobicContact CZ-CD1 4.26Å; F156-Y163 HydrophobicContact CZ-CD2 4.22Å; F156-Y163 AromaticContact CZ-CG 3.79Å; F156-Y163 HydrophobicContact CZ-CG 3.79Å; F156-Y163 PolarHBondContact N-O 3.46Å; F156-Y163 WeakPolarHBondContact O-CB 3.16Å; F156-Y163 PolarHBondContact O-N 3.22Å; D158-Y163 HydrophobicContact CB-CE2 4.23Å; D158-Y163 VanDerWaalsContact OD2-CE2 3.29Å; D158-Y163 WeakPolarHBondContact OD2-CE2 3.33Å; D158-Y163 VanDerWaalsContact OD2-CZ 3.3Å; D158-Y163 PolarHBondContact OD2-OH 3.27Å; N161-Y163 HydrophobicContact CB-CD2 4.47Å; N161-Y163 HydrophobicContact CB-CE1 4.18Å; N161-Y163 HydrophobicContact CB-CE2 3.69Å; N161-Y163 WeakPolarHBondContact CB-OH 3.23Å; N161-Y163 PolarHBondContact ND2-OH 3.34Å; Y163-L419 HydrophobicContact CE1-CD2 4.26Å; Y163-Y443 WeakPolarHBondContact O-CE1 3.46Å
164	L	91.6	Very high	91.5	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	123.1	171	-61.6	153.7	0	0	0	108.2	M117 K118 L120 M152 Y443	M117-L164 CarbonylContact C-O 3.57Å; M117-L164 VanDerWaalsContact CA-O 3.31Å; M117-L164 WeakPolarHBondContact CA-O 3.48Å; K118-L164 HydrophobicContact CB-CB 4.24Å; K118-L164 HydrophobicContact CB-CD1 4.4Å; K118-L164 HydrophobicContact CD-CD1 4.1Å; K118-L164 HydrophobicContact CG-CD1 4.42Å; K118-L164 PolarHBondContact N-O 2.77Å; K118-L164 PolarHBondContact O-N 3.22Å; L120-L164 HydrophobicContact CD1-CD1 4.27Å; M152-L164 HydrophobicContact SD-CD2 3.57Å; M152-L164 VanDerWaalsContact SD-CD2 3.57Å; L164-Y443 WeakPolarHBondContact CD2-OH 3.16Å; L164-Y443 VanDerWaalsContact CG-OH 3.23Å; L164-Y443 WeakPolarHBondContact CG-OH 3.39Å
165	I	92.9	Very high	91.7	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	117.1	175.7	-51.6	-61.5	0	0	0	108.6	F89 Y115 M117 F153 Y154 F156	F89-I165 HydrophobicContact CE1-CD1 4.19Å; F89-I165 HydrophobicContact CE1-CG1 4.34Å; F89-I165 HydrophobicContact CE1-CG2 4.16Å; F89-I165 HydrophobicContact CE2-CD1 4.32Å; F89-I165 HydrophobicContact CE2-CG1 4.38Å; F89-I165 HydrophobicContact CZ-CD1 4.09Å; F89-I165 HydrophobicContact CZ-CG1 3.94Å; F89-I165 HydrophobicContact CZ-CG2 4.4Å; Y115-I165 HydrophobicContact CD1-CG2 3.68Å; Y115-I165 HydrophobicContact CD2-CG2 4.23Å; Y115-I165 HydrophobicContact CE1-CG2 4.41Å; Y115-I165 HydrophobicContact CG-CG2 3.57Å; M117-I165 HydrophobicContact CB-CD1 3.79Å; M117-I165 HydrophobicContact CG-CD1 3.59Å; M117-I165 HydrophobicContact SD-CD1 3.82Å; F153-I165 PolarHBondContact N-O 3.19Å; Y154-I165 HydrophobicContact CD2-CB 3.72Å; Y154-I165 HydrophobicContact CD2-CG1 4.05Å; Y154-I165 HydrophobicContact CD2-CG2 3.68Å; Y154-I165 HydrophobicContact CE2-CG2 4.24Å; Y154-I165 HydrophobicContact CG-CB 4.34Å; Y154-I165 PolarHBondContact N-O 3.31Å; Y154-I165 PolarHBondContact O-N 3.48Å; F156-I165 HydrophobicContact CD1-CG1 4.44Å; F156-I165 HydrophobicContact CE1-CD1 3.93Å; F156-I165 HydrophobicContact CE1-CG1 3.74Å; F156-I165 HydrophobicContact CZ-CD1 4.41Å
166	M	92.8	Very high	91.8	Very high	21 Å²	21	27 Å²	27	10%	0.103	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	162.3	-172.3	-60.6	174.7	-64.1	0	0	110.7	Y115 A116 K118 L141 V150 K151 M152 F168	Y115-M166 WeakPolarHBondContact CA-O 3.3Å; Y115-M166 WeakPolarHBondContact CB-O 3.48Å; A116-M166 PolarHBondContact N-O 2.81Å; A116-M166 PolarHBondContact O-N 2.73Å; K118-M166 HydrophobicContact CB-CE 3.73Å; K118-M166 HydrophobicContact CD-CE 4.4Å; L141-M166 HydrophobicContact CD1-SD 4.34Å; V150-M166 HydrophobicContact CG1-CB 3.82Å; V150-M166 HydrophobicContact CG1-CG 4.26Å; V150-M166 HydrophobicContact CG1-SD 4.14Å; K151-M166 CarbonylContact O-C 3.54Å; K151-M166 VanDerWaalsContact O-CA 3.29Å; K151-M166 WeakPolarHBondContact O-CA 3.2Å; M152-M166 HydrophobicContact CB-CG 4.33Å; M152-M166 HydrophobicContact CG-CG 4.39Å; M166-F168 PolarHBondContact O-N 3.18Å
167	E	92.8	Very high	92	Very high	45 Å²	45	27.8 Å²	27.8	21%	0.21	14%	0.137	C	C	.	.			trans	-57.8	138.7	167.9	65.4	-177.7	143.2	0	0	110.6	V150 K151 F153 L169 K227	V150-E167 HydrophobicContact CG1-CG 4.04Å; K151-E167 HydrophobicContact CB-CB 4.48Å; K151-E167 HydrophobicContact CB-CG 4.08Å; K151-E167 VanDerWaalsContact CB-OE1 3.27Å; K151-E167 WeakPolarHBondContact CB-OE1 3.32Å; K151-E167 PolarHBondContact N-OE1 2.92Å; K151-E167 PolarHBondContact O-N 3.26Å; F153-E167 HydrophobicContact CE2-CB 3.88Å; E167-L169 HydrophobicContact CG-CD2 3.93Å; E167-L169 HydrophobicContact CG-CG 4.32Å; E167-K227 IonicContact OE1-NZ 2.97Å; E167-K227 PolarHBondContact OE1-NZ 2.97Å; E167-K227 IonicContact OE2-NZ 3.57Å
168	F	95.1	Very high	92.2	Very high	23 Å²	23	25.7 Å²	25.7	10%	0.101	13%	0.127	C	C	.	.			trans	-83.9	125.4	172.5	173.5	-123.2	0	0	0	109.4	I95 L105 V114 M166 P170 I404 D406 T407 F410	I95-F168 HydrophobicContact CD1-CD2 3.94Å; I95-F168 HydrophobicContact CD1-CE2 3.83Å; L105-F168 HydrophobicContact CD1-CB 4.01Å; L105-F168 HydrophobicContact CD1-CD1 3.55Å; L105-F168 HydrophobicContact CD1-CD2 3.48Å; L105-F168 VanDerWaalsContact CD1-CD2 3.48Å; L105-F168 HydrophobicContact CD1-CE1 3.78Å; L105-F168 HydrophobicContact CD1-CE2 3.74Å; L105-F168 HydrophobicContact CD1-CG 3.38Å; L105-F168 HydrophobicContact CD1-CZ 3.87Å; V114-F168 HydrophobicContact CG1-CB 4.39Å; V114-F168 HydrophobicContact CG1-CD1 4.18Å; V114-F168 HydrophobicContact CG1-CG 4.5Å; M166-F168 PolarHBondContact O-N 3.18Å; F168-P170 HydrophobicContact CD1-CB 4.33Å; F168-P170 HydrophobicContact CE1-CB 3.69Å; F168-P170 HydrophobicContact CZ-CB 4.03Å; F168-P170 WeakPolarHBondContact O-CD 3.39Å; F168-I404 WeakPolarHBondContact CD1-O 3.12Å; F168-D406 WeakPolarHBondContact CZ-O 3.46Å; F168-T407 HydrophobicContact CZ-CG2 4.21Å; F168-F410 HydrophobicContact CD2-CZ 4.46Å; F168-F410 HydrophobicContact CE2-CD2 4.41Å; F168-F410 AromaticContact CE2-CE2 3.48Å; F168-F410 HydrophobicContact CE2-CE2 3.48Å; F168-F410 VanDerWaalsContact CE2-CE2 3.48Å; F168-F410 AromaticContact CE2-CZ 3.56Å; F168-F410 HydrophobicContact CE2-CZ 3.56Å; F168-F410 HydrophobicContact CZ-CD2 4.45Å; F168-F410 AromaticContact CZ-CE2 3.66Å; F168-F410 HydrophobicContact CZ-CE2 3.66Å; F168-F410 HydrophobicContact CZ-CZ 4.21Å
169	L	95.9	Very high	92.4	Very high	9 Å²	9	24.6 Å²	24.6	5%	0.047	12%	0.12	C	C	.	.			trans	-107.1	99.2	179.1	-62.6	-173.6	0	0	0	109.6	V150 E167 G171 G172 L219 L220 D221 K227 F410	V150-L169 HydrophobicContact CG2-CD1 3.78Å; E167-L169 HydrophobicContact CG-CD2 3.93Å; E167-L169 HydrophobicContact CG-CG 4.32Å; L169-G171 PolarHBondContact O-N 2.86Å; L169-G172 PolarHBondContact O-N 3.07Å; L169-L219 HydrophobicContact CB-CB 4.44Å; L169-L219 HydrophobicContact CD1-CB 3.56Å; L169-L219 HydrophobicContact CD1-CD1 4Å; L169-L219 HydrophobicContact CD1-CG 4.44Å; L169-L220 WeakPolarHBondContact CB-O 3.02Å; L169-D221 HydrophobicContact CD2-CB 3.95Å; L169-K227 HydrophobicContact CD1-CB 3.79Å; L169-K227 HydrophobicContact CD1-CD 3.71Å; L169-K227 HydrophobicContact CD1-CG 4.36Å; L169-K227 HydrophobicContact CD2-CD 3.91Å; L169-K227 HydrophobicContact CG-CD 4.48Å; L169-F410 VanDerWaalsContact O-CZ 3.29Å; L169-F410 WeakPolarHBondContact O-CZ 3.27Å
170	P	95.7	Very high	92.6	Very high	11 Å²	11	21.4 Å²	21.4	7%	0.071	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-3.8	-167.7	33.2	-39.4	0	0	0	114.1	F168 G172 I401 N409	F168-P170 HydrophobicContact CD1-CB 4.33Å; F168-P170 HydrophobicContact CE1-CB 3.69Å; F168-P170 HydrophobicContact CZ-CB 4.03Å; F168-P170 WeakPolarHBondContact O-CD 3.39Å; P170-G172 PolarHBondContact O-N 2.94Å; P170-I401 HydrophobicContact CB-CD1 4.24Å; P170-I401 HydrophobicContact CB-CG2 4.08Å; P170-I401 HydrophobicContact CG-CD1 3.73Å; P170-N409 WeakPolarHBondContact O-CB 3.42Å; P170-N409 PolarHBondContact O-ND2 2.88Å
171	G	95.7	Very high	93	Very high	7 Å²	7	21.1 Å²	21.1	7%	0.072	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-9.2	173.9	0	0	0	0	0	113.7	L169 L220	L169-G171 PolarHBondContact O-N 2.86Å; G171-L220 WeakPolarHBondContact CA-O 3.15Å; G171-L220 PolarHBondContact N-O 3.48Å
172	G	94.7	Very high	93.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.122	C	C	.	.			trans	74.7	-154.2	-176.8	0	0	0	0	0	111.9	L169 P170 L219 L220	L169-G172 PolarHBondContact O-N 3.07Å; P170-G172 PolarHBondContact O-N 2.94Å; G172-L219 CarbonylContact O-C 3.49Å; G172-L219 WeakPolarHBondContact O-CA 3.27Å; G172-L220 PolarHBondContact O-N 3.23Å
173	D	93.8	Very high	93.5	Very high	27 Å²	27	27.9 Å²	27.9	14%	0.144	14%	0.14	C	C	.	.	B	Isolated β-bridge	trans	-112.7	157.6	-179.5	65	87	0	0	0	112.5	M175 T176 L177 L218 L219	D173-M175 VanDerWaalsContact C-N 3.25Å; D173-M175 PolarHBondContact O-N 3.35Å; D173-M175 WeakPolarHBondContact OD1-CA 3.43Å; D173-M175 WeakPolarHBondContact OD1-CB 3.06Å; D173-M175 PolarHBondContact OD1-N 3.39Å; D173-M175 VanDerWaalsContact OD1-N 3.07Å; D173-T176 PolarHBondContact O-N 3.35Å; D173-T176 PolarHBondContact OD1-N 2.91Å; D173-T176 PolarHBondContact OD1-OG1 2.94Å; D173-T176 PolarHBondContact OD2-OG1 3.02Å; D173-L177 PolarHBondContact O-N 3.06Å; D173-L177 VanDerWaalsContact O-N 3.1Å; D173-L218 CarbonylContact C-O 3.44Å; D173-L218 WeakPolarHBondContact CA-O 3.42Å; D173-L219 HydrophobicContact CB-CD2 3.65Å
174	M	96.1	Very high	93.8	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-63.9	-29.7	-179.1	-177.1	60.9	67.7	0	0	112.2	L177 L178 L184 Y192 P215 L218 L220 M315	M174-L177 HydrophobicContact CE-CD2 4.14Å; M174-L177 PolarHBondContact O-N 3.37Å; M174-L177 HydrophobicContact SD-CB 4.36Å; M174-L177 HydrophobicContact SD-CD2 3.72Å; M174-L177 HydrophobicContact SD-CG 4.36Å; M174-L178 HydrophobicContact CG-CD1 4.2Å; M174-L178 HydrophobicContact CG-CG 4.39Å; M174-L178 WeakPolarHBondContact O-CB 3.29Å; M174-L178 VanDerWaalsContact O-CG 3.3Å; M174-L178 WeakPolarHBondContact O-CG 3.42Å; M174-L178 PolarHBondContact O-N 3.37Å; M174-L178 HydrophobicContact SD-CG 4.36Å; M174-L184 HydrophobicContact SD-CD1 4.29Å; M174-Y192 HydrophobicContact CE-CD1 3.53Å; M174-Y192 HydrophobicContact CE-CD2 3.78Å; M174-Y192 HydrophobicContact CE-CE1 3.89Å; M174-Y192 HydrophobicContact CE-CE2 4.12Å; M174-Y192 HydrophobicContact CE-CG 3.47Å; M174-Y192 VanDerWaalsContact CE-CG 3.47Å; M174-P215 HydrophobicContact CB-CB 4.09Å; M174-P215 VanDerWaalsContact CB-O 3.3Å; M174-P215 WeakPolarHBondContact CB-O 3.34Å; M174-P215 HydrophobicContact CG-CB 4.1Å; M174-P215 PolarHBondContact N-O 2.96Å; M174-L218 HydrophobicContact CB-CB 3.86Å; M174-L218 PolarHBondContact N-O 2.99Å; M174-L220 HydrophobicContact CE-CD2 4.24Å; M174-M315 HydrophobicContact CE-CE 3.82Å; M174-M315 HydrophobicContact CG-CE 3.77Å; M174-M315 HydrophobicContact SD-CE 3.64Å
175	M	91.4	Very high	94.1	Very high	11 Å²	11	31.7 Å²	31.7	5%	0.054	16%	0.164	C	C	.	.	H	α-helix	trans	-62.3	-47	173.6	159.5	173.5	158.8	0	0	110.8	D173 L177 L178 M179 P215 D216 R275 R276 A279	D173-M175 VanDerWaalsContact C-N 3.25Å; D173-M175 PolarHBondContact O-N 3.35Å; D173-M175 WeakPolarHBondContact OD1-CA 3.43Å; D173-M175 WeakPolarHBondContact OD1-CB 3.06Å; D173-M175 PolarHBondContact OD1-N 3.39Å; D173-M175 VanDerWaalsContact OD1-N 3.07Å; M175-L177 VanDerWaalsContact C-N 3.31Å; M175-L177 PolarHBondContact O-N 3.1Å; M175-L178 PolarHBondContact O-N 3.21Å; M175-M179 HydrophobicContact CE-SD 4.24Å; M175-M179 WeakPolarHBondContact O-CG 3.45Å; M175-M179 PolarHBondContact O-N 3.49Å; M175-P215 HydrophobicContact CB-CB 3.91Å; M175-P215 PolarHBondContact N-O 3.47Å; M175-D216 HydrophobicContact CB-CB 4.23Å; M175-D216 HydrophobicContact SD-CB 4.22Å; M175-R275 HydrophobicContact CE-CB 4.21Å; M175-R275 HydrophobicContact CE-CG 3.49Å; M175-R275 VanDerWaalsContact CE-CG 3.49Å; M175-R275 HydrophobicContact CG-CG 4.15Å; M175-R275 HydrophobicContact SD-CG 3.66Å; M175-R276 HydrophobicContact CE-CG 4.24Å; M175-A279 HydrophobicContact CE-CB 3.93Å; M175-A279 HydrophobicContact SD-CB 4.06Å
176	T	91.9	Very high	94.4	Very high	8 Å²	8	34.7 Å²	34.7	5%	0.049	18%	0.177	C	C	.	.	H	α-helix	trans	-62.9	-39.1	177.6	-61.2	0	0	0	0	111.5	D173 M179 K180 N409	D173-T176 PolarHBondContact O-N 3.35Å; D173-T176 PolarHBondContact OD1-N 2.91Å; D173-T176 PolarHBondContact OD1-OG1 2.94Å; D173-T176 PolarHBondContact OD2-OG1 3.02Å; T176-M179 HydrophobicContact CG2-CE 4.47Å; T176-M179 PolarHBondContact O-N 2.79Å; T176-K180 WeakPolarHBondContact O-CG 3.37Å; T176-K180 PolarHBondContact O-N 3.36Å; T176-K180 VanDerWaalsContact O-N 3.11Å; T176-N409 WeakPolarHBondContact CG2-O 3.48Å
177	L	94.5	Very high	94.7	Very high	22 Å²	22	41.1 Å²	41.1	12%	0.115	21%	0.207	C	C	.	.	H	α-helix	trans	-60.9	-47	173.1	177.8	59.3	0	0	0	112	D173 M174 M175 M179 K180 K181 Y192 L220 I397	D173-L177 PolarHBondContact O-N 3.06Å; D173-L177 VanDerWaalsContact O-N 3.1Å; M174-L177 HydrophobicContact CE-CD2 4.14Å; M174-L177 PolarHBondContact O-N 3.37Å; M174-L177 HydrophobicContact SD-CB 4.36Å; M174-L177 HydrophobicContact SD-CD2 3.72Å; M174-L177 HydrophobicContact SD-CG 4.36Å; M175-L177 VanDerWaalsContact C-N 3.31Å; M175-L177 PolarHBondContact O-N 3.1Å; L177-M179 VanDerWaalsContact C-N 3.34Å; L177-M179 PolarHBondContact O-N 2.73Å; L177-K180 PolarHBondContact O-N 2.69Å; L177-K180 VanDerWaalsContact O-N 3.1Å; L177-K181 HydrophobicContact CD1-CD 3.9Å; L177-K181 HydrophobicContact CD1-CG 4.12Å; L177-K181 PolarHBondContact O-N 3.41Å; L177-Y192 HydrophobicContact CD2-CE2 4.2Å; L177-L220 HydrophobicContact CD2-CD1 3.79Å; L177-I397 HydrophobicContact CD1-CD1 4.16Å; L177-I397 HydrophobicContact CD2-CD1 4.03Å
178	L	93.8	Very high	94.9	Very high	9 Å²	9	40.2 Å²	40.2	5%	0.047	20%	0.203	C	C	.	.	H	α-helix	trans	-65.7	-34.5	177.5	-71.4	173.1	0	0	0	112.7	M174 M175 K180 D182 L184 P215 E314 M315	M174-L178 HydrophobicContact CG-CD1 4.2Å; M174-L178 HydrophobicContact CG-CG 4.39Å; M174-L178 WeakPolarHBondContact O-CB 3.29Å; M174-L178 VanDerWaalsContact O-CG 3.3Å; M174-L178 WeakPolarHBondContact O-CG 3.42Å; M174-L178 PolarHBondContact O-N 3.37Å; M174-L178 HydrophobicContact SD-CG 4.36Å; M175-L178 PolarHBondContact O-N 3.21Å; L178-K180 VanDerWaalsContact C-N 3.28Å; L178-K180 PolarHBondContact O-N 3.18Å; L178-D182 WeakPolarHBondContact O-CA 3.4Å; L178-D182 PolarHBondContact O-N 3.37Å; L178-L184 HydrophobicContact CD2-CD1 4.19Å; L178-L184 HydrophobicContact CD2-CD2 4.38Å; L178-L184 HydrophobicContact CD2-CG 3.82Å; L178-P215 HydrophobicContact CD1-CB 4.2Å; L178-P215 HydrophobicContact CD1-CG 4.23Å; L178-E314 HydrophobicContact CD1-CG 4.24Å; L178-M315 HydrophobicContact CD1-CG 4.37Å; L178-M315 HydrophobicContact CD2-CB 4.48Å; L178-M315 HydrophobicContact CD2-CG 4.12Å
179	M	89.8	Confident	95.1	Very high	37 Å²	37	39.1 Å²	39.1	18%	0.182	20%	0.198	C	C	.	.	H	α-helix	trans	-63.4	-34.7	171.7	-72.9	-161.6	-55.1	0	0	112.3	M175 T176 L177 R276	M175-M179 HydrophobicContact CE-SD 4.24Å; M175-M179 WeakPolarHBondContact O-CG 3.45Å; M175-M179 PolarHBondContact O-N 3.49Å; T176-M179 HydrophobicContact CG2-CE 4.47Å; T176-M179 PolarHBondContact O-N 2.79Å; L177-M179 VanDerWaalsContact C-N 3.34Å; L177-M179 PolarHBondContact O-N 2.73Å; M179-R276 HydrophobicContact CE-CG 4.3Å; M179-R276 HydrophobicContact SD-CG 3.89Å
180	K	90.9	Very high	95.3	Very high	119 Å²	119	40.9 Å²	40.9	52%	0.517	21%	0.206	S	C	.	.	H	α-helix	trans	-78.4	-37.6	179.4	-72.6	177.5	179	-177.2	0	112.8	T176 L177 L178 S408 N409	T176-K180 WeakPolarHBondContact O-CG 3.37Å; T176-K180 PolarHBondContact O-N 3.36Å; T176-K180 VanDerWaalsContact O-N 3.11Å; L177-K180 PolarHBondContact O-N 2.69Å; L177-K180 VanDerWaalsContact O-N 3.1Å; L178-K180 VanDerWaalsContact C-N 3.28Å; L178-K180 PolarHBondContact O-N 3.18Å; K180-S408 PolarHBondContact NZ-O 3.28Å; K180-N409 PolarHBondContact NZ-OD1 3.42Å
181	K	93.6	Very high	95.4	Very high	83 Å²	83	41.5 Å²	41.5	36%	0.361	21%	0.208	S	C	.	.	H	α-helix	trans	-98.9	-9.9	-173.4	-70.8	-162.8	62.6	147.9	0	115.3	L177 T183 L184 E188 I397	L177-K181 HydrophobicContact CD1-CD 3.9Å; L177-K181 HydrophobicContact CD1-CG 4.12Å; L177-K181 PolarHBondContact O-N 3.41Å; K181-T183 PolarHBondContact O-N 2.66Å; K181-L184 HydrophobicContact CB-CD2 4.26Å; K181-L184 HydrophobicContact CD-CD2 3.95Å; K181-E188 IonicContact NZ-OE1 3.79Å; K181-E188 PolarHBondContact NZ-OE1 3.06Å; K181-E188 IonicContact NZ-OE2 3.75Å; K181-I397 HydrophobicContact CD-CD1 3.74Å
182	D	92.1	Very high	95.5	Very high	88 Å²	88	41.2 Å²	41.2	47%	0.471	20%	0.204	S	C	.	.	S	Bend	trans	67	-53.2	-172.2	-62.5	-38.6	0	0	0	115.5	L178 K272	L178-D182 WeakPolarHBondContact O-CA 3.4Å; L178-D182 PolarHBondContact O-N 3.37Å; D182-K272 PolarHBondContact O-NZ 3.37Å; D182-K272 VanDerWaalsContact OD1-CE 3.31Å; D182-K272 WeakPolarHBondContact OD1-CE 3.36Å; D182-K272 IonicContact OD1-NZ 2.68Å; D182-K272 PolarHBondContact OD1-NZ 3.29Å
183	T	96.8	Very high	95.7	Very high	62 Å²	62	41.2 Å²	41.2	38%	0.38	20%	0.204	S	C	.	.	S	Bend	trans	-144.4	160.6	176.2	52.8	0	0	0	0	109	K181 M315	K181-T183 PolarHBondContact O-N 2.66Å; T183-M315 CarbonylContact C-O 3.54Å; T183-M315 VanDerWaalsContact CA-O 3.31Å; T183-M315 WeakPolarHBondContact CA-O 3.39Å; T183-M315 WeakPolarHBondContact CB-O 3.43Å
184	L	98.4	Very high	96	Very high	8 Å²	8	39.9 Å²	39.9	4%	0.042	20%	0.198	C	C	.	.			trans	-104.4	153.6	170.5	-58.8	-174.2	0	0	0	110.1	M174 L178 K181 E188 Y192 M315 I397	M174-L184 HydrophobicContact SD-CD1 4.29Å; L178-L184 HydrophobicContact CD2-CD1 4.19Å; L178-L184 HydrophobicContact CD2-CD2 4.38Å; L178-L184 HydrophobicContact CD2-CG 3.82Å; K181-L184 HydrophobicContact CB-CD2 4.26Å; K181-L184 HydrophobicContact CD-CD2 3.95Å; L184-E188 HydrophobicContact CB-CB 4.05Å; L184-Y192 HydrophobicContact CD1-CD2 3.73Å; L184-Y192 HydrophobicContact CD1-CE2 4.09Å; L184-M315 HydrophobicContact CB-CB 4.39Å; L184-M315 HydrophobicContact CD1-CB 4.31Å; L184-M315 HydrophobicContact CD1-CE 4.31Å; L184-M315 HydrophobicContact CD1-CG 3.97Å; L184-M315 HydrophobicContact CD1-SD 4.15Å; L184-M315 HydrophobicContact CG-CB 4.45Å; L184-M315 PolarHBondContact N-O 2.96Å; L184-I397 HydrophobicContact CD2-CD1 4.04Å
185	T	98.5	Very high	96.1	Very high	76 Å²	76	39.9 Å²	39.9	47%	0.466	20%	0.198	S	C	.	.			trans	-67.4	163.3	168	60.6	0	0	0	0	110.5	E187 E188 T189	T185-E187 PolarHBondContact O-N 3.41Å; T185-E188 PolarHBondContact N-OE2 3.11Å; T185-E188 PolarHBondContact O-N 3.26Å; T185-E188 WeakPolarHBondContact OG1-CB 3.38Å; T185-E188 VanDerWaalsContact OG1-CD 3.28Å; T185-E188 VanDerWaalsContact OG1-CG 3.24Å; T185-E188 WeakPolarHBondContact OG1-CG 3.37Å; T185-E188 PolarHBondContact OG1-N 2.95Å; T185-E188 PolarHBondContact OG1-OE2 3.08Å; T185-T189 VanDerWaalsContact O-CB 3.29Å; T185-T189 WeakPolarHBondContact O-CB 3.17Å; T185-T189 PolarHBondContact O-N 2.65Å; T185-T189 PolarHBondContact O-OG1 2.88Å
186	E	98.5	Very high	96.4	Very high	62 Å²	62	39.4 Å²	39.4	29%	0.29	20%	0.195	S	C	.	.	H	α-helix	trans	-62.8	-32	175.3	-72.7	-168.9	-157.8	0	0	112.7	Q190 L316 S350 F381	E186-Q190 VanDerWaalsContact O-CB 3.24Å; E186-Q190 WeakPolarHBondContact O-CB 3.37Å; E186-Q190 PolarHBondContact O-N 2.94Å; E186-L316 HydrophobicContact CB-CD2 4.5Å; E186-L316 HydrophobicContact CG-CD2 3.75Å; E186-S350 VanDerWaalsContact CD-OG 3.26Å; E186-S350 VanDerWaalsContact OE1-CB 3.23Å; E186-S350 WeakPolarHBondContact OE1-CB 3.31Å; E186-S350 PolarHBondContact OE1-N 3.02Å; E186-S350 PolarHBondContact OE1-OG 2.9Å; E186-S350 WeakPolarHBondContact OE2-CB 3.42Å; E186-S350 PolarHBondContact OE2-OG 2.84Å; E186-F381 HydrophobicContact CB-CE2 4.44Å
187	E	98.2	Very high	96.8	Very high	157 Å²	157	39 Å²	39	73%	0.734	19%	0.193	S	C	*	.	H	α-helix	trans	-67.9	-48.7	176	-175.7	-180	170.8	0	0	111.7	T185 T189 Q190 F191	T185-E187 PolarHBondContact O-N 3.41Å; E187-T189 VanDerWaalsContact C-N 3.3Å; E187-T189 PolarHBondContact O-N 2.95Å; E187-Q190 PolarHBondContact O-N 3.44Å; E187-F191 PolarHBondContact O-N 2.83Å; E187-F191 VanDerWaalsContact O-N 3.09Å
188	E	98.6	Very high	96.9	Very high	26 Å²	26	39 Å²	39	12%	0.121	19%	0.193	C	C	.	.	H	α-helix	trans	-60.7	-41.9	174.3	-70.1	164.2	143.3	0	0	111.1	K181 L184 T185 F191 Y192 A396 I397	K181-E188 IonicContact NZ-OE1 3.79Å; K181-E188 PolarHBondContact NZ-OE1 3.06Å; K181-E188 IonicContact NZ-OE2 3.75Å; L184-E188 HydrophobicContact CB-CB 4.05Å; T185-E188 PolarHBondContact N-OE2 3.11Å; T185-E188 PolarHBondContact O-N 3.26Å; T185-E188 WeakPolarHBondContact OG1-CB 3.38Å; T185-E188 VanDerWaalsContact OG1-CD 3.28Å; T185-E188 VanDerWaalsContact OG1-CG 3.24Å; T185-E188 WeakPolarHBondContact OG1-CG 3.37Å; T185-E188 PolarHBondContact OG1-N 2.95Å; T185-E188 PolarHBondContact OG1-OE2 3.08Å; E188-F191 PolarHBondContact O-N 2.84Å; E188-Y192 WeakPolarHBondContact O-CD2 3.41Å; E188-Y192 PolarHBondContact O-N 3.1Å; E188-Y192 VanDerWaalsContact O-N 3.08Å; E188-A396 HydrophobicContact CB-CB 4.36Å; E188-A396 HydrophobicContact CG-CB 4.15Å; E188-I397 HydrophobicContact CG-CD1 4.27Å; E188-I397 HydrophobicContact CG-CG1 4.05Å; E188-I397 WeakPolarHBondContact OE1-CD1 3.47Å; E188-I397 WeakPolarHBondContact OE1-CG1 3.2Å
189	T	98.8	Very high	97.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63.9	-44.3	176.4	-58.8	0	0	0	0	111.2	T185 E187 F191 Y192 I193 M312 M315 L316 F381	T185-T189 VanDerWaalsContact O-CB 3.29Å; T185-T189 WeakPolarHBondContact O-CB 3.17Å; T185-T189 PolarHBondContact O-N 2.65Å; T185-T189 PolarHBondContact O-OG1 2.88Å; E187-T189 VanDerWaalsContact C-N 3.3Å; E187-T189 PolarHBondContact O-N 2.95Å; T189-F191 VanDerWaalsContact C-N 3.29Å; T189-F191 PolarHBondContact O-N 3.12Å; T189-Y192 PolarHBondContact O-N 3.24Å; T189-I193 HydrophobicContact CG2-CG1 3.77Å; T189-I193 VanDerWaalsContact O-CB 3.26Å; T189-I193 WeakPolarHBondContact O-CB 3.4Å; T189-I193 WeakPolarHBondContact O-CG1 3.07Å; T189-I193 PolarHBondContact O-N 3.46Å; T189-M312 HydrophobicContact CG2-CG 3.96Å; T189-M315 HydrophobicContact CG2-CB 4.1Å; T189-M315 HydrophobicContact CG2-SD 3.99Å; T189-L316 HydrophobicContact CG2-CD1 4.3Å; T189-L316 HydrophobicContact CG2-CD2 4.11Å; T189-L316 HydrophobicContact CG2-CG 4.04Å; T189-L316 WeakPolarHBondContact OG1-CD2 2.97Å; T189-F381 HydrophobicContact CG2-CZ 4.27Å
190	Q	98.8	Very high	97.4	Very high	45 Å²	45	36.9 Å²	36.9	21%	0.21	18%	0.182	C	C	.	.	H	α-helix	trans	-56	-46.1	177.4	-173.2	-165	66.8	0	0	110.8	E186 E187 A194 F381 F382 E383 V385	E186-Q190 VanDerWaalsContact O-CB 3.24Å; E186-Q190 WeakPolarHBondContact O-CB 3.37Å; E186-Q190 PolarHBondContact O-N 2.94Å; E187-Q190 PolarHBondContact O-N 3.44Å; Q190-A194 WeakPolarHBondContact O-CB 3.49Å; Q190-A194 PolarHBondContact O-N 3.38Å; Q190-F381 HydrophobicContact CB-CE1 3.93Å; Q190-F381 HydrophobicContact CB-CZ 4.03Å; Q190-F381 HydrophobicContact CG-CE1 4.19Å; Q190-F381 PolarHBondContact NE2-O 2.8Å; Q190-F382 HydrophobicContact CG-CD1 4.04Å; Q190-E383 PolarHBondContact NE2-O 3.21Å; Q190-V385 VanDerWaalsContact CD-CG2 3.49Å; Q190-V385 HydrophobicContact CG-CG2 3.67Å
191	F	98.8	Very high	97.6	Very high	25 Å²	25	31.9 Å²	31.9	11%	0.11	16%	0.161	C	C	.	.	H	α-helix	trans	-60.5	-55.6	177	177.4	-93.1	0	0	0	112.2	E187 E188 T189 I193 A194 E195 H225 I390 A395 A396	E187-F191 PolarHBondContact O-N 2.83Å; E187-F191 VanDerWaalsContact O-N 3.09Å; E188-F191 PolarHBondContact O-N 2.84Å; T189-F191 VanDerWaalsContact C-N 3.29Å; T189-F191 PolarHBondContact O-N 3.12Å; F191-I193 PolarHBondContact O-N 2.74Å; F191-A194 PolarHBondContact O-N 2.77Å; F191-E195 HydrophobicContact CE1-CG 4.19Å; F191-E195 HydrophobicContact CE2-CG 4.38Å; F191-E195 VanDerWaalsContact CZ-CD 3.49Å; F191-E195 HydrophobicContact CZ-CG 4.03Å; F191-E195 PolarHBondContact O-N 2.78Å; F191-H225 AromaticContact CZ-CE1 3.87Å; F191-H225 AromaticContact CZ-ND1 3.61Å; F191-I390 HydrophobicContact CD2-CD1 4.03Å; F191-I390 HydrophobicContact CD2-CG1 3.99Å; F191-I390 HydrophobicContact CE2-CD1 4.17Å; F191-I390 HydrophobicContact CE2-CG1 3.7Å; F191-A395 HydrophobicContact CE1-CB 3.75Å; F191-A395 VanDerWaalsContact CZ-CA 3.43Å; F191-A395 HydrophobicContact CZ-CB 3.62Å; F191-A396 HydrophobicContact CB-CB 3.69Å; F191-A396 HydrophobicContact CD1-CB 3.71Å; F191-A396 HydrophobicContact CD2-CB 4.45Å; F191-A396 HydrophobicContact CG-CB 3.68Å
192	Y	98.8	Very high	97.6	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-68.1	-36.2	-175.5	-70.1	-56.6	0	0	0	113.2	M174 L177 L184 E188 T189 T196 L220 V226 I397	M174-Y192 HydrophobicContact CE-CD1 3.53Å; M174-Y192 HydrophobicContact CE-CD2 3.78Å; M174-Y192 HydrophobicContact CE-CE1 3.89Å; M174-Y192 HydrophobicContact CE-CE2 4.12Å; M174-Y192 HydrophobicContact CE-CG 3.47Å; M174-Y192 VanDerWaalsContact CE-CG 3.47Å; L177-Y192 HydrophobicContact CD2-CE2 4.2Å; L184-Y192 HydrophobicContact CD1-CD2 3.73Å; L184-Y192 HydrophobicContact CD1-CE2 4.09Å; E188-Y192 WeakPolarHBondContact O-CD2 3.41Å; E188-Y192 PolarHBondContact O-N 3.1Å; E188-Y192 VanDerWaalsContact O-N 3.08Å; T189-Y192 PolarHBondContact O-N 3.24Å; Y192-T196 VanDerWaalsContact O-CB 3.31Å; Y192-T196 WeakPolarHBondContact O-CB 3.32Å; Y192-T196 PolarHBondContact O-N 2.92Å; Y192-T196 PolarHBondContact O-OG1 3.45Å; Y192-L220 HydrophobicContact CD1-CD2 4.39Å; Y192-L220 HydrophobicContact CE1-CD2 3.82Å; Y192-V226 HydrophobicContact CD1-CG2 3.73Å; Y192-V226 HydrophobicContact CE1-CG2 4.42Å; Y192-I397 HydrophobicContact CE2-CD1 3.92Å; Y192-I397 HydrophobicContact CE2-CG1 4.17Å; Y192-I397 VanDerWaalsContact OH-CB 3.3Å; Y192-I397 WeakPolarHBondContact OH-CB 3.49Å
193	I	98.8	Very high	97.5	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-67.9	-42.7	175.3	-64	-61.3	0	0	0	109.8	T189 F191 T196 V197 L308 I311 M312 M315 F360 F382	T189-I193 HydrophobicContact CG2-CG1 3.77Å; T189-I193 VanDerWaalsContact O-CB 3.26Å; T189-I193 WeakPolarHBondContact O-CB 3.4Å; T189-I193 WeakPolarHBondContact O-CG1 3.07Å; T189-I193 PolarHBondContact O-N 3.46Å; F191-I193 PolarHBondContact O-N 2.74Å; I193-T196 PolarHBondContact O-N 2.82Å; I193-V197 HydrophobicContact CG2-CG2 4.47Å; I193-V197 WeakPolarHBondContact O-CG2 3.35Å; I193-V197 PolarHBondContact O-N 3.39Å; I193-L308 HydrophobicContact CD1-CD1 3.6Å; I193-L308 HydrophobicContact CD1-CG 4.26Å; I193-L308 HydrophobicContact CG2-CD1 4.39Å; I193-L308 HydrophobicContact CG2-CD2 4.21Å; I193-L308 HydrophobicContact CG2-CG 4.28Å; I193-I311 HydrophobicContact CD1-CG2 4.33Å; I193-M312 HydrophobicContact CD1-CB 3.73Å; I193-M312 HydrophobicContact CD1-CG 4.33Å; I193-M312 HydrophobicContact CG1-CB 4.06Å; I193-M312 HydrophobicContact CG1-CG 4.1Å; I193-M315 HydrophobicContact CD1-CE 4.47Å; I193-M315 HydrophobicContact CD1-SD 3.83Å; I193-M315 HydrophobicContact CG1-SD 4.08Å; I193-F360 HydrophobicContact CG2-CE2 4.48Å; I193-F382 HydrophobicContact CB-CE1 4.31Å; I193-F382 HydrophobicContact CG2-CE1 3.88Å; I193-F382 HydrophobicContact CG2-CZ 3.7Å
194	A	98.8	Very high	97.2	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-60.5	-47.9	176.7	0	0	0	0	0	112.3	Q190 F191 T196 V197 L198 F382 V385 W387 I390	Q190-A194 WeakPolarHBondContact O-CB 3.49Å; Q190-A194 PolarHBondContact O-N 3.38Å; F191-A194 PolarHBondContact O-N 2.77Å; A194-T196 VanDerWaalsContact C-N 3.29Å; A194-T196 PolarHBondContact O-N 2.77Å; A194-V197 WeakPolarHBondContact O-CB 3.45Å; A194-V197 PolarHBondContact O-N 3.25Å; A194-L198 PolarHBondContact O-N 3.07Å; A194-L198 VanDerWaalsContact O-N 3.16Å; A194-F382 HydrophobicContact CB-CD1 4.15Å; A194-F382 HydrophobicContact CB-CE1 4.13Å; A194-V385 HydrophobicContact CB-CG1 3.91Å; A194-V385 HydrophobicContact CB-CG2 4.49Å; A194-W387 HydrophobicContact CB-CE3 4.47Å; A194-W387 HydrophobicContact CB-CH2 3.66Å; A194-W387 HydrophobicContact CB-CZ2 4.29Å; A194-W387 HydrophobicContact CB-CZ3 3.77Å; A194-W387 VanDerWaalsContact O-CZ3 3.27Å; A194-W387 WeakPolarHBondContact O-CZ3 3.49Å; A194-I390 HydrophobicContact CB-CD1 3.75Å
195	E	98.6	Very high	96.8	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59.7	-40.8	174.6	-73.6	-148.3	137.8	0	0	112.4	W148 F191 V197 L198 A199 H225 V226 I390	W148-E195 HydrophobicContact CH2-CB 4.31Å; W148-E195 HydrophobicContact CH2-CG 4.17Å; W148-E195 HydrophobicContact CZ3-CB 3.76Å; W148-E195 HydrophobicContact CZ3-CG 3.97Å; F191-E195 HydrophobicContact CE1-CG 4.19Å; F191-E195 HydrophobicContact CE2-CG 4.38Å; F191-E195 VanDerWaalsContact CZ-CD 3.49Å; F191-E195 HydrophobicContact CZ-CG 4.03Å; F191-E195 PolarHBondContact O-N 2.78Å; E195-V197 VanDerWaalsContact C-N 3.32Å; E195-V197 PolarHBondContact O-N 3.22Å; E195-L198 PolarHBondContact O-N 2.85Å; E195-A199 WeakPolarHBondContact O-CB 3.31Å; E195-A199 PolarHBondContact O-N 2.88Å; E195-H225 IonicContact OE1-CE1 3.23Å; E195-H225 IonicContact OE1-CG 2.88Å; E195-H225 IonicContact OE1-ND1 3.86Å; E195-H225 PolarHBondContact OE1-ND1 2.89Å; E195-H225 VanDerWaalsContact OE2-CA 3.31Å; E195-H225 WeakPolarHBondContact OE2-CA 3.3Å; E195-H225 IonicContact OE2-ND1 2.83Å; E195-V226 HydrophobicContact CB-CB 4.1Å; E195-V226 HydrophobicContact CB-CG2 4.05Å; E195-V226 PolarHBondContact OE2-N 2.89Å; E195-I390 HydrophobicContact CG-CD1 3.77Å; E195-I390 HydrophobicContact CG-CG1 4.07Å; E195-I390 HydrophobicContact CG-CG2 4.49Å
196	T	98.6	Very high	96.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-68.4	-32.4	178.5	-51.9	0	0	0	0	111.9	Y192 I193 A194 A199 I200 L218 L308	Y192-T196 VanDerWaalsContact O-CB 3.31Å; Y192-T196 WeakPolarHBondContact O-CB 3.32Å; Y192-T196 PolarHBondContact O-N 2.92Å; Y192-T196 PolarHBondContact O-OG1 3.45Å; I193-T196 PolarHBondContact O-N 2.82Å; A194-T196 VanDerWaalsContact C-N 3.29Å; A194-T196 PolarHBondContact O-N 2.77Å; T196-A199 PolarHBondContact O-N 3.4Å; T196-I200 HydrophobicContact CG2-CD1 3.85Å; T196-I200 HydrophobicContact CG2-CG1 4.22Å; T196-I200 WeakPolarHBondContact O-CB 3.3Å; T196-I200 WeakPolarHBondContact O-CG1 3.46Å; T196-I200 PolarHBondContact O-N 2.75Å; T196-L218 HydrophobicContact CG2-CD1 4.18Å; T196-L218 HydrophobicContact CG2-CD2 3.92Å; T196-L308 HydrophobicContact CG2-CD1 3.56Å
197	V	98.7	Very high	95.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-59.2	-49.3	170.8	168.7	0	0	0	0	110.8	I193 A194 E195 A199 I200 D201 W305 L308 V373 I376 F382 W387	I193-V197 HydrophobicContact CG2-CG2 4.47Å; I193-V197 WeakPolarHBondContact O-CG2 3.35Å; I193-V197 PolarHBondContact O-N 3.39Å; A194-V197 WeakPolarHBondContact O-CB 3.45Å; A194-V197 PolarHBondContact O-N 3.25Å; E195-V197 VanDerWaalsContact C-N 3.32Å; E195-V197 PolarHBondContact O-N 3.22Å; V197-A199 VanDerWaalsContact C-N 3.29Å; V197-A199 PolarHBondContact O-N 3.36Å; V197-I200 PolarHBondContact O-N 2.91Å; V197-D201 WeakPolarHBondContact O-CB 3.17Å; V197-D201 PolarHBondContact O-N 2.73Å; V197-W305 HydrophobicContact CB-CZ3 4.45Å; V197-W305 HydrophobicContact CG1-CH2 4.32Å; V197-W305 HydrophobicContact CG1-CZ3 4.43Å; V197-W305 HydrophobicContact CG2-CZ3 4.33Å; V197-L308 HydrophobicContact CG2-CD2 3.55Å; V197-V373 HydrophobicContact CG1-CG2 3.53Å; V197-I376 HydrophobicContact CG1-CB 4.44Å; V197-I376 HydrophobicContact CG1-CG2 4.08Å; V197-I376 HydrophobicContact CG2-CG2 3.71Å; V197-F382 HydrophobicContact CG2-CZ 4.44Å; V197-W387 HydrophobicContact CB-CH2 4.12Å; V197-W387 HydrophobicContact CB-CZ3 3.94Å; V197-W387 HydrophobicContact CG1-CH2 4.12Å; V197-W387 HydrophobicContact CG1-CZ3 3.93Å; V197-W387 HydrophobicContact CG2-CH2 4.47Å
198	L	98.1	Very high	94.8	Very high	23 Å²	23	22.2 Å²	22.2	12%	0.12	12%	0.119	C	C	.	.	H	α-helix	trans	-62.5	-39.4	177.1	-66.3	177.7	0	0	0	111.7	W148 A194 E195 S202 W387 I390	W148-L198 HydrophobicContact CD2-CB 4.23Å; W148-L198 HydrophobicContact CH2-CB 4.09Å; W148-L198 HydrophobicContact CH2-CD1 3.81Å; W148-L198 HydrophobicContact CZ2-CB 3.64Å; W148-L198 HydrophobicContact CZ2-CD1 3.5Å; W148-L198 VanDerWaalsContact CZ2-CD1 3.5Å; W148-L198 HydrophobicContact CZ2-CG 4.22Å; A194-L198 PolarHBondContact O-N 3.07Å; A194-L198 VanDerWaalsContact O-N 3.16Å; E195-L198 PolarHBondContact O-N 2.85Å; L198-S202 WeakPolarHBondContact O-CB 3.29Å; L198-S202 PolarHBondContact O-N 2.79Å; L198-W387 HydrophobicContact CD1-CE3 4.09Å; L198-W387 HydrophobicContact CD2-CE3 3.77Å; L198-W387 HydrophobicContact CD2-CZ3 4.28Å; L198-W387 HydrophobicContact CG-CE3 3.78Å; L198-W387 HydrophobicContact CG-CZ3 4.04Å; L198-I390 HydrophobicContact CD1-CG2 3.65Å
199	A	96.8	Very high	94.3	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-64.3	-49.7	179.4	0	0	0	0	0	112.8	W148 E195 T196 V197 S202 I203 L228	W148-A199 HydrophobicContact CB-CB 3.66Å; W148-A199 HydrophobicContact CD2-CB 4.19Å; W148-A199 HydrophobicContact CE3-CB 4.02Å; W148-A199 HydrophobicContact CG-CB 4.07Å; E195-A199 WeakPolarHBondContact O-CB 3.31Å; E195-A199 PolarHBondContact O-N 2.88Å; T196-A199 PolarHBondContact O-N 3.4Å; V197-A199 VanDerWaalsContact C-N 3.29Å; V197-A199 PolarHBondContact O-N 3.36Å; A199-S202 PolarHBondContact O-N 3.28Å; A199-S202 PolarHBondContact O-OG 3.34Å; A199-I203 PolarHBondContact O-N 2.97Å; A199-L228 HydrophobicContact CB-CD1 3.76Å; A199-L228 HydrophobicContact CB-CD2 4.36Å; A199-L228 HydrophobicContact CB-CG 3.78Å
200	I	96	Very high	93.8	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-64	-43.7	178.1	-68.3	170.5	0	0	0	110.5	T196 V197 S202 I203 H204 I213 L228 D304 W305 L308	T196-I200 HydrophobicContact CG2-CD1 3.85Å; T196-I200 HydrophobicContact CG2-CG1 4.22Å; T196-I200 WeakPolarHBondContact O-CB 3.3Å; T196-I200 WeakPolarHBondContact O-CG1 3.46Å; T196-I200 PolarHBondContact O-N 2.75Å; V197-I200 PolarHBondContact O-N 2.91Å; I200-S202 VanDerWaalsContact C-N 3.29Å; I200-S202 PolarHBondContact O-N 2.78Å; I200-I203 WeakPolarHBondContact O-CG1 3.37Å; I200-I203 PolarHBondContact O-N 2.99Å; I200-H204 WeakPolarHBondContact CG2-CE1 3.46Å; I200-H204 WeakPolarHBondContact CG2-NE2 3.28Å; I200-H204 PolarHBondContact O-CD2 2.71Å; I200-H204 PolarHBondContact O-N 3.45Å; I200-I213 HydrophobicContact CD1-CD1 4.08Å; I200-I213 HydrophobicContact CD1-CG1 4.07Å; I200-I213 HydrophobicContact CD1-CG2 4.16Å; I200-I213 HydrophobicContact CG1-CD1 3.92Å; I200-I213 HydrophobicContact CG1-CG1 4.35Å; I200-L228 HydrophobicContact CG1-CD1 4.47Å; I200-D304 HydrophobicContact CD1-CB 4.5Å; I200-D304 HydrophobicContact CG2-CB 3.84Å; I200-W305 HydrophobicContact CB-CE3 4.42Å; I200-W305 HydrophobicContact CB-CH2 3.61Å; I200-W305 HydrophobicContact CB-CZ3 3.55Å; I200-W305 HydrophobicContact CD1-CE3 4.16Å; I200-W305 HydrophobicContact CD1-CZ3 3.86Å; I200-W305 HydrophobicContact CG1-CZ3 4.3Å; I200-W305 HydrophobicContact CG2-CD2 4.4Å; I200-W305 HydrophobicContact CG2-CE3 3.98Å; I200-W305 HydrophobicContact CG2-CH2 3.39Å; I200-W305 HydrophobicContact CG2-CZ2 3.86Å; I200-W305 HydrophobicContact CG2-CZ3 3.46Å; I200-W305 VanDerWaalsContact CG2-CZ3 3.46Å; I200-L308 HydrophobicContact CD1-CB 4.34Å; I200-L308 HydrophobicContact CD1-CD2 4.31Å
201	D	95.8	Very high	93.2	Very high	15 Å²	15	20.6 Å²	20.6	8%	0.08	11%	0.11	C	C	.	.	H	α-helix	trans	-63.2	-37.6	178.3	-172.2	57.3	0	0	0	111.6	V197 I203 H204 Q205 W305 V373	V197-D201 WeakPolarHBondContact O-CB 3.17Å; V197-D201 PolarHBondContact O-N 2.73Å; D201-I203 VanDerWaalsContact C-N 3.33Å; D201-I203 PolarHBondContact O-N 2.77Å; D201-H204 WeakPolarHBondContact O-CB 3.3Å; D201-H204 PolarHBondContact O-N 2.84Å; D201-H204 VanDerWaalsContact O-N 3.13Å; D201-Q205 WeakPolarHBondContact O-CG 3.32Å; D201-Q205 PolarHBondContact O-N 2.6Å; D201-Q205 PolarHBondContact OD2-NE2 3.39Å; D201-W305 HydrophobicContact CB-CH2 4.28Å; D201-V373 HydrophobicContact CB-CB 4.22Å; D201-V373 HydrophobicContact CB-CG2 3.84Å; D201-V373 WeakPolarHBondContact OD2-CG1 3.31Å
202	S	93	Very high	92.7	Very high	20 Å²	20	21 Å²	21	14%	0.14	11%	0.114	C	C	.	.	H	α-helix	trans	-59.7	-39.8	177.9	80.7	0	0	0	0	113.1	S146 L198 A199 I200 L206	S146-S202 PolarHBondContact OG-OG 3.28Å; L198-S202 WeakPolarHBondContact O-CB 3.29Å; L198-S202 PolarHBondContact O-N 2.79Å; A199-S202 PolarHBondContact O-N 3.28Å; A199-S202 PolarHBondContact O-OG 3.34Å; I200-S202 VanDerWaalsContact C-N 3.29Å; I200-S202 PolarHBondContact O-N 2.78Å; S202-L206 WeakPolarHBondContact O-CG 3.43Å; S202-L206 PolarHBondContact O-N 2.86Å
203	I	90.1	Very high	92.4	Very high	1 Å²	1	21.1 Å²	21.1	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-77.9	-30.1	176.7	59.2	169.6	0	0	0	112	V149 A199 I200 D201 L206 G207 F208 H210 L228 F231	V149-I203 HydrophobicContact CG2-CG2 3.67Å; A199-I203 PolarHBondContact O-N 2.97Å; I200-I203 WeakPolarHBondContact O-CG1 3.37Å; I200-I203 PolarHBondContact O-N 2.99Å; D201-I203 VanDerWaalsContact C-N 3.33Å; D201-I203 PolarHBondContact O-N 2.77Å; I203-L206 PolarHBondContact O-N 2.97Å; I203-G207 PolarHBondContact O-N 2.66Å; I203-F208 PolarHBondContact O-N 3.23Å; I203-H210 HydrophobicContact CD1-CB 3.72Å; I203-L228 HydrophobicContact CD1-CD1 3.81Å; I203-L228 HydrophobicContact CG1-CD1 4.32Å; I203-L228 HydrophobicContact CG2-CD1 4.41Å; I203-F231 HydrophobicContact CD1-CE1 4.36Å; I203-F231 HydrophobicContact CG2-CE1 4.21Å
204	H	91.4	Very high	92.1	Very high	13 Å²	13	23 Å²	23	6%	0.06	12%	0.122	C	C	.	.	H	α-helix	trans	-66.4	-37.8	173.1	-74.1	-173.2	0	0	0	112	I200 D201 L206 G207 F208 K301 D304 W305	I200-H204 WeakPolarHBondContact CG2-CE1 3.46Å; I200-H204 WeakPolarHBondContact CG2-NE2 3.28Å; I200-H204 PolarHBondContact O-CD2 2.71Å; I200-H204 PolarHBondContact O-N 3.45Å; D201-H204 WeakPolarHBondContact O-CB 3.3Å; D201-H204 PolarHBondContact O-N 2.84Å; D201-H204 VanDerWaalsContact O-N 3.13Å; H204-L206 PolarHBondContact O-N 3.03Å; H204-G207 WeakPolarHBondContact O-CA 3.46Å; H204-G207 PolarHBondContact O-N 3.44Å; H204-F208 WeakPolarHBondContact CA-O 3.3Å; H204-F208 PolarHBondContact CD2-O 2.97Å; H204-K301 HydrophobicContact CB-CD 4.14Å; H204-K301 PolarHBondContact CE1-O 3.45Å; H204-D304 IonicContact CD2-OD2 3.89Å; H204-D304 IonicContact CE1-OD2 3.22Å; H204-D304 IonicContact NE2-OD2 2.96Å; H204-D304 PolarHBondContact NE2-OD2 3.48Å; H204-W305 AromaticContact ND1-CZ2 3.98Å
205	Q	90.1	Very high	91.9	Very high	147 Å²	147	23 Å²	23	69%	0.687	12%	0.122	S	C	*	.	H	α-helix	trans	-65	-29.6	174.6	-71.3	-178.6	25.2	0	0	112.4	D201 G207	D201-Q205 WeakPolarHBondContact O-CG 3.32Å; D201-Q205 PolarHBondContact O-N 2.6Å; D201-Q205 PolarHBondContact OD2-NE2 3.39Å; Q205-G207 PolarHBondContact O-N 2.91Å
206	L	84.7	Confident	91.5	Very high	81 Å²	81	24.4 Å²	24.4	42%	0.424	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-1.5	171.4	-64.7	173.4	0	0	0	113.1	A144 S202 I203 H204 F208	A144-L206 HydrophobicContact CB-CD1 4.15Å; S202-L206 WeakPolarHBondContact O-CG 3.43Å; S202-L206 PolarHBondContact O-N 2.86Å; I203-L206 PolarHBondContact O-N 2.97Å; H204-L206 PolarHBondContact O-N 3.03Å; L206-F208 HydrophobicContact CB-CD2 3.65Å; L206-F208 HydrophobicContact CB-CE2 3.93Å
207	G	84.9	Confident	91.2	Very high	39 Å²	39	24.7 Å²	24.7	40%	0.402	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.3	12.9	177.8	0	0	0	0	0	114.8	I203 H204 Q205	I203-G207 PolarHBondContact O-N 2.66Å; H204-G207 WeakPolarHBondContact O-CA 3.46Å; H204-G207 PolarHBondContact O-N 3.44Å; Q205-G207 PolarHBondContact O-N 2.91Å
208	F	83.4	Confident	91.1	Very high	32 Å²	32	24.7 Å²	24.7	14%	0.14	13%	0.131	C	C	.	.			trans	-100.9	151.3	178.2	-59.8	-74.4	0	0	0	111.7	I140 I203 H204 L206	I140-F208 HydrophobicContact CD1-CB 4.04Å; I140-F208 HydrophobicContact CD1-CD1 3.54Å; I140-F208 HydrophobicContact CD1-CD2 4.44Å; I140-F208 HydrophobicContact CD1-CE1 4.07Å; I140-F208 HydrophobicContact CD1-CG 3.75Å; I140-F208 HydrophobicContact CG1-CB 4.36Å; I140-F208 HydrophobicContact CG1-CD1 3.4Å; I140-F208 HydrophobicContact CG1-CD2 3.84Å; I140-F208 HydrophobicContact CG1-CE1 3.46Å; I140-F208 VanDerWaalsContact CG1-CE1 3.46Å; I140-F208 HydrophobicContact CG1-CE2 3.9Å; I140-F208 HydrophobicContact CG1-CG 3.59Å; I140-F208 HydrophobicContact CG1-CZ 3.72Å; I203-F208 PolarHBondContact O-N 3.23Å; H204-F208 WeakPolarHBondContact CA-O 3.3Å; H204-F208 PolarHBondContact CD2-O 2.97Å; L206-F208 HydrophobicContact CB-CD2 3.65Å; L206-F208 HydrophobicContact CB-CE2 3.93Å
209	I	86.6	Confident	91	Very high	4 Å²	4	25.4 Å²	25.4	2%	0.021	14%	0.135	C	C	.	.	B	Isolated β-bridge	trans	-119.5	130.6	170.5	-54.2	173.4	0	0	0	106.6	R211 C234 L237 K301 D304	I209-R211 HydrophobicContact CB-CG 4.14Å; I209-R211 HydrophobicContact CG2-CG 3.6Å; I209-C234 WeakPolarHBondContact O-CA 3.2Å; I209-L237 HydrophobicContact CD1-CD2 4.12Å; I209-K301 HydrophobicContact CD1-CB 4.13Å; I209-K301 HydrophobicContact CG1-CB 3.85Å; I209-D304 WeakPolarHBondContact CG2-OD2 3.35Å
210	H	88.8	Confident	91.1	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.135	C	C	.	.			trans	-72.1	-50.4	-173.4	-164.4	-58.2	0	0	0	112.5	I203 D212 I213 S229 D230 F231 C234 D304	I203-H210 HydrophobicContact CD1-CB 3.72Å; H210-D212 PolarHBondContact CE1-O 3.31Å; H210-D212 PolarHBondContact ND1-N 3.08Å; H210-D212 PolarHBondContact O-N 3.32Å; H210-D212 VanDerWaalsContact O-N 3.15Å; H210-I213 HydrophobicContact CB-CD1 3.66Å; H210-I213 HydrophobicContact CB-CG1 3.79Å; H210-I213 VanDerWaalsContact CD2-CD1 3.4Å; H210-I213 WeakPolarHBondContact CD2-CD1 3.31Å; H210-S229 PolarHBondContact NE2-O 3.13Å; H210-D230 PolarHBondContact CE1-O 3.33Å; H210-F231 AromaticContact CD2-CD1 3.9Å; H210-F231 AromaticContact CD2-CE1 3.75Å; H210-F231 AromaticContact NE2-CE1 3.94Å; H210-C234 VanDerWaalsContact CA-SG 3.5Å; H210-C234 PolarHBondContact O-SG 3.06Å; H210-D304 PolarHBondContact N-OD2 3.43Å
211	R	86.6	Confident	91.1	Very high	33 Å²	33	26.5 Å²	26.5	13%	0.125	14%	0.141	C	C	.	.	S	Bend	trans	66.4	3.1	177.4	-51.4	175.1	176.6	-179.2	-1.1	116.7	I209 L233 T235 G236 K238 Y299 D304	I209-R211 HydrophobicContact CB-CG 4.14Å; I209-R211 HydrophobicContact CG2-CG 3.6Å; R211-L233 WeakPolarHBondContact CD-O 3.36Å; R211-T235 VanDerWaalsContact NH1-CG2 3.3Å; R211-T235 PolarHBondContact NH1-OG1 3.43Å; R211-T235 PolarHBondContact NH2-OG1 3.12Å; R211-G236 PolarHBondContact NH2-O 2.9Å; R211-K238 PolarHBondContact NH2-O 3.5Å; R211-Y299 WeakPolarHBondContact CD-OH 3.19Å; R211-Y299 HydrophobicContact CG-CE2 4.14Å; R211-Y299 PolarHBondContact NE-OH 2.68Å; R211-Y299 VanDerWaalsContact NE-OH 3.12Å; R211-Y299 PolarHBondContact NH1-OH 2.84Å; R211-D304 WeakPolarHBondContact CA-OD1 3.24Å; R211-D304 PolarHBondContact N-OD1 2.87Å
212	D	87.2	Confident	91	Very high	34 Å²	34	28.9 Å²	28.9	18%	0.182	16%	0.159	C	C	.	.			trans	-145.6	44.3	-179.5	-158	29.1	0	0	0	109.7	H210 K214 N217 L233	H210-D212 PolarHBondContact CE1-O 3.31Å; H210-D212 PolarHBondContact ND1-N 3.08Å; H210-D212 PolarHBondContact O-N 3.32Å; H210-D212 VanDerWaalsContact O-N 3.15Å; D212-K214 VanDerWaalsContact CG-CE 3.41Å; D212-K214 PolarHBondContact O-N 2.72Å; D212-K214 VanDerWaalsContact OD1-CE 3.31Å; D212-K214 WeakPolarHBondContact OD1-CE 3.44Å; D212-K214 IonicContact OD1-NZ 3.75Å; D212-K214 WeakPolarHBondContact OD2-CE 3.4Å; D212-K214 IonicContact OD2-NZ 2.66Å; D212-K214 PolarHBondContact OD2-NZ 3.38Å; D212-N217 PolarHBondContact O-ND2 2.97Å; D212-N217 PolarHBondContact OD2-ND2 3.17Å; D212-L233 HydrophobicContact CB-CB 4.26Å; D212-L233 HydrophobicContact CB-CD1 3.99Å; D212-L233 HydrophobicContact CB-CG 4.46Å
213	I	93.9	Very high	91.2	Very high	1 Å²	1	35 Å²	35	1%	0.005	18%	0.183	C	C	.	.			trans	-75.6	116.9	175.1	-65.8	-63.7	0	0	0	108	I200 H210 L228 Y288 D304 S307 I311	I200-I213 HydrophobicContact CD1-CD1 4.08Å; I200-I213 HydrophobicContact CD1-CG1 4.07Å; I200-I213 HydrophobicContact CD1-CG2 4.16Å; I200-I213 HydrophobicContact CG1-CD1 3.92Å; I200-I213 HydrophobicContact CG1-CG1 4.35Å; H210-I213 HydrophobicContact CB-CD1 3.66Å; H210-I213 HydrophobicContact CB-CG1 3.79Å; H210-I213 VanDerWaalsContact CD2-CD1 3.4Å; H210-I213 WeakPolarHBondContact CD2-CD1 3.31Å; I213-L228 HydrophobicContact CD1-CD2 3.99Å; I213-Y288 WeakPolarHBondContact O-CB 3.16Å; I213-D304 HydrophobicContact CG1-CB 4.09Å; I213-S307 WeakPolarHBondContact O-CB 3.26Å; I213-I311 HydrophobicContact CG2-CD1 3.59Å
214	K	92.6	Very high	91.5	Very high	39 Å²	39	35 Å²	35	17%	0.17	18%	0.182	C	C	.	.	S	Bend	trans	-161.3	160.6	-178.5	52.7	-178.1	176	154.8	0	109	D212 D216 N217 Y288	D212-K214 VanDerWaalsContact CG-CE 3.41Å; D212-K214 PolarHBondContact O-N 2.72Å; D212-K214 VanDerWaalsContact OD1-CE 3.31Å; D212-K214 WeakPolarHBondContact OD1-CE 3.44Å; D212-K214 IonicContact OD1-NZ 3.75Å; D212-K214 WeakPolarHBondContact OD2-CE 3.4Å; D212-K214 IonicContact OD2-NZ 2.66Å; D212-K214 PolarHBondContact OD2-NZ 3.38Å; K214-D216 VanDerWaalsContact C-N 3.28Å; K214-D216 WeakPolarHBondContact CD-OD1 3.16Å; K214-D216 VanDerWaalsContact CD-OD2 3.28Å; K214-D216 WeakPolarHBondContact CD-OD2 3.28Å; K214-D216 WeakPolarHBondContact CE-OD2 3.47Å; K214-D216 WeakPolarHBondContact CG-OD1 3.5Å; K214-D216 IonicContact NZ-OD2 3.83Å; K214-D216 PolarHBondContact NZ-OD2 3.02Å; K214-D216 PolarHBondContact O-N 2.86Å; K214-N217 WeakPolarHBondContact CE-ND2 3.16Å; K214-N217 HydrophobicContact CG-CB 4.29Å; K214-N217 PolarHBondContact O-N 3.18Å; K214-Y288 HydrophobicContact CB-CD1 4.31Å; K214-Y288 HydrophobicContact CB-CD2 3.7Å; K214-Y288 HydrophobicContact CB-CE2 3.98Å; K214-Y288 HydrophobicContact CB-CG 3.9Å
215	P	94.3	Very high	91.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-60.3	-31	-171.4	-25.4	34.9	0	0	0	114.8	M174 M175 L178 N217 L218 Y288 I311 E314	M174-P215 HydrophobicContact CB-CB 4.09Å; M174-P215 VanDerWaalsContact CB-O 3.3Å; M174-P215 WeakPolarHBondContact CB-O 3.34Å; M174-P215 HydrophobicContact CG-CB 4.1Å; M174-P215 PolarHBondContact N-O 2.96Å; M175-P215 HydrophobicContact CB-CB 3.91Å; M175-P215 PolarHBondContact N-O 3.47Å; L178-P215 HydrophobicContact CD1-CB 4.2Å; L178-P215 HydrophobicContact CD1-CG 4.23Å; P215-N217 PolarHBondContact O-N 2.99Å; P215-L218 PolarHBondContact O-N 3.3Å; P215-Y288 HydrophobicContact CG-CE1 4.17Å; P215-I311 HydrophobicContact CG-CG1 4.15Å; P215-I311 HydrophobicContact CG-CG2 4.48Å; P215-E314 WeakPolarHBondContact CG-OE2 3.46Å
216	D	89.3	Confident	92.2	Very high	31 Å²	31	27.5 Å²	27.5	17%	0.166	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-67.6	-21.9	176.4	47.1	-64.6	0	0	0	113.8	M175 K214 R275	M175-D216 HydrophobicContact CB-CB 4.23Å; M175-D216 HydrophobicContact SD-CB 4.22Å; K214-D216 VanDerWaalsContact C-N 3.28Å; K214-D216 WeakPolarHBondContact CD-OD1 3.16Å; K214-D216 VanDerWaalsContact CD-OD2 3.28Å; K214-D216 WeakPolarHBondContact CD-OD2 3.28Å; K214-D216 WeakPolarHBondContact CE-OD2 3.47Å; K214-D216 WeakPolarHBondContact CG-OD1 3.5Å; K214-D216 IonicContact NZ-OD2 3.83Å; K214-D216 PolarHBondContact NZ-OD2 3.02Å; K214-D216 PolarHBondContact O-N 2.86Å; D216-R275 IonicContact OD1-NH2 2.67Å
217	N	92.6	Very high	92.8	Very high	6 Å²	6	24.7 Å²	24.7	3%	0.032	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-93.9	-3.8	177.8	-71.8	-10	0	0	0	113.2	D212 K214 P215 S229 D230	D212-N217 PolarHBondContact O-ND2 2.97Å; D212-N217 PolarHBondContact OD2-ND2 3.17Å; K214-N217 WeakPolarHBondContact CE-ND2 3.16Å; K214-N217 HydrophobicContact CG-CB 4.29Å; K214-N217 PolarHBondContact O-N 3.18Å; P215-N217 PolarHBondContact O-N 2.99Å; N217-S229 WeakPolarHBondContact CA-OG 3.39Å; N217-S229 PolarHBondContact O-N 2.99Å; N217-S229 PolarHBondContact O-OG 2.98Å; N217-D230 WeakPolarHBondContact OD1-CB 3.23Å
218	L	96.7	Very high	93.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	102.7	173.7	-55.1	-175	0	0	0	109.3	D173 M174 T196 P215 V226 L228 I311	D173-L218 CarbonylContact C-O 3.44Å; D173-L218 WeakPolarHBondContact CA-O 3.42Å; M174-L218 HydrophobicContact CB-CB 3.86Å; M174-L218 PolarHBondContact N-O 2.99Å; T196-L218 HydrophobicContact CG2-CD1 4.18Å; T196-L218 HydrophobicContact CG2-CD2 3.92Å; P215-L218 PolarHBondContact O-N 3.3Å; L218-V226 HydrophobicContact CB-CG1 4.43Å; L218-V226 HydrophobicContact CD2-CG1 4.39Å; L218-L228 HydrophobicContact CD2-CD2 3.37Å; L218-I311 HydrophobicContact CD1-CD1 3.97Å; L218-I311 HydrophobicContact CD1-CG2 4.48Å
219	L	96.9	Very high	93.5	Very high	37 Å²	37	22 Å²	22	19%	0.194	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	154.5	-179.9	-57	-172.9	0	0	0	111.8	V150 L169 G172 D173 V226 K227 S229	V150-L219 HydrophobicContact CG2-CD1 3.89Å; L169-L219 HydrophobicContact CB-CB 4.44Å; L169-L219 HydrophobicContact CD1-CB 3.56Å; L169-L219 HydrophobicContact CD1-CD1 4Å; L169-L219 HydrophobicContact CD1-CG 4.44Å; G172-L219 CarbonylContact O-C 3.49Å; G172-L219 WeakPolarHBondContact O-CA 3.27Å; D173-L219 HydrophobicContact CB-CD2 3.65Å; L219-V226 CarbonylContact O-C 3.54Å; L219-V226 WeakPolarHBondContact O-CA 3.33Å; L219-K227 PolarHBondContact N-O 3.29Å; L219-K227 PolarHBondContact O-N 2.9Å; L219-S229 WeakPolarHBondContact CG-OG 3.32Å
220	L	97.4	Very high	93.1	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.005	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	125.5	179.2	-59.9	176.8	0	0	0	110.5	L169 G171 G172 M174 L177 Y192 H225 V226 I399	L169-L220 WeakPolarHBondContact CB-O 3.02Å; G171-L220 WeakPolarHBondContact CA-O 3.15Å; G171-L220 PolarHBondContact N-O 3.48Å; G172-L220 PolarHBondContact O-N 3.23Å; M174-L220 HydrophobicContact CE-CD2 4.24Å; L177-L220 HydrophobicContact CD2-CD1 3.79Å; Y192-L220 HydrophobicContact CD1-CD2 4.39Å; Y192-L220 HydrophobicContact CE1-CD2 3.82Å; L220-H225 WeakPolarHBondContact CA-O 3.47Å; L220-V226 HydrophobicContact CD2-CG2 4.15Å; L220-I399 HydrophobicContact CB-CD1 4.36Å; L220-I399 HydrophobicContact CD1-CD1 4.13Å
221	D	95.9	Very high	92.4	Very high	22 Å²	22	24.4 Å²	24.4	12%	0.118	12%	0.124	C	C	.	.			trans	-72.7	176.6	174	72	25.6	0	0	0	112.4	L169 K223 G224 H225 R391	L169-D221 HydrophobicContact CD2-CB 3.95Å; D221-K223 PolarHBondContact O-N 2.63Å; D221-K223 WeakPolarHBondContact OD1-CA 3.36Å; D221-K223 WeakPolarHBondContact OD1-CB 3.32Å; D221-K223 PolarHBondContact OD1-N 3.15Å; D221-G224 PolarHBondContact O-N 2.84Å; D221-G224 PolarHBondContact OD1-N 3.11Å; D221-G224 VanDerWaalsContact OD1-N 3.09Å; D221-H225 PolarHBondContact N-O 3.3Å; D221-H225 IonicContact OD1-CD2 2.77Å; D221-H225 PolarHBondContact OD1-N 3.46Å; D221-H225 VanDerWaalsContact OD1-N 3.09Å; D221-R391 IonicContact OD2-CZ 3.3Å; D221-R391 IonicContact OD2-NH2 2.64Å; D221-R391 PolarHBondContact OD2-NH2 3.49Å
222	S	95.4	Very high	91.2	Very high	65 Å²	65	23.4 Å²	23.4	46%	0.455	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-15.5	-179.9	60.5	0	0	0	0	115.2
223	K	95.9	Very high	89.7	Confident	149 Å²	149	23.1 Å²	23.1	65%	0.648	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.8	-4.6	177.6	-66.7	-179.3	-178.7	-176.8	0	112.5	D221 A395	D221-K223 PolarHBondContact O-N 2.63Å; D221-K223 WeakPolarHBondContact OD1-CA 3.36Å; D221-K223 WeakPolarHBondContact OD1-CB 3.32Å; D221-K223 PolarHBondContact OD1-N 3.15Å; K223-A395 VanDerWaalsContact O-CB 3.3Å; K223-A395 WeakPolarHBondContact O-CB 3.35Å
224	G	96.8	Very high	88	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.122	C	C	.	.	S	Bend	trans	91.3	12.1	179.3	0	0	0	0	0	115.2	D221 A395 I399	D221-G224 PolarHBondContact O-N 2.84Å; D221-G224 PolarHBondContact OD1-N 3.11Å; D221-G224 VanDerWaalsContact OD1-N 3.09Å; G224-A395 WeakPolarHBondContact O-CB 3.22Å; G224-I399 VanDerWaalsContact CA-CG1 3.42Å
225	H	98.3	Very high	86.2	Confident	4 Å²	4	22.8 Å²	22.8	2%	0.019	12%	0.124	C	C	.	.			trans	-89.8	149.3	177.5	-62.3	-89.2	0	0	0	112.3	F191 E195 L220 D221 R391 R393	F191-H225 AromaticContact CZ-CE1 3.87Å; F191-H225 AromaticContact CZ-ND1 3.61Å; E195-H225 IonicContact OE1-CE1 3.23Å; E195-H225 IonicContact OE1-CG 2.88Å; E195-H225 IonicContact OE1-ND1 3.86Å; E195-H225 PolarHBondContact OE1-ND1 2.89Å; E195-H225 VanDerWaalsContact OE2-CA 3.31Å; E195-H225 WeakPolarHBondContact OE2-CA 3.3Å; E195-H225 IonicContact OE2-ND1 2.83Å; L220-H225 WeakPolarHBondContact CA-O 3.47Å; D221-H225 PolarHBondContact N-O 3.3Å; D221-H225 IonicContact OD1-CD2 2.77Å; D221-H225 PolarHBondContact OD1-N 3.46Å; D221-H225 VanDerWaalsContact OD1-N 3.09Å; H225-R391 HydrophobicContact CB-CG 4.24Å; H225-R391 PolarHBondContact CE1-O 3.09Å; H225-R391 PolarHBondContact NE2-O 3.21Å; H225-R393 PolarHBondContact CE1-O 3.18Å; H225-R393 PolarHBondContact NE2-O 3.4Å; H225-R393 VanDerWaalsContact NE2-O 3.12Å
226	V	98	Very high	83.9	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	139.7	-175.4	178.4	0	0	0	0	111.7	Y192 E195 L218 L219 L220 R391	Y192-V226 HydrophobicContact CD1-CG2 3.73Å; Y192-V226 HydrophobicContact CE1-CG2 4.42Å; E195-V226 HydrophobicContact CB-CB 4.1Å; E195-V226 HydrophobicContact CB-CG2 4.05Å; E195-V226 PolarHBondContact OE2-N 2.89Å; L218-V226 HydrophobicContact CB-CG1 4.43Å; L218-V226 HydrophobicContact CD2-CG1 4.39Å; L219-V226 CarbonylContact O-C 3.54Å; L219-V226 WeakPolarHBondContact O-CA 3.33Å; L220-V226 HydrophobicContact CD2-CG2 4.15Å; V226-R391 PolarHBondContact O-NH1 3.44Å; V226-R391 PolarHBondContact O-NH2 3.25Å
227	K	96.8	Very high	81.4	Confident	21 Å²	21	30.2 Å²	30.2	9%	0.091	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	136.5	163.3	-82.2	170.4	169.9	-94	0	109.7	L147 W148 V149 V150 E167 L169 L219	L147-K227 VanDerWaalsContact O-CE 3.3Å; L147-K227 WeakPolarHBondContact O-CE 3.19Å; L147-K227 WeakPolarHBondContact O-CG 3.35Å; L147-K227 PolarHBondContact O-NZ 3.41Å; W148-K227 CarbonylContact O-C 3.5Å; W148-K227 WeakPolarHBondContact O-CA 3.42Å; V149-K227 PolarHBondContact O-NZ 3.02Å; V149-K227 VanDerWaalsContact O-NZ 3.15Å; V150-K227 HydrophobicContact CG2-CB 4.25Å; E167-K227 IonicContact OE1-NZ 2.97Å; E167-K227 PolarHBondContact OE1-NZ 2.97Å; E167-K227 IonicContact OE2-NZ 3.57Å; L169-K227 HydrophobicContact CD1-CB 3.79Å; L169-K227 HydrophobicContact CD1-CD 3.71Å; L169-K227 HydrophobicContact CD1-CG 4.36Å; L169-K227 HydrophobicContact CD2-CD 3.91Å; L169-K227 HydrophobicContact CG-CD 4.48Å; L219-K227 PolarHBondContact N-O 3.29Å; L219-K227 PolarHBondContact O-N 2.9Å
228	L	94.7	Very high	78.5	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	139.3	174.1	-64.3	177.2	0	0	0	110.9	W148 V150 A199 I200 I203 I213 L218 F231	W148-L228 PolarHBondContact O-N 3.37Å; V150-L228 WeakPolarHBondContact CG2-O 3.43Å; V150-L228 PolarHBondContact N-O 2.86Å; A199-L228 HydrophobicContact CB-CD1 3.76Å; A199-L228 HydrophobicContact CB-CD2 4.36Å; A199-L228 HydrophobicContact CB-CG 3.78Å; I200-L228 HydrophobicContact CG1-CD1 4.47Å; I203-L228 HydrophobicContact CD1-CD1 3.81Å; I203-L228 HydrophobicContact CG1-CD1 4.32Å; I203-L228 HydrophobicContact CG2-CD1 4.41Å; I213-L228 HydrophobicContact CD1-CD2 3.99Å; L218-L228 HydrophobicContact CD2-CD2 3.37Å; L228-F231 HydrophobicContact CB-CE1 4.13Å; L228-F231 HydrophobicContact CB-CZ 3.71Å
229	S	89.9	Confident	75.6	Confident	16 Å²	16	45 Å²	45	11%	0.112	24%	0.235	C	C	.	.			trans	-133.4	169.9	176.3	69.1	0	0	0	0	111.2	H210 N217 L219	H210-S229 PolarHBondContact NE2-O 3.13Å; N217-S229 WeakPolarHBondContact CA-OG 3.39Å; N217-S229 PolarHBondContact O-N 2.99Å; N217-S229 PolarHBondContact O-OG 2.98Å; L219-S229 WeakPolarHBondContact CG-OG 3.32Å
230	D	78.3	Confident	72.9	Confident	53 Å²	53	44.9 Å²	44.9	28%	0.283	24%	0.24	S	C	.	.			trans	56.6	71.5	175.5	-156.2	14.4	0	0	0	115.4	K118 H210 N217 G232	K118-D230 IonicContact NZ-OD1 3.8Å; K118-D230 PolarHBondContact NZ-OD1 3.17Å; H210-D230 PolarHBondContact CE1-O 3.33Å; N217-D230 WeakPolarHBondContact OD1-CB 3.23Å; D230-G232 PolarHBondContact O-N 3.38Å
231	F	73.2	Confident	70.5	Confident	1 Å²	1	52.9 Å²	52.9	0%	0.004	28%	0.277	C	S	.	.			trans	-83.7	19.2	177.2	-57.7	-82.1	0	0	0	113.3	E137 I140 L141 V149 I203 H210 L228 L233 C234	E137-F231 HydrophobicContact CB-CB 4.26Å; E137-F231 HydrophobicContact CG-CB 4.14Å; I140-F231 HydrophobicContact CB-CB 4.42Å; I140-F231 HydrophobicContact CB-CG 4.35Å; I140-F231 HydrophobicContact CD1-CB 3.9Å; I140-F231 HydrophobicContact CD1-CD1 4.23Å; I140-F231 HydrophobicContact CD1-CG 4.28Å; I140-F231 HydrophobicContact CG2-CB 4.43Å; I140-F231 HydrophobicContact CG2-CD1 3.85Å; I140-F231 HydrophobicContact CG2-CD2 4.11Å; I140-F231 HydrophobicContact CG2-CE1 4.14Å; I140-F231 HydrophobicContact CG2-CE2 4.4Å; I140-F231 HydrophobicContact CG2-CG 3.85Å; I140-F231 HydrophobicContact CG2-CZ 4.41Å; L141-F231 HydrophobicContact CD2-CD2 3.91Å; L141-F231 HydrophobicContact CD2-CE2 3.8Å; L141-F231 HydrophobicContact CG-CD2 4.06Å; L141-F231 HydrophobicContact CG-CE2 4.44Å; V149-F231 HydrophobicContact CB-CZ 4.21Å; V149-F231 HydrophobicContact CG1-CE2 3.46Å; V149-F231 VanDerWaalsContact CG1-CE2 3.46Å; V149-F231 HydrophobicContact CG1-CZ 3.47Å; V149-F231 VanDerWaalsContact CG1-CZ 3.47Å; V149-F231 HydrophobicContact CG2-CZ 3.89Å; I203-F231 HydrophobicContact CD1-CE1 4.36Å; I203-F231 HydrophobicContact CG2-CE1 4.21Å; H210-F231 AromaticContact CD2-CD1 3.9Å; H210-F231 AromaticContact CD2-CE1 3.75Å; H210-F231 AromaticContact NE2-CE1 3.94Å; L228-F231 HydrophobicContact CB-CE1 4.13Å; L228-F231 HydrophobicContact CB-CZ 3.71Å; F231-L233 VanDerWaalsContact C-N 3.29Å; F231-L233 PolarHBondContact O-N 3.03Å; F231-C234 WeakPolarHBondContact CA-SG 3.36Å; F231-C234 HydrophobicContact CB-CB 4.15Å; F231-C234 WeakPolarHBondContact CB-SG 3.5Å; F231-C234 VanDerWaalsContact CD1-SG 3.56Å; F231-C234 WeakPolarHBondContact O-CB 3.33Å; F231-C234 PolarHBondContact O-N 3.27Å; F231-C234 PolarHBondContact O-SG 3.02Å; F231-C234 VanDerWaalsContact O-SG 3.33Å
232	G	60.9	Low	68.4	Low	11 Å²	11	58.1 Å²	58.1	11%	0.113	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-39.7	-175.4	0	0	0	0	0	112.9	H133 D230 C234	H133-G232 CarbonylContact C-O 3.59Å; H133-G232 WeakPolarHBondContact CA-O 3.42Å; H133-G232 WeakPolarHBondContact CB-O 3.4Å; H133-G232 PolarHBondContact CD2-O 3.3Å; H133-G232 VanDerWaalsContact CD2-O 3.31Å; D230-G232 PolarHBondContact O-N 3.38Å; G232-C234 VanDerWaalsContact C-N 3.3Å
233	L	56.8	Low	66.6	Low	29 Å²	29	57 Å²	57	15%	0.152	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	0.1	178.8	-60.6	-176.7	0	0	0	113.8	R211 D212 F231 T235	R211-L233 WeakPolarHBondContact CD-O 3.36Å; D212-L233 HydrophobicContact CB-CB 4.26Å; D212-L233 HydrophobicContact CB-CD1 3.99Å; D212-L233 HydrophobicContact CB-CG 4.46Å; F231-L233 VanDerWaalsContact C-N 3.29Å; F231-L233 PolarHBondContact O-N 3.03Å; L233-T235 PolarHBondContact O-N 3.38Å
234	C	57.1	Low	64.9	Low	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.282	C	S	.	.			trans	-64.9	133.8	175.6	-58.5	0	0	0	0	109.2	A136 I140 I209 H210 F231 G232	A136-C234 WeakPolarHBondContact CB-O 3.49Å; I140-C234 HydrophobicContact CD1-CB 3.26Å; I209-C234 WeakPolarHBondContact O-CA 3.2Å; H210-C234 VanDerWaalsContact CA-SG 3.5Å; H210-C234 PolarHBondContact O-SG 3.06Å; F231-C234 WeakPolarHBondContact CA-SG 3.36Å; F231-C234 HydrophobicContact CB-CB 4.15Å; F231-C234 WeakPolarHBondContact CB-SG 3.5Å; F231-C234 VanDerWaalsContact CD1-SG 3.56Å; F231-C234 WeakPolarHBondContact O-CB 3.33Å; F231-C234 PolarHBondContact O-N 3.27Å; F231-C234 PolarHBondContact O-SG 3.02Å; F231-C234 VanDerWaalsContact O-SG 3.33Å; G232-C234 VanDerWaalsContact C-N 3.3Å
235	T	54.7	Low	63	Low	33 Å²	33	60.8 Å²	60.8	20%	0.202	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-133.7	161	162.7	85.7	0	0	0	0	107.5	R211 L233 K238 A240	R211-T235 VanDerWaalsContact NH1-CG2 3.3Å; R211-T235 PolarHBondContact NH1-OG1 3.43Å; R211-T235 PolarHBondContact NH2-OG1 3.12Å; L233-T235 PolarHBondContact O-N 3.38Å; T235-K238 PolarHBondContact OG1-O 2.93Å; T235-K238 VanDerWaalsContact OG1-O 3.07Å; T235-A240 HydrophobicContact CG2-CB 4.39Å
236	G	45.8	Very low	61.3	Low	37 Å²	37	61.5 Å²	61.5	38%	0.381	31%	0.306	S	S	.	.	S	Bend	trans	-56.7	179.8	162.2	0	0	0	0	0	111.2	R211 K238	R211-G236 PolarHBondContact NH2-O 2.9Å; G236-K238 PolarHBondContact O-N 3.26Å
237	L	37.5	Very low	59.7	Low	149 Å²	149	68.7 Å²	68.7	78%	0.78	33%	0.334	S	S	*	.	S	Bend	trans	-55.4	11.7	-176	-67.3	167.5	0	0	0	117.1	I209	I209-L237 HydrophobicContact CD1-CD2 4.12Å
238	K	32	Very low	58.1	Low	177 Å²	177	75.1 Å²	75.1	77%	0.77	37%	0.369	S	S	*	.	S	Bend	trans	-85.9	141	173.2	-62.4	-175.3	179.3	-179.5	0	111.3	R211 T235 G236	R211-K238 PolarHBondContact NH2-O 3.5Å; T235-K238 PolarHBondContact OG1-O 2.93Å; T235-K238 VanDerWaalsContact OG1-O 3.07Å; G236-K238 PolarHBondContact O-N 3.26Å
239	K	36.2	Very low	56.7	Low	140 Å²	140	77.5 Å²	77.5	61%	0.609	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-62.7	127.5	-177.9	-61.4	-174.6	175	-165.9	0	110.9	T297	K239-T297 PolarHBondContact NZ-O 3.47Å
240	A	40.2	Very low	55.9	Low	35 Å²	35	81.5 Å²	81.5	29%	0.289	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-97.2	153.5	173.2	0	0	0	0	0	113.6	T235 Y299	T235-A240 HydrophobicContact CG2-CB 4.39Å; A240-Y299 WeakPolarHBondContact CB-OH 3.37Å; A240-Y299 PolarHBondContact N-OH 2.92Å
241	H	45.4	Very low	55.7	Low	169 Å²	169	84 Å²	84	78%	0.782	41%	0.411	S	S	*	.			trans	-93.2	107	-172.9	-77.2	-131.9	0	0	0	111.5
242	R	52.8	Low	55.9	Low	132 Å²	132	86.5 Å²	86.5	50%	0.498	43%	0.429	S	S	.	.			trans	-148.7	13.3	157.5	-78.2	-158.6	178.1	175.9	-0.7	114.9	E244	R242-E244 PolarHBondContact O-N 2.77Å
243	T	56.7	Low	56.6	Low	42 Å²	42	90.2 Å²	90.2	26%	0.258	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-72.4	-13.2	-177.8	-38.1	0	0	0	0	113.8	F245 Y246 R247 F294	T243-F245 PolarHBondContact O-N 3.05Å; T243-Y246 PolarHBondContact O-N 3.45Å; T243-R247 PolarHBondContact O-N 3.41Å; T243-F294 WeakPolarHBondContact CG2-O 3.5Å
244	E	60.6	Low	57.6	Low	123 Å²	123	89.2 Å²	89.2	58%	0.575	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-65.8	-37.1	-169.3	-52.9	-148.3	131	0	0	114.1	R242 Y246 R247	R242-E244 PolarHBondContact O-N 2.77Å; E244-Y246 PolarHBondContact O-N 3.19Å; E244-R247 WeakPolarHBondContact O-CB 3.34Å; E244-R247 PolarHBondContact O-N 2.98Å; E244-R247 IonicContact OE1-CZ 3.06Å; E244-R247 IonicContact OE1-NH1 2.96Å; E244-R247 IonicContact OE1-NH2 3.37Å; E244-R247 PolarHBondContact OE1-NH2 3.43Å
245	F	58.1	Low	58.5	Low	105 Å²	105	92.8 Å²	92.8	46%	0.461	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-62.5	-30.7	-178.1	-174.7	-94.2	0	0	0	112.8	T243 V283	T243-F245 PolarHBondContact O-N 3.05Å; F245-V283 HydrophobicContact CE2-CG1 4.42Å; F245-V283 HydrophobicContact CZ-CG1 4.32Å
246	Y	61.9	Low	59.6	Low	19 Å²	19	92.3 Å²	92.3	8%	0.075	46%	0.462	C	S	.	.	G	3₁₀ helix	trans	-103	2.6	-177.1	-56.7	-78.2	0	0	0	113.3	T243 E244 N248 L249 P286 F294 Y331	T243-Y246 PolarHBondContact O-N 3.45Å; E244-Y246 PolarHBondContact O-N 3.19Å; Y246-N248 PolarHBondContact O-N 2.92Å; Y246-L249 HydrophobicContact CD1-CD2 4.38Å; Y246-L249 PolarHBondContact O-N 3.23Å; Y246-P286 WeakPolarHBondContact OH-CG 3.43Å; Y246-F294 AromaticContact CD2-CD1 3.92Å; Y246-F294 HydrophobicContact CD2-CD1 3.92Å; Y246-F294 AromaticContact CD2-CE1 3.8Å; Y246-F294 HydrophobicContact CD2-CE1 3.8Å; Y246-F294 HydrophobicContact CE2-CD1 4.29Å; Y246-F294 AromaticContact CE2-CE1 3.68Å; Y246-F294 HydrophobicContact CE2-CE1 3.68Å; Y246-Y331 AromaticContact CD1-CD1 3.92Å; Y246-Y331 HydrophobicContact CD1-CD1 3.92Å; Y246-Y331 AromaticContact CD1-CD2 3.61Å; Y246-Y331 HydrophobicContact CD1-CD2 3.61Å; Y246-Y331 HydrophobicContact CD1-CE1 4.45Å; Y246-Y331 HydrophobicContact CD1-CE2 4.16Å; Y246-Y331 AromaticContact CD1-CG 3.46Å; Y246-Y331 HydrophobicContact CD1-CG 3.46Å; Y246-Y331 VanDerWaalsContact CD1-CG 3.46Å; Y246-Y331 HydrophobicContact CD2-CD2 4.1Å; Y246-Y331 HydrophobicContact CD2-CE2 4.36Å; Y246-Y331 HydrophobicContact CE1-CD2 4.03Å; Y246-Y331 AromaticContact CE1-CG 3.8Å; Y246-Y331 HydrophobicContact CE1-CG 3.8Å; Y246-Y331 HydrophobicContact CE2-CD2 4.49Å; Y246-Y331 HydrophobicContact CG-CD1 4.49Å; Y246-Y331 AromaticContact CG-CD2 3.65Å; Y246-Y331 HydrophobicContact CG-CD2 3.65Å; Y246-Y331 AromaticContact CG-CE2 3.83Å; Y246-Y331 HydrophobicContact CG-CE2 3.83Å; Y246-Y331 AromaticContact CG-CG 4Å; Y246-Y331 HydrophobicContact CG-CG 4Å
247	R	63.3	Low	61.2	Low	151 Å²	151	97 Å²	97	57%	0.57	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-30.4	-172.4	-173.1	-177.1	-73.3	152.1	-3.7	114	T243 E244	T243-R247 PolarHBondContact O-N 3.41Å; E244-R247 WeakPolarHBondContact O-CB 3.34Å; E244-R247 PolarHBondContact O-N 2.98Å; E244-R247 IonicContact OE1-CZ 3.06Å; E244-R247 IonicContact OE1-NH1 2.96Å; E244-R247 IonicContact OE1-NH2 3.37Å; E244-R247 PolarHBondContact OE1-NH2 3.43Å
248	N	64.4	Low	63.1	Low	156 Å²	156	95.8 Å²	95.8	83%	0.834	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	4.4	-177.5	-61.6	-20.9	0	0	0	113.4	Y246	Y246-N248 PolarHBondContact O-N 2.92Å
249	L	65.6	Low	65.3	Low	49 Å²	49	87.9 Å²	87.9	26%	0.257	44%	0.437	S	S	.	.			trans	-86.5	133.9	175.8	-103.9	74.2	0	0	0	110.3	Y246 Q328 Y331	Y246-L249 HydrophobicContact CD1-CD2 4.38Å; Y246-L249 PolarHBondContact O-N 3.23Å; L249-Q328 HydrophobicContact CD1-CG 4.41Å; L249-Q328 HydrophobicContact CD2-CB 3.67Å; L249-Q328 HydrophobicContact CD2-CG 3.7Å; L249-Y331 HydrophobicContact CB-CE1 4.2Å; L249-Y331 HydrophobicContact CD2-CD1 4.15Å
250	N	71.5	Confident	67.3	Low	101 Å²	101	84.2 Å²	84.2	54%	0.54	42%	0.422	S	S	.	.			trans	-74	149.7	169.7	63.5	-3.2	0	0	0	110.3	S252	N250-S252 PolarHBondContact ND2-OG 2.91Å; N250-S252 PolarHBondContact O-N 2.89Å; N250-S252 PolarHBondContact OD1-OG 3.34Å; N250-S252 VanDerWaalsContact OD1-OG 3.13Å
251	H	75.5	Confident	69.2	Low	106 Å²	106	89.1 Å²	89.1	49%	0.491	44%	0.443	S	S	.	.			trans	-84.8	22.8	177.2	-59.8	-168.7	0	0	0	111.9	Y331 M335 N336	H251-Y331 PolarHBondContact CD2-OH 3.39Å; H251-Y331 VanDerWaalsContact CD2-OH 3.27Å; H251-Y331 PolarHBondContact NE2-OH 3.16Å; H251-M335 HydrophobicContact CB-CB 4.48Å; H251-N336 PolarHBondContact O-ND2 3.05Å; H251-N336 PolarHBondContact O-OD1 3.11Å
252	S	77.1	Confident	71.2	Confident	52 Å²	52	82.3 Å²	82.3	36%	0.364	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-64.9	159.1	177.2	63	0	0	0	0	110.5	N250 K332	N250-S252 PolarHBondContact ND2-OG 2.91Å; N250-S252 PolarHBondContact O-N 2.89Å; N250-S252 PolarHBondContact OD1-OG 3.34Å; N250-S252 VanDerWaalsContact OD1-OG 3.13Å; S252-K332 WeakPolarHBondContact O-CD 3.18Å; S252-K332 WeakPolarHBondContact O-CG 3.3Å
253	L	74.6	Confident	72.8	Confident	90 Å²	90	79.8 Å²	79.8	47%	0.471	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-51.1	147.2	173.5	-78.2	160.6	0	0	0	111.9	N336 E339	L253-N336 HydrophobicContact CD2-CB 4.22Å; L253-E339 WeakPolarHBondContact CD2-OE2 2.97Å
254	P	78.8	Confident	74.3	Confident	8 Å²	8	78.1 Å²	78.1	5%	0.052	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-62.8	149.2	176	28.6	-36.9	0	0	0	111.9	D256 Q260 E329 K332 K333	P254-D256 WeakPolarHBondContact CB-OD1 3.35Å; P254-Q260 PolarHBondContact O-NE2 3.42Å; P254-E329 VanDerWaalsContact C-OE2 3.32Å; P254-E329 WeakPolarHBondContact CA-OE2 3.31Å; P254-E329 WeakPolarHBondContact CB-OE2 3.38Å; P254-K332 HydrophobicContact CB-CB 4.24Å; P254-K333 HydrophobicContact CB-CG 4.18Å; P254-K333 HydrophobicContact CG-CG 3.72Å
255	S	75.8	Confident	75.6	Confident	74 Å²	74	79.2 Å²	79.2	52%	0.517	40%	0.401	S	S	.	.			trans	-103.9	6.3	-178.3	44.7	0	0	0	0	113.8	F257 E329	S255-F257 VanDerWaalsContact O-CD2 3.31Å; S255-F257 WeakPolarHBondContact O-CD2 3.39Å; S255-F257 PolarHBondContact O-N 3.43Å; S255-E329 PolarHBondContact N-OE2 3.29Å
256	D	78.8	Confident	77	Confident	24 Å²	24	80.8 Å²	80.8	13%	0.128	40%	0.404	C	S	.	.			trans	-78.9	50.8	-179.5	68.4	-23	0	0	0	113.7	P254 T258 F259 Q260 S324 E329 K333	P254-D256 WeakPolarHBondContact CB-OD1 3.35Å; D256-T258 PolarHBondContact O-N 2.62Å; D256-T258 VanDerWaalsContact O-N 3.11Å; D256-F259 HydrophobicContact CB-CB 4.2Å; D256-F259 PolarHBondContact O-N 3.5Å; D256-Q260 WeakPolarHBondContact O-CG 3.48Å; D256-Q260 PolarHBondContact O-N 3.23Å; D256-Q260 WeakPolarHBondContact OD1-CG 3.4Å; D256-Q260 PolarHBondContact OD1-NE2 3.25Å; D256-S324 PolarHBondContact OD2-OG 3.21Å; D256-E329 HydrophobicContact CB-CG 4.44Å; D256-K333 WeakPolarHBondContact OD1-CE 3.32Å; D256-K333 IonicContact OD1-NZ 2.66Å; D256-K333 WeakPolarHBondContact OD2-CE 3.43Å; D256-K333 IonicContact OD2-NZ 3.41Å; D256-K333 PolarHBondContact OD2-NZ 3.29Å
257	F	78.5	Confident	78.3	Confident	134 Å²	134	81.7 Å²	81.7	59%	0.588	41%	0.408	S	S	*	.	H	α-helix	trans	-52.5	-38.1	-175.2	-61.1	-70.1	0	0	0	113.8	S255 Q260 N261	S255-F257 VanDerWaalsContact O-CD2 3.31Å; S255-F257 WeakPolarHBondContact O-CD2 3.39Å; S255-F257 PolarHBondContact O-N 3.43Å; F257-Q260 PolarHBondContact O-N 3.29Å; F257-N261 WeakPolarHBondContact O-CB 3.21Å; F257-N261 VanDerWaalsContact O-CG 3.27Å; F257-N261 PolarHBondContact O-N 2.89Å; F257-N261 VanDerWaalsContact O-N 3.1Å; F257-N261 PolarHBondContact O-ND2 3.47Å; F257-N261 VanDerWaalsContact O-ND2 3.1Å
258	T	76.9	Confident	79.4	Confident	125 Å²	125	75 Å²	75	77%	0.767	39%	0.386	S	S	*	.	H	α-helix	trans	-62.2	-44.7	177.6	-51.5	0	0	0	0	111.6	D256 M262	D256-T258 PolarHBondContact O-N 2.62Å; D256-T258 VanDerWaalsContact O-N 3.11Å; T258-M262 WeakPolarHBondContact O-CG 3.36Å
259	F	79.8	Confident	80.5	Confident	11 Å²	11	71.8 Å²	71.8	5%	0.048	37%	0.365	C	S	.	.	H	α-helix	trans	-71.3	-40.5	180	-175.5	-87	0	0	0	111.3	D256 N261 M262 K267 T270 C323 E325	D256-F259 HydrophobicContact CB-CB 4.2Å; D256-F259 PolarHBondContact O-N 3.5Å; F259-N261 VanDerWaalsContact C-N 3.33Å; F259-N261 PolarHBondContact O-N 3.04Å; F259-M262 HydrophobicContact CD2-SD 4.08Å; F259-M262 WeakPolarHBondContact O-CB 3.06Å; F259-M262 PolarHBondContact O-N 2.85Å; F259-K267 HydrophobicContact CE1-CD 4.47Å; F259-K267 HydrophobicContact CE1-CG 4.31Å; F259-K267 HydrophobicContact CZ-CG 4.22Å; F259-K267 WeakPolarHBondContact O-CE 3.46Å; F259-T270 HydrophobicContact CE2-CG2 4.14Å; F259-C323 WeakPolarHBondContact CE1-O 3.47Å; F259-E325 HydrophobicContact CD2-CG 3.87Å; F259-E325 HydrophobicContact CE2-CG 4.33Å
260	Q	77.2	Confident	81.5	Confident	63 Å²	63	70.5 Å²	70.5	29%	0.294	36%	0.36	S	S	.	.	H	α-helix	trans	-60.1	-41.5	177.8	-67.9	173.2	23.6	0	0	112.5	P254 D256 F257 M262 K267	P254-Q260 PolarHBondContact O-NE2 3.42Å; D256-Q260 WeakPolarHBondContact O-CG 3.48Å; D256-Q260 PolarHBondContact O-N 3.23Å; D256-Q260 WeakPolarHBondContact OD1-CG 3.4Å; D256-Q260 PolarHBondContact OD1-NE2 3.25Å; F257-Q260 PolarHBondContact O-N 3.29Å; Q260-M262 PolarHBondContact O-N 2.81Å; Q260-K267 WeakPolarHBondContact O-CE 3.44Å; Q260-K267 PolarHBondContact O-NZ 3.35Å
261	N	80.2	Confident	82.1	Confident	138 Å²	138	66.4 Å²	66.4	74%	0.738	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-1.7	-179.9	-68.5	-29.2	0	0	0	114.1	F257 F259	F257-N261 WeakPolarHBondContact O-CB 3.21Å; F257-N261 VanDerWaalsContact O-CG 3.27Å; F257-N261 PolarHBondContact O-N 2.89Å; F257-N261 VanDerWaalsContact O-N 3.1Å; F257-N261 PolarHBondContact O-ND2 3.47Å; F257-N261 VanDerWaalsContact O-ND2 3.1Å; F259-N261 VanDerWaalsContact C-N 3.33Å; F259-N261 PolarHBondContact O-N 3.04Å
262	M	86.8	Confident	82.6	Confident	25 Å²	25	63.7 Å²	63.7	12%	0.123	32%	0.323	C	S	.	.	S	Bend	trans	-68.8	140.7	172.7	-67	174.2	67.4	0	0	110.4	T258 F259 Q260 R266 K267	T258-M262 WeakPolarHBondContact O-CG 3.36Å; F259-M262 HydrophobicContact CD2-SD 4.08Å; F259-M262 WeakPolarHBondContact O-CB 3.06Å; F259-M262 PolarHBondContact O-N 2.85Å; Q260-M262 PolarHBondContact O-N 2.81Å; M262-R266 HydrophobicContact CB-CB 4.46Å; M262-R266 HydrophobicContact CE-CB 3.38Å; M262-R266 HydrophobicContact CE-CG 4.42Å; M262-K267 HydrophobicContact CB-CG 3.99Å; M262-K267 WeakPolarHBondContact O-CE 3.49Å; M262-K267 PolarHBondContact O-NZ 2.8Å
263	N	87	Confident	82.9	Confident	80 Å²	80	69 Å²	69	43%	0.428	34%	0.336	S	S	.	.			trans	-62.3	158.9	169.7	67.3	13.3	0	0	0	111.2	K265 R266 K267	N263-K265 VanDerWaalsContact C-N 3.28Å; N263-K265 PolarHBondContact O-N 3.31Å; N263-R266 PolarHBondContact O-N 3.28Å; N263-R266 VanDerWaalsContact OD1-CB 3.29Å; N263-R266 WeakPolarHBondContact OD1-CB 3.17Å; N263-R266 WeakPolarHBondContact OD1-CG 3.17Å; N263-R266 PolarHBondContact OD1-N 3.27Å; N263-K267 PolarHBondContact O-N 3.49Å
264	S	88.3	Confident	83.3	Confident	7 Å²	7	67.5 Å²	67.5	5%	0.049	33%	0.328	C	S	.	.	H	α-helix	trans	-55	-43.7	-176.5	179	0	0	0	0	112.1	R266 K267 A268 Y319 E346 V347	S264-R266 PolarHBondContact O-N 2.71Å; S264-K267 WeakPolarHBondContact O-CB 3.45Å; S264-K267 PolarHBondContact O-N 3.26Å; S264-K267 VanDerWaalsContact O-N 3.16Å; S264-A268 PolarHBondContact O-N 3.26Å; S264-Y319 VanDerWaalsContact O-CE1 3.28Å; S264-Y319 WeakPolarHBondContact O-CE1 2.9Å; S264-Y319 WeakPolarHBondContact OG-CE1 3.28Å; S264-Y319 PolarHBondContact OG-OH 3.08Å; S264-E346 VanDerWaalsContact CB-OE1 3.26Å; S264-E346 WeakPolarHBondContact CB-OE1 3.21Å; S264-E346 PolarHBondContact N-OE1 2.91Å; S264-V347 WeakPolarHBondContact OG-CG2 3.38Å
265	K	87.8	Confident	83.3	Confident	146 Å²	146	67.7 Å²	67.7	64%	0.635	33%	0.328	S	S	*	.	H	α-helix	trans	-56.5	-48	179.2	-173.3	176.1	178.8	177.8	0	113.1	N263 K267 A268 E269	N263-K265 VanDerWaalsContact C-N 3.28Å; N263-K265 PolarHBondContact O-N 3.31Å; K265-K267 VanDerWaalsContact C-N 3.33Å; K265-K267 PolarHBondContact O-N 3.23Å; K265-A268 PolarHBondContact O-N 3.41Å; K265-E269 WeakPolarHBondContact CE-OE1 3.35Å; K265-E269 WeakPolarHBondContact O-CG 3.45Å; K265-E269 PolarHBondContact O-N 2.83Å
266	R	87.8	Confident	83.2	Confident	138 Å²	138	69.3 Å²	69.3	52%	0.521	32%	0.322	S	S	.	.	H	α-helix	trans	-70.7	-28.5	-179.6	-68.4	177.1	73.5	-164.6	1	112.7	M262 N263 S264 T270	M262-R266 HydrophobicContact CB-CB 4.46Å; M262-R266 HydrophobicContact CE-CB 3.38Å; M262-R266 HydrophobicContact CE-CG 4.42Å; N263-R266 PolarHBondContact O-N 3.28Å; N263-R266 VanDerWaalsContact OD1-CB 3.29Å; N263-R266 WeakPolarHBondContact OD1-CB 3.17Å; N263-R266 WeakPolarHBondContact OD1-CG 3.17Å; N263-R266 PolarHBondContact OD1-N 3.27Å; S264-R266 PolarHBondContact O-N 2.71Å; R266-T270 WeakPolarHBondContact O-CB 3.42Å; R266-T270 PolarHBondContact O-N 3.24Å; R266-T270 PolarHBondContact O-OG1 3.48Å
267	K	88.2	Confident	82.8	Confident	37 Å²	37	75.1 Å²	75.1	16%	0.161	35%	0.349	C	S	.	.	H	α-helix	trans	-65.3	-47.7	171.2	-72.8	176.6	178.6	160.4	0	110.5	F259 Q260 M262 N263 S264 K265 E269 T270 W271 Y319	F259-K267 HydrophobicContact CE1-CD 4.47Å; F259-K267 HydrophobicContact CE1-CG 4.31Å; F259-K267 HydrophobicContact CZ-CG 4.22Å; F259-K267 WeakPolarHBondContact O-CE 3.46Å; Q260-K267 WeakPolarHBondContact O-CE 3.44Å; Q260-K267 PolarHBondContact O-NZ 3.35Å; M262-K267 HydrophobicContact CB-CG 3.99Å; M262-K267 WeakPolarHBondContact O-CE 3.49Å; M262-K267 PolarHBondContact O-NZ 2.8Å; N263-K267 PolarHBondContact O-N 3.49Å; S264-K267 WeakPolarHBondContact O-CB 3.45Å; S264-K267 PolarHBondContact O-N 3.26Å; S264-K267 VanDerWaalsContact O-N 3.16Å; K265-K267 VanDerWaalsContact C-N 3.33Å; K265-K267 PolarHBondContact O-N 3.23Å; K267-E269 VanDerWaalsContact C-N 3.34Å; K267-E269 PolarHBondContact O-N 3.41Å; K267-T270 PolarHBondContact O-N 3.26Å; K267-W271 WeakPolarHBondContact O-CB 3.24Å; K267-W271 PolarHBondContact O-N 3.23Å; K267-Y319 HydrophobicContact CB-CD1 3.83Å; K267-Y319 HydrophobicContact CB-CD2 4.45Å; K267-Y319 HydrophobicContact CB-CE1 3.61Å; K267-Y319 HydrophobicContact CB-CE2 4.29Å; K267-Y319 HydrophobicContact CB-CG 4.24Å; K267-Y319 HydrophobicContact CD-CE1 4.45Å; K267-Y319 HydrophobicContact CD-CE2 4.1Å
268	A	87.5	Confident	82.4	Confident	11 Å²	11	70.7 Å²	70.7	9%	0.091	33%	0.331	C	S	.	.	H	α-helix	trans	-58.3	-43.2	176	0	0	0	0	0	112.4	S264 K265 W271 K272 Y319	S264-A268 PolarHBondContact O-N 3.26Å; K265-A268 PolarHBondContact O-N 3.41Å; A268-W271 PolarHBondContact O-N 2.5Å; A268-K272 WeakPolarHBondContact O-CB 3.14Å; A268-K272 WeakPolarHBondContact O-CG 3.45Å; A268-K272 PolarHBondContact O-N 3.11Å; A268-Y319 HydrophobicContact CB-CD1 3.9Å
269	E	87.4	Confident	81.8	Confident	88 Å²	88	66.3 Å²	66.3	41%	0.411	31%	0.308	S	S	.	.	H	α-helix	trans	-63.3	-43.7	176.4	-72.6	170	-173	0	0	112.4	K265 K267 R273	K265-E269 WeakPolarHBondContact CE-OE1 3.35Å; K265-E269 WeakPolarHBondContact O-CG 3.45Å; K265-E269 PolarHBondContact O-N 2.83Å; K267-E269 VanDerWaalsContact C-N 3.34Å; K267-E269 PolarHBondContact O-N 3.41Å; E269-R273 WeakPolarHBondContact O-CB 3.17Å; E269-R273 PolarHBondContact O-N 2.78Å; E269-R273 VanDerWaalsContact O-N 3.11Å
270	T	86.3	Confident	81	Confident	22 Å²	22	69.7 Å²	69.7	14%	0.135	32%	0.323	C	S	.	.	H	α-helix	trans	-65	-44.5	177.4	-56.8	0	0	0	0	111.3	F259 R266 K267 R273 N274	F259-T270 HydrophobicContact CE2-CG2 4.14Å; R266-T270 WeakPolarHBondContact O-CB 3.42Å; R266-T270 PolarHBondContact O-N 3.24Å; R266-T270 PolarHBondContact O-OG1 3.48Å; K267-T270 PolarHBondContact O-N 3.26Å; T270-R273 PolarHBondContact O-N 3.45Å; T270-N274 PolarHBondContact O-N 2.86Å; T270-N274 PolarHBondContact O-ND2 3.42Å
271	W	84.6	Confident	80.3	Confident	15 Å²	15	69.1 Å²	69.1	6%	0.057	33%	0.325	C	S	.	.	H	α-helix	trans	-56.3	-54.5	176.4	178.1	-117.7	0	0	0	111.3	K267 A268 R273 N274 R275 L278 D287 Y288 E314 P320 C323	K267-W271 WeakPolarHBondContact O-CB 3.24Å; K267-W271 PolarHBondContact O-N 3.23Å; A268-W271 PolarHBondContact O-N 2.5Å; W271-R273 VanDerWaalsContact C-N 3.33Å; W271-R273 PolarHBondContact O-N 3.04Å; W271-N274 PolarHBondContact O-N 3.17Å; W271-N274 VanDerWaalsContact O-N 3.14Å; W271-R275 WeakPolarHBondContact O-CB 3.47Å; W271-R275 PolarHBondContact O-N 3.12Å; W271-L278 HydrophobicContact CE3-CD1 4.39Å; W271-L278 HydrophobicContact CZ3-CD1 3.92Å; W271-D287 HydrophobicContact CH2-CB 4.36Å; W271-D287 WeakPolarHBondContact CH2-OD2 3.31Å; W271-Y288 WeakPolarHBondContact CZ2-OH 3.08Å; W271-E314 PolarHBondContact NE1-OE1 3.35Å; W271-P320 HydrophobicContact CD2-CG 4.33Å; W271-P320 HydrophobicContact CE3-CG 4.41Å; W271-P320 HydrophobicContact CH2-CG 3.41Å; W271-P320 VanDerWaalsContact CH2-CG 3.41Å; W271-P320 HydrophobicContact CZ2-CG 3.3Å; W271-P320 HydrophobicContact CZ3-CG 4Å; W271-C323 HydrophobicContact CE3-CB 3.82Å; W271-C323 HydrophobicContact CZ3-CB 3.9Å
272	K	85.1	Confident	78.8	Confident	49 Å²	49	66.3 Å²	66.3	21%	0.213	31%	0.313	C	S	.	.	H	α-helix	trans	-59.3	-41.4	-179.9	-75.8	172.9	-175.2	150.9	0	113.2	D182 A268 N274 R275	D182-K272 PolarHBondContact O-NZ 3.37Å; D182-K272 VanDerWaalsContact OD1-CE 3.31Å; D182-K272 WeakPolarHBondContact OD1-CE 3.36Å; D182-K272 IonicContact OD1-NZ 2.68Å; D182-K272 PolarHBondContact OD1-NZ 3.29Å; A268-K272 WeakPolarHBondContact O-CB 3.14Å; A268-K272 WeakPolarHBondContact O-CG 3.45Å; A268-K272 PolarHBondContact O-N 3.11Å; K272-N274 VanDerWaalsContact C-N 3.26Å; K272-N274 PolarHBondContact O-N 3.4Å; K272-R275 PolarHBondContact O-N 3.18Å
273	R	83.9	Confident	77.2	Confident	165 Å²	165	69 Å²	69	62%	0.623	33%	0.331	S	S	*	.	H	α-helix	trans	-59.3	-39.3	178.3	-170.8	-176.5	-59.9	117.1	5	111.9	E269 T270 W271	E269-R273 WeakPolarHBondContact O-CB 3.17Å; E269-R273 PolarHBondContact O-N 2.78Å; E269-R273 VanDerWaalsContact O-N 3.11Å; T270-R273 PolarHBondContact O-N 3.45Å; W271-R273 VanDerWaalsContact C-N 3.33Å; W271-R273 PolarHBondContact O-N 3.04Å
274	N	82.8	Confident	76.1	Confident	58 Å²	58	66.2 Å²	66.2	31%	0.31	32%	0.321	S	S	.	.	H	α-helix	trans	-93.9	-17.2	-174.9	-62.8	-19	0	0	0	113.1	T270 W271 K272 R276 Q277 L278	T270-N274 PolarHBondContact O-N 2.86Å; T270-N274 PolarHBondContact O-ND2 3.42Å; W271-N274 PolarHBondContact O-N 3.17Å; W271-N274 VanDerWaalsContact O-N 3.14Å; K272-N274 VanDerWaalsContact C-N 3.26Å; K272-N274 PolarHBondContact O-N 3.4Å; N274-R276 VanDerWaalsContact C-N 3.35Å; N274-R276 PolarHBondContact O-N 3.2Å; N274-Q277 PolarHBondContact O-N 2.99Å; N274-Q277 VanDerWaalsContact O-N 3.09Å; N274-L278 HydrophobicContact CB-CD1 4.25Å; N274-L278 WeakPolarHBondContact O-CG 3.27Å; N274-L278 PolarHBondContact O-N 3.15Å
275	R	78.8	Confident	75.1	Confident	12 Å²	12	67.1 Å²	67.1	5%	0.045	33%	0.326	C	S	.	.	H	α-helix	trans	-54.8	-43.4	-170.7	-168.1	71.4	180	139.9	11.6	113.8	M175 D216 W271 K272 L278 A279 Y288 E314	M175-R275 HydrophobicContact CE-CB 4.21Å; M175-R275 HydrophobicContact CE-CG 3.49Å; M175-R275 VanDerWaalsContact CE-CG 3.49Å; M175-R275 HydrophobicContact CG-CG 4.15Å; M175-R275 HydrophobicContact SD-CG 3.66Å; D216-R275 IonicContact OD1-NH2 2.67Å; W271-R275 WeakPolarHBondContact O-CB 3.47Å; W271-R275 PolarHBondContact O-N 3.12Å; K272-R275 PolarHBondContact O-N 3.18Å; R275-L278 WeakPolarHBondContact O-CB 3.46Å; R275-L278 PolarHBondContact O-N 3.29Å; R275-A279 PolarHBondContact O-N 3.38Å; R275-Y288 PolarHBondContact NH1-OH 3.5Å; R275-Y288 PolarHBondContact NH2-OH 3.16Å; R275-E314 IonicContact NE-OE1 2.86Å
276	R	73.2	Confident	74.8	Confident	108 Å²	108	60.2 Å²	60.2	41%	0.408	30%	0.297	S	S	.	.	H	α-helix	trans	-63.4	-44.3	178.6	-65.7	-173.2	-173.5	-147.3	-7.4	112.2	M175 M179 N274 L278 A279 F280 D411	M175-R276 HydrophobicContact CE-CG 4.24Å; M179-R276 HydrophobicContact CE-CG 4.3Å; M179-R276 HydrophobicContact SD-CG 3.89Å; N274-R276 VanDerWaalsContact C-N 3.35Å; N274-R276 PolarHBondContact O-N 3.2Å; R276-L278 VanDerWaalsContact C-N 3.27Å; R276-L278 PolarHBondContact O-N 3.38Å; R276-A279 PolarHBondContact O-N 3.04Å; R276-F280 HydrophobicContact CB-CE2 4.16Å; R276-F280 WeakPolarHBondContact O-CD2 3.49Å; R276-F280 WeakPolarHBondContact O-CE2 3.4Å; R276-F280 WeakPolarHBondContact O-CG 3.47Å; R276-F280 PolarHBondContact O-N 3.24Å; R276-D411 IonicContact CZ-OD1 3.98Å; R276-D411 IonicContact CZ-OD2 3.52Å; R276-D411 IonicContact NE-OD2 3.74Å; R276-D411 PolarHBondContact NE-OD2 3.41Å; R276-D411 IonicContact NH1-OD1 2.73Å; R276-D411 PolarHBondContact NH1-OD1 2.91Å; R276-D411 IonicContact NH1-OD2 3.73Å; R276-D411 PolarHBondContact NH1-OD2 3.15Å; R276-D411 IonicContact NH2-OD1 3.88Å; R276-D411 PolarHBondContact NH2-OD1 2.74Å; R276-D411 IonicContact NH2-OD2 2.96Å; R276-D411 PolarHBondContact NH2-OD2 3.32Å
277	Q	71.5	Confident	74.8	Confident	145 Å²	145	53.7 Å²	53.7	68%	0.678	27%	0.272	S	S	*	.	H	α-helix	trans	-64.8	-36.3	178	-65.5	-177.6	-0.8	0	0	111.4	N274 F280 S281	N274-Q277 PolarHBondContact O-N 2.99Å; N274-Q277 VanDerWaalsContact O-N 3.09Å; Q277-F280 PolarHBondContact O-N 2.88Å; Q277-S281 PolarHBondContact O-N 3.34Å; Q277-S281 VanDerWaalsContact O-N 3.16Å
278	L	69.4	Low	75.1	Confident	41 Å²	41	52.5 Å²	52.5	22%	0.215	27%	0.267	C	S	.	.	H	α-helix	trans	-64.6	-41.4	175.4	-72	166.5	0	0	0	112.2	W271 N274 R275 R276 F280 S281 T285	W271-L278 HydrophobicContact CE3-CD1 4.39Å; W271-L278 HydrophobicContact CZ3-CD1 3.92Å; N274-L278 HydrophobicContact CB-CD1 4.25Å; N274-L278 WeakPolarHBondContact O-CG 3.27Å; N274-L278 PolarHBondContact O-N 3.15Å; R275-L278 WeakPolarHBondContact O-CB 3.46Å; R275-L278 PolarHBondContact O-N 3.29Å; R276-L278 VanDerWaalsContact C-N 3.27Å; R276-L278 PolarHBondContact O-N 3.38Å; L278-F280 VanDerWaalsContact C-N 3.3Å; L278-F280 PolarHBondContact O-N 3Å; L278-S281 WeakPolarHBondContact O-CB 3.23Å; L278-S281 PolarHBondContact O-N 3.32Å; L278-T285 HydrophobicContact CD2-CG2 3.42Å; L278-T285 VanDerWaalsContact CD2-CG2 3.42Å
279	A	65.3	Low	75.2	Confident	34 Å²	34	54.2 Å²	54.2	28%	0.281	27%	0.274	S	S	.	.	H	α-helix	trans	-63.2	-33.8	176.9	0	0	0	0	0	112.9	M175 R275 R276	M175-A279 HydrophobicContact CE-CB 3.93Å; M175-A279 HydrophobicContact SD-CB 4.06Å; R275-A279 PolarHBondContact O-N 3.38Å; R276-A279 PolarHBondContact O-N 3.04Å
280	F	62.2	Low	75.4	Confident	82 Å²	82	50.1 Å²	50.1	36%	0.36	26%	0.255	S	S	.	.	H	α-helix	trans	-86.3	-7.5	177.6	-54.3	-44.8	0	0	0	114.2	R97 R276 Q277 L278 F413	R97-F280 HydrophobicContact CB-CD1 4.27Å; R97-F280 HydrophobicContact CB-CE1 4.29Å; R97-F280 WeakPolarHBondContact O-CD1 3.27Å; R97-F280 WeakPolarHBondContact O-CE1 3.39Å; R276-F280 HydrophobicContact CB-CE2 4.16Å; R276-F280 WeakPolarHBondContact O-CD2 3.49Å; R276-F280 WeakPolarHBondContact O-CE2 3.4Å; R276-F280 WeakPolarHBondContact O-CG 3.47Å; R276-F280 PolarHBondContact O-N 3.24Å; Q277-F280 PolarHBondContact O-N 2.88Å; L278-F280 VanDerWaalsContact C-N 3.3Å; L278-F280 PolarHBondContact O-N 3Å; F280-F413 AromaticContact CE1-CE1 3.65Å; F280-F413 HydrophobicContact CE1-CE1 3.65Å; F280-F413 AromaticContact CE1-CZ 3.98Å; F280-F413 HydrophobicContact CE1-CZ 3.98Å; F280-F413 HydrophobicContact CE2-CE1 4.23Å; F280-F413 AromaticContact CZ-CE1 3.36Å; F280-F413 HydrophobicContact CZ-CE1 3.36Å; F280-F413 AromaticContact CZ-CZ 3.72Å; F280-F413 HydrophobicContact CZ-CZ 3.72Å
281	S	61.9	Low	75.7	Confident	50 Å²	50	49.6 Å²	49.6	35%	0.35	25%	0.252	S	S	.	.			trans	-75.3	135.9	-177.8	179	0	0	0	0	111.7	Q277 L278 V283 G284	Q277-S281 PolarHBondContact O-N 3.34Å; Q277-S281 VanDerWaalsContact O-N 3.16Å; L278-S281 WeakPolarHBondContact O-CB 3.23Å; L278-S281 PolarHBondContact O-N 3.32Å; S281-V283 VanDerWaalsContact C-N 3.25Å; S281-V283 PolarHBondContact O-N 2.99Å; S281-V283 PolarHBondContact OG-N 3.43Å; S281-G284 PolarHBondContact OG-N 3.36Å
282	T	49	Very low	76	Confident	79 Å²	79	49 Å²	49	49%	0.485	25%	0.25	S	C	.	.	S	Bend	trans	-68.9	-24.9	172.7	52.1	0	0	0	0	113.1	A99	A99-T282 HydrophobicContact CB-CG2 3.7Å
283	V	53.7	Low	76	Confident	81 Å²	81	48.4 Å²	48.4	49%	0.491	25%	0.25	S	C	.	.	S	Bend	trans	-86.4	-32.1	-177.9	-176.3	0	0	0	0	110.4	F245 S281	F245-V283 HydrophobicContact CE2-CG1 4.42Å; F245-V283 HydrophobicContact CZ-CG1 4.32Å; S281-V283 VanDerWaalsContact C-N 3.25Å; S281-V283 PolarHBondContact O-N 2.99Å; S281-V283 PolarHBondContact OG-N 3.43Å
284	G	62.5	Low	75.9	Confident	22 Å²	22	41.3 Å²	41.3	23%	0.227	22%	0.224	C	C	.	.			trans	58.1	-173.5	-173.5	0	0	0	0	0	113	S281	S281-G284 PolarHBondContact OG-N 3.36Å
285	T	67.3	Low	75.8	Confident	26 Å²	26	43 Å²	43	16%	0.16	23%	0.231	C	C	.	.			trans	-122.2	143	167.4	39.7	0	0	0	0	109.6	L278 D287 P327	L278-T285 HydrophobicContact CD2-CG2 3.42Å; L278-T285 VanDerWaalsContact CD2-CG2 3.42Å; T285-D287 WeakPolarHBondContact CB-OD2 3.08Å; T285-D287 PolarHBondContact O-N 3.39Å; T285-D287 PolarHBondContact OG1-OD2 3.15Å; T285-P327 HydrophobicContact CG2-CB 4.36Å; T285-P327 HydrophobicContact CG2-CG 3.92Å
286	P	83	Confident	75.3	Confident	2 Å²	2	50.7 Å²	50.7	1%	0.013	27%	0.267	C	S	.	.			trans	-77.7	23.5	-175.2	31.8	-34.5	0	0	0	113.7	Y246 Y288 I289 F294 T330	Y246-P286 WeakPolarHBondContact OH-CG 3.43Å; P286-Y288 VanDerWaalsContact C-N 3.25Å; P286-Y288 PolarHBondContact O-N 3.28Å; P286-Y288 VanDerWaalsContact O-N 3.16Å; P286-I289 HydrophobicContact CB-CB 4.4Å; P286-I289 HydrophobicContact CB-CD1 4.04Å; P286-I289 HydrophobicContact CB-CG1 4.4Å; P286-I289 PolarHBondContact O-N 3.22Å; P286-F294 HydrophobicContact CB-CE1 4.38Å; P286-F294 HydrophobicContact CB-CE2 4.4Å; P286-F294 HydrophobicContact CB-CZ 3.57Å; P286-T330 HydrophobicContact CG-CG2 3.73Å
287	D	87.9	Confident	75.2	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-35.2	-168.6	-62.5	-69	0	0	0	113.4	W271 T285 V310 P320 C323 T330	W271-D287 HydrophobicContact CH2-CB 4.36Å; W271-D287 WeakPolarHBondContact CH2-OD2 3.31Å; T285-D287 WeakPolarHBondContact CB-OD2 3.08Å; T285-D287 PolarHBondContact O-N 3.39Å; T285-D287 PolarHBondContact OG1-OD2 3.15Å; D287-V310 VanDerWaalsContact O-CG1 3.31Å; D287-V310 WeakPolarHBondContact O-CG1 2.81Å; D287-P320 HydrophobicContact CB-CB 4.22Å; D287-P320 HydrophobicContact CB-CG 3.93Å; D287-C323 VanDerWaalsContact OD1-CA 3.31Å; D287-C323 WeakPolarHBondContact OD1-CA 3.33Å; D287-T330 HydrophobicContact CB-CG2 4.41Å; D287-T330 WeakPolarHBondContact OD1-CG2 2.85Å
288	Y	92.8	Very high	75.1	Confident	13 Å²	13	44 Å²	44	5%	0.051	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-4.6	-178.4	-49.9	-87.5	0	0	0	113.2	I213 K214 P215 W271 R275 P286 S307 V310 I311 E314 P320	I213-Y288 WeakPolarHBondContact O-CB 3.16Å; K214-Y288 HydrophobicContact CB-CD1 4.31Å; K214-Y288 HydrophobicContact CB-CD2 3.7Å; K214-Y288 HydrophobicContact CB-CE2 3.98Å; K214-Y288 HydrophobicContact CB-CG 3.9Å; P215-Y288 HydrophobicContact CG-CE1 4.17Å; W271-Y288 WeakPolarHBondContact CZ2-OH 3.08Å; R275-Y288 PolarHBondContact NH1-OH 3.5Å; R275-Y288 PolarHBondContact NH2-OH 3.16Å; P286-Y288 VanDerWaalsContact C-N 3.25Å; P286-Y288 PolarHBondContact O-N 3.28Å; P286-Y288 VanDerWaalsContact O-N 3.16Å; Y288-S307 WeakPolarHBondContact O-CA 3.4Å; Y288-S307 WeakPolarHBondContact O-CB 3.21Å; Y288-S307 PolarHBondContact O-OG 3.01Å; Y288-V310 HydrophobicContact CD1-CB 3.94Å; Y288-V310 HydrophobicContact CD1-CG1 3.37Å; Y288-V310 HydrophobicContact CE1-CG1 3.72Å; Y288-V310 HydrophobicContact CG-CG1 4.11Å; Y288-I311 HydrophobicContact CD1-CG1 3.9Å; Y288-I311 HydrophobicContact CE1-CG1 3.97Å; Y288-E314 WeakPolarHBondContact CE1-OE2 3.28Å; Y288-E314 PolarHBondContact OH-OE1 2.84Å; Y288-E314 PolarHBondContact OH-OE2 3.27Å; Y288-P320 HydrophobicContact CE1-CB 4.41Å
289	I	90.3	Very high	75.6	Confident	47 Å²	47	44 Å²	44	24%	0.241	25%	0.249	C	C	.	.			trans	-81.8	127	-172.9	-56.9	-179	0	0	0	109.8	P286 V293 F294 V334	P286-I289 HydrophobicContact CB-CB 4.4Å; P286-I289 HydrophobicContact CB-CD1 4.04Å; P286-I289 HydrophobicContact CB-CG1 4.4Å; P286-I289 PolarHBondContact O-N 3.22Å; I289-V293 HydrophobicContact CG2-CB 3.65Å; I289-V293 HydrophobicContact CG2-CG1 3.77Å; I289-V293 HydrophobicContact CG2-CG2 4.11Å; I289-F294 HydrophobicContact CB-CE2 3.81Å; I289-F294 HydrophobicContact CB-CZ 3.72Å; I289-F294 HydrophobicContact CD1-CZ 4.05Å; I289-F294 HydrophobicContact CG1-CZ 4.47Å; I289-F294 HydrophobicContact CG2-CD2 4.22Å; I289-F294 HydrophobicContact CG2-CE1 4.31Å; I289-F294 HydrophobicContact CG2-CE2 3.41Å; I289-F294 VanDerWaalsContact CG2-CE2 3.41Å; I289-F294 HydrophobicContact CG2-CZ 3.44Å; I289-F294 VanDerWaalsContact CG2-CZ 3.44Å; I289-V334 WeakPolarHBondContact O-CG1 3.37Å
290	A	92.1	Very high	76.7	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.008	25%	0.248	C	C	.	.			trans	-63.8	145.1	177.3	0	0	0	0	0	112.3	E292 V293 C303 W306	A290-E292 VanDerWaalsContact C-N 3.28Å; A290-E292 WeakPolarHBondContact CB-OE1 3.4Å; A290-E292 WeakPolarHBondContact CB-OE2 3.44Å; A290-E292 PolarHBondContact O-N 3.28Å; A290-V293 HydrophobicContact CB-CG2 4.16Å; A290-V293 WeakPolarHBondContact O-CB 3.44Å; A290-V293 PolarHBondContact O-N 3.31Å; A290-C303 HydrophobicContact CB-CB 3.79Å; A290-W306 VanDerWaalsContact CA-CD1 3.44Å; A290-W306 HydrophobicContact CB-CB 3.63Å; A290-W306 HydrophobicContact CB-CD2 4.14Å; A290-W306 HydrophobicContact CB-CG 3.57Å
291	P	92.5	Very high	78.1	Confident	11 Å²	11	44.8 Å²	44.8	7%	0.071	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-58.8	-38.4	-175.7	22.4	-33.1	0	0	0	112.5	V293 F294 W306 V334 M335	P291-V293 PolarHBondContact O-N 3.31Å; P291-V293 VanDerWaalsContact O-N 3.16Å; P291-F294 PolarHBondContact O-N 3.03Å; P291-F294 VanDerWaalsContact O-N 3.09Å; P291-W306 HydrophobicContact CG-CE3 4.35Å; P291-W306 HydrophobicContact CG-CH2 3.98Å; P291-W306 HydrophobicContact CG-CZ2 4.34Å; P291-W306 HydrophobicContact CG-CZ3 3.97Å; P291-V334 HydrophobicContact CB-CG1 4.18Å; P291-M335 HydrophobicContact CB-CE 4.14Å; P291-M335 WeakPolarHBondContact O-CE 3.49Å
292	E	90.3	Very high	79.7	Confident	4 Å²	4	42.9 Å²	42.9	2%	0.019	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-64.8	-19.7	-179.7	68.7	-85.5	-168.6	0	0	114	A290 F294 M295 W364 R367	A290-E292 VanDerWaalsContact C-N 3.28Å; A290-E292 WeakPolarHBondContact CB-OE1 3.4Å; A290-E292 WeakPolarHBondContact CB-OE2 3.44Å; A290-E292 PolarHBondContact O-N 3.28Å; E292-F294 PolarHBondContact O-N 3.41Å; E292-M295 HydrophobicContact CB-SD 4.48Å; E292-M295 PolarHBondContact O-N 3.3Å; E292-M295 VanDerWaalsContact O-N 3.08Å; E292-W364 HydrophobicContact CG-CB 4.38Å; E292-R367 IonicContact OE1-CZ 2.82Å; E292-R367 IonicContact OE1-NH1 3.55Å; E292-R367 PolarHBondContact OE1-NH1 3.33Å; E292-R367 IonicContact OE1-NH2 3.01Å; E292-R367 PolarHBondContact OE1-NH2 3.06Å; E292-R367 IonicContact OE2-CZ 3.72Å; E292-R367 IonicContact OE2-NH1 2.63Å; E292-R367 IonicContact OE2-NH2 3.03Å; E292-R367 PolarHBondContact OE2-NH2 2.86Å
293	V	85.6	Confident	81.9	Confident	35 Å²	35	39.2 Å²	39.2	21%	0.212	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-67	-27.9	176.1	178.1	0	0	0	0	111	I289 A290 P291 Y299 C303	I289-V293 HydrophobicContact CG2-CB 3.65Å; I289-V293 HydrophobicContact CG2-CG1 3.77Å; I289-V293 HydrophobicContact CG2-CG2 4.11Å; A290-V293 HydrophobicContact CB-CG2 4.16Å; A290-V293 WeakPolarHBondContact O-CB 3.44Å; A290-V293 PolarHBondContact O-N 3.31Å; P291-V293 PolarHBondContact O-N 3.31Å; P291-V293 VanDerWaalsContact O-N 3.16Å; V293-Y299 HydrophobicContact CB-CD1 4.46Å; V293-Y299 HydrophobicContact CG1-CD1 4.48Å; V293-Y299 HydrophobicContact CG1-CE1 4.34Å; V293-Y299 HydrophobicContact CG2-CD1 4.32Å; V293-Y299 HydrophobicContact CG2-CD2 4.19Å; V293-Y299 HydrophobicContact CG2-CG 4.03Å; V293-C303 HydrophobicContact CG2-CB 3.86Å
294	F	81.3	Confident	83.9	Confident	17 Å²	17	35.3 Å²	35.3	8%	0.075	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-85.7	-12.2	174.4	-55.7	-77.6	0	0	0	112.9	T243 Y246 P286 I289 P291 E292 Y331 V334 M335	T243-F294 WeakPolarHBondContact CG2-O 3.5Å; Y246-F294 AromaticContact CD2-CD1 3.92Å; Y246-F294 HydrophobicContact CD2-CD1 3.92Å; Y246-F294 AromaticContact CD2-CE1 3.8Å; Y246-F294 HydrophobicContact CD2-CE1 3.8Å; Y246-F294 HydrophobicContact CE2-CD1 4.29Å; Y246-F294 AromaticContact CE2-CE1 3.68Å; Y246-F294 HydrophobicContact CE2-CE1 3.68Å; P286-F294 HydrophobicContact CB-CE1 4.38Å; P286-F294 HydrophobicContact CB-CE2 4.4Å; P286-F294 HydrophobicContact CB-CZ 3.57Å; I289-F294 HydrophobicContact CB-CE2 3.81Å; I289-F294 HydrophobicContact CB-CZ 3.72Å; I289-F294 HydrophobicContact CD1-CZ 4.05Å; I289-F294 HydrophobicContact CG1-CZ 4.47Å; I289-F294 HydrophobicContact CG2-CD2 4.22Å; I289-F294 HydrophobicContact CG2-CE1 4.31Å; I289-F294 HydrophobicContact CG2-CE2 3.41Å; I289-F294 VanDerWaalsContact CG2-CE2 3.41Å; I289-F294 HydrophobicContact CG2-CZ 3.44Å; I289-F294 VanDerWaalsContact CG2-CZ 3.44Å; P291-F294 PolarHBondContact O-N 3.03Å; P291-F294 VanDerWaalsContact O-N 3.09Å; E292-F294 PolarHBondContact O-N 3.41Å; F294-Y331 HydrophobicContact CB-CE2 3.98Å; F294-Y331 HydrophobicContact CD1-CD2 4.06Å; F294-Y331 AromaticContact CD1-CE2 3.89Å; F294-Y331 HydrophobicContact CD1-CE2 3.89Å; F294-Y331 HydrophobicContact CD2-CD2 4.39Å; F294-Y331 HydrophobicContact CD2-CE2 4.3Å; F294-Y331 HydrophobicContact CE1-CD2 4.19Å; F294-Y331 HydrophobicContact CE1-CE2 4.48Å; F294-Y331 HydrophobicContact CE2-CD2 4.48Å; F294-Y331 HydrophobicContact CG-CD2 4.16Å; F294-Y331 AromaticContact CG-CE2 3.79Å; F294-Y331 HydrophobicContact CG-CE2 3.79Å; F294-Y331 HydrophobicContact CZ-CD2 4.39Å; F294-V334 HydrophobicContact CE2-CG1 4.35Å; F294-M335 HydrophobicContact CB-CE 3.47Å; F294-M335 VanDerWaalsContact CB-CE 3.47Å; F294-M335 HydrophobicContact CD2-CE 3.21Å; F294-M335 HydrophobicContact CE2-CE 4.16Å; F294-M335 HydrophobicContact CG-CE 3.6Å
295	M	80.3	Confident	85.6	Confident	93 Å²	93	34.4 Å²	34.4	46%	0.458	18%	0.178	S	C	.	.	S	Bend	trans	-86	142	-177.4	-60.1	177.9	82.3	0	0	111	E292 T297 G298	E292-M295 HydrophobicContact CB-SD 4.48Å; E292-M295 PolarHBondContact O-N 3.3Å; E292-M295 VanDerWaalsContact O-N 3.08Å; M295-T297 WeakPolarHBondContact CB-OG1 3.34Å; M295-T297 PolarHBondContact O-N 3.19Å; M295-G298 PolarHBondContact O-N 3.43Å
296	Q	68.9	Low	87	Confident	173 Å²	173	33.2 Å²	33.2	81%	0.808	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-9.6	179	-64	-176.3	2.4	0	0	113.4	G298	Q296-G298 PolarHBondContact O-N 3.24Å
297	T	71.1	Confident	87.7	Confident	99 Å²	99	33.3 Å²	33.3	61%	0.607	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-21.9	176.6	49.2	0	0	0	0	112	K239 M295	K239-T297 PolarHBondContact NZ-O 3.47Å; M295-T297 WeakPolarHBondContact CB-OG1 3.34Å; M295-T297 PolarHBondContact O-N 3.19Å
298	G	69.8	Low	88.2	Confident	15 Å²	15	33.3 Å²	33.3	16%	0.155	17%	0.171	C	C	.	.			trans	90.1	167.6	-172.8	0	0	0	0	0	111.6	M295 Q296	M295-G298 PolarHBondContact O-N 3.43Å; Q296-G298 PolarHBondContact O-N 3.24Å
299	Y	80.4	Confident	88.5	Confident	39 Å²	39	32.7 Å²	32.7	15%	0.153	17%	0.169	C	C	.	.			trans	-137.8	167.8	-178	63.1	-85.8	0	0	0	109.9	R211 A240 V293 C303	R211-Y299 WeakPolarHBondContact CD-OH 3.19Å; R211-Y299 HydrophobicContact CG-CE2 4.14Å; R211-Y299 PolarHBondContact NE-OH 2.68Å; R211-Y299 VanDerWaalsContact NE-OH 3.12Å; R211-Y299 PolarHBondContact NH1-OH 2.84Å; A240-Y299 WeakPolarHBondContact CB-OH 3.37Å; A240-Y299 PolarHBondContact N-OH 2.92Å; V293-Y299 HydrophobicContact CB-CD1 4.46Å; V293-Y299 HydrophobicContact CG1-CD1 4.48Å; V293-Y299 HydrophobicContact CG1-CE1 4.34Å; V293-Y299 HydrophobicContact CG2-CD1 4.32Å; V293-Y299 HydrophobicContact CG2-CD2 4.19Å; V293-Y299 HydrophobicContact CG2-CG 4.03Å; Y299-C303 HydrophobicContact CD2-CB 4.43Å
300	N	88.5	Confident	88.9	Confident	49 Å²	49	30.5 Å²	30.5	26%	0.262	16%	0.157	S	C	.	.			trans	-130	-169.1	-179.5	64.3	27.7	0	0	0	110.3	L302 C303	N300-L302 PolarHBondContact O-N 2.7Å; N300-L302 VanDerWaalsContact O-N 3.08Å; N300-L302 WeakPolarHBondContact OD1-CB 3.32Å; N300-L302 WeakPolarHBondContact OD1-CG 3.39Å; N300-L302 PolarHBondContact OD1-N 3.03Å; N300-C303 PolarHBondContact O-N 3.11Å; N300-C303 PolarHBondContact O-SG 2.77Å
301	K	91.7	Very high	89.2	Confident	84 Å²	84	30.4 Å²	30.4	37%	0.365	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-17.8	-177.7	71.6	179.5	-174	163.8	0	114.7	H204 I209 C303 D304	H204-K301 HydrophobicContact CB-CD 4.14Å; H204-K301 PolarHBondContact CE1-O 3.45Å; I209-K301 HydrophobicContact CD1-CB 4.13Å; I209-K301 HydrophobicContact CG1-CB 3.85Å; K301-C303 PolarHBondContact O-N 3.3Å; K301-D304 PolarHBondContact O-N 2.85Å
302	L	95.1	Very high	89.5	Confident	10 Å²	10	29.9 Å²	29.9	5%	0.052	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-14	-178.1	-53.3	177.3	0	0	0	113	N300 D304 W305 W306 W364 R367 G369 A370	N300-L302 PolarHBondContact O-N 2.7Å; N300-L302 VanDerWaalsContact O-N 3.08Å; N300-L302 WeakPolarHBondContact OD1-CB 3.32Å; N300-L302 WeakPolarHBondContact OD1-CG 3.39Å; N300-L302 PolarHBondContact OD1-N 3.03Å; L302-D304 PolarHBondContact O-N 2.95Å; L302-W305 WeakPolarHBondContact O-CB 2.98Å; L302-W305 PolarHBondContact O-N 3.27Å; L302-W305 VanDerWaalsContact O-N 3.12Å; L302-W306 PolarHBondContact O-N 3.32Å; L302-W364 HydrophobicContact CD1-CE3 4.41Å; L302-W364 WeakPolarHBondContact CD1-O 3.44Å; L302-R367 WeakPolarHBondContact O-CD 3.16Å; L302-R367 PolarHBondContact O-NH1 3.4Å; L302-G369 WeakPolarHBondContact CD2-O 3.37Å; L302-A370 HydrophobicContact CD1-CB 3.83Å; L302-A370 HydrophobicContact CD2-CB 4.5Å
303	C	93.8	Very high	89.9	Confident	2 Å²	2	30 Å²	30	1%	0.014	15%	0.154	C	C	.	.	H	α-helix	trans	-63	-27.9	174.9	65.3	0	0	0	0	112.7	A290 V293 Y299 N300 K301 W305 W306 S307	A290-C303 HydrophobicContact CB-CB 3.79Å; V293-C303 HydrophobicContact CG2-CB 3.86Å; Y299-C303 HydrophobicContact CD2-CB 4.43Å; N300-C303 PolarHBondContact O-N 3.11Å; N300-C303 PolarHBondContact O-SG 2.77Å; K301-C303 PolarHBondContact O-N 3.3Å; C303-W305 VanDerWaalsContact C-N 3.31Å; C303-W305 PolarHBondContact O-N 2.97Å; C303-W306 WeakPolarHBondContact O-CB 3.33Å; C303-W306 PolarHBondContact O-N 2.78Å; C303-S307 PolarHBondContact O-N 3.47Å; C303-S307 PolarHBondContact O-OG 2.73Å
304	D	96	Very high	90.5	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-68.5	-32.9	175.2	-66.1	-23.9	0	0	0	111	I200 H204 I209 H210 R211 I213 K301 L302 S307 L308	I200-D304 HydrophobicContact CD1-CB 4.5Å; I200-D304 HydrophobicContact CG2-CB 3.84Å; H204-D304 IonicContact CD2-OD2 3.89Å; H204-D304 IonicContact CE1-OD2 3.22Å; H204-D304 IonicContact NE2-OD2 2.96Å; H204-D304 PolarHBondContact NE2-OD2 3.48Å; I209-D304 WeakPolarHBondContact CG2-OD2 3.35Å; H210-D304 PolarHBondContact N-OD2 3.43Å; R211-D304 WeakPolarHBondContact CA-OD1 3.24Å; R211-D304 PolarHBondContact N-OD1 2.87Å; I213-D304 HydrophobicContact CG1-CB 4.09Å; K301-D304 PolarHBondContact O-N 2.85Å; L302-D304 PolarHBondContact O-N 2.95Å; D304-S307 WeakPolarHBondContact O-CB 3.49Å; D304-S307 PolarHBondContact O-N 3.33Å; D304-L308 PolarHBondContact O-N 3.12Å
305	W	98.3	Very high	91.3	Very high	3 Å²	3	27.9 Å²	27.9	1%	0.011	14%	0.142	C	C	.	.	H	α-helix	trans	-70.2	-34.4	175.5	-57.7	139.7	0	0	0	113.3	V197 I200 D201 H204 L302 C303 S307 L308 G309 F360 I376	V197-W305 HydrophobicContact CB-CZ3 4.45Å; V197-W305 HydrophobicContact CG1-CH2 4.32Å; V197-W305 HydrophobicContact CG1-CZ3 4.43Å; V197-W305 HydrophobicContact CG2-CZ3 4.33Å; I200-W305 HydrophobicContact CB-CE3 4.42Å; I200-W305 HydrophobicContact CB-CH2 3.61Å; I200-W305 HydrophobicContact CB-CZ3 3.55Å; I200-W305 HydrophobicContact CD1-CE3 4.16Å; I200-W305 HydrophobicContact CD1-CZ3 3.86Å; I200-W305 HydrophobicContact CG1-CZ3 4.3Å; I200-W305 HydrophobicContact CG2-CD2 4.4Å; I200-W305 HydrophobicContact CG2-CE3 3.98Å; I200-W305 HydrophobicContact CG2-CH2 3.39Å; I200-W305 HydrophobicContact CG2-CZ2 3.86Å; I200-W305 HydrophobicContact CG2-CZ3 3.46Å; I200-W305 VanDerWaalsContact CG2-CZ3 3.46Å; D201-W305 HydrophobicContact CB-CH2 4.28Å; H204-W305 AromaticContact ND1-CZ2 3.98Å; L302-W305 WeakPolarHBondContact O-CB 2.98Å; L302-W305 PolarHBondContact O-N 3.27Å; L302-W305 VanDerWaalsContact O-N 3.12Å; C303-W305 VanDerWaalsContact C-N 3.31Å; C303-W305 PolarHBondContact O-N 2.97Å; W305-S307 VanDerWaalsContact C-N 3.33Å; W305-L308 HydrophobicContact CE3-CD2 3.94Å; W305-L308 HydrophobicContact CZ3-CD2 4.02Å; W305-L308 PolarHBondContact O-N 3.21Å; W305-G309 PolarHBondContact O-N 2.85Å; W305-G309 VanDerWaalsContact O-N 3.11Å; W305-F360 HydrophobicContact CB-CD1 4.06Å; W305-F360 HydrophobicContact CB-CE1 4.33Å; W305-F360 WeakPolarHBondContact O-CD1 3.47Å; W305-I376 HydrophobicContact CD2-CD1 3.66Å; W305-I376 HydrophobicContact CE3-CD1 3.88Å; W305-I376 HydrophobicContact CG-CD1 4.17Å; W305-I376 HydrophobicContact CH2-CD1 4.1Å; W305-I376 HydrophobicContact CZ2-CD1 3.88Å; W305-I376 HydrophobicContact CZ3-CD1 4.1Å
306	W	98.2	Very high	92.2	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-59.5	-49.2	169.6	173.7	-79.6	0	0	0	110.7	A290 P291 L302 C303 L308 G309 V310 F322 W337 C361	A290-W306 VanDerWaalsContact CA-CD1 3.44Å; A290-W306 HydrophobicContact CB-CB 3.63Å; A290-W306 HydrophobicContact CB-CD2 4.14Å; A290-W306 HydrophobicContact CB-CG 3.57Å; P291-W306 HydrophobicContact CG-CE3 4.35Å; P291-W306 HydrophobicContact CG-CH2 3.98Å; P291-W306 HydrophobicContact CG-CZ2 4.34Å; P291-W306 HydrophobicContact CG-CZ3 3.97Å; L302-W306 PolarHBondContact O-N 3.32Å; C303-W306 WeakPolarHBondContact O-CB 3.33Å; C303-W306 PolarHBondContact O-N 2.78Å; W306-L308 PolarHBondContact O-N 3.23Å; W306-G309 WeakPolarHBondContact O-CA 3.31Å; W306-G309 PolarHBondContact O-N 3.37Å; W306-V310 WeakPolarHBondContact O-CG2 3.42Å; W306-V310 PolarHBondContact O-N 3.42Å; W306-F322 HydrophobicContact CH2-CE2 4.42Å; W306-F322 HydrophobicContact CH2-CZ 4.2Å; W306-F322 AromaticContact CZ2-CE2 3.5Å; W306-F322 HydrophobicContact CZ2-CE2 3.5Å; W306-F322 AromaticContact CZ2-CZ 3.7Å; W306-F322 HydrophobicContact CZ2-CZ 3.7Å; W306-W337 HydrophobicContact CH2-CB 3.74Å; W306-W337 AromaticContact CH2-CD1 3.8Å; W306-W337 HydrophobicContact CH2-CD2 4Å; W306-W337 AromaticContact CH2-CG 3.56Å; W306-W337 HydrophobicContact CH2-CG 3.56Å; W306-W337 HydrophobicContact CZ2-CB 4.34Å; W306-W337 HydrophobicContact CZ3-CD2 4.32Å; W306-W337 HydrophobicContact CZ3-CG 4.29Å; W306-C361 HydrophobicContact CD2-CB 4.49Å; W306-C361 VanDerWaalsContact CE3-CA 3.49Å; W306-C361 HydrophobicContact CE3-CB 4.18Å; W306-C361 HydrophobicContact CH2-CB 4.17Å; W306-C361 VanDerWaalsContact CZ3-CA 3.5Å; W306-C361 HydrophobicContact CZ3-CB 4.02Å
307	S	97.6	Very high	93.6	Very high	5 Å²	5	16.2 Å²	16.2	4%	0.035	9%	0.087	C	C	.	.	H	α-helix	trans	-57.7	-40.6	-180	-49.3	0	0	0	0	111.1	I213 Y288 C303 D304 W305 G309 V310 I311	I213-S307 WeakPolarHBondContact O-CB 3.26Å; Y288-S307 WeakPolarHBondContact O-CA 3.4Å; Y288-S307 WeakPolarHBondContact O-CB 3.21Å; Y288-S307 PolarHBondContact O-OG 3.01Å; C303-S307 PolarHBondContact O-N 3.47Å; C303-S307 PolarHBondContact O-OG 2.73Å; D304-S307 WeakPolarHBondContact O-CB 3.49Å; D304-S307 PolarHBondContact O-N 3.33Å; W305-S307 VanDerWaalsContact C-N 3.33Å; S307-G309 PolarHBondContact O-N 3.15Å; S307-V310 WeakPolarHBondContact O-CB 3.43Å; S307-V310 PolarHBondContact O-N 3.34Å; S307-I311 WeakPolarHBondContact O-CG1 3.47Å; S307-I311 PolarHBondContact O-N 3.11Å
308	L	98.6	Very high	94.8	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-63.3	-38.8	175	-173.1	60.5	0	0	0	112.9	I193 T196 V197 I200 D304 W305 W306 I311 M312 F360	I193-L308 HydrophobicContact CD1-CD1 3.6Å; I193-L308 HydrophobicContact CD1-CG 4.26Å; I193-L308 HydrophobicContact CG2-CD1 4.39Å; I193-L308 HydrophobicContact CG2-CD2 4.21Å; I193-L308 HydrophobicContact CG2-CG 4.28Å; T196-L308 HydrophobicContact CG2-CD1 3.56Å; V197-L308 HydrophobicContact CG2-CD2 3.55Å; I200-L308 HydrophobicContact CD1-CB 4.34Å; I200-L308 HydrophobicContact CD1-CD2 4.31Å; D304-L308 PolarHBondContact O-N 3.12Å; W305-L308 HydrophobicContact CE3-CD2 3.94Å; W305-L308 HydrophobicContact CZ3-CD2 4.02Å; W305-L308 PolarHBondContact O-N 3.21Å; W306-L308 PolarHBondContact O-N 3.23Å; L308-I311 PolarHBondContact O-N 3.34Å; L308-M312 WeakPolarHBondContact O-CB 3.33Å; L308-M312 PolarHBondContact O-N 3.06Å; L308-F360 HydrophobicContact CD2-CE1 4.34Å; L308-F360 HydrophobicContact CD2-CZ 3.96Å; L308-F360 HydrophobicContact CG-CZ 4.41Å
309	G	98.7	Very high	96	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-63	-39.7	173	0	0	0	0	0	113.3	W305 W306 S307 M312 Y313	W305-G309 PolarHBondContact O-N 2.85Å; W305-G309 VanDerWaalsContact O-N 3.11Å; W306-G309 WeakPolarHBondContact O-CA 3.31Å; W306-G309 PolarHBondContact O-N 3.37Å; S307-G309 PolarHBondContact O-N 3.15Å; G309-M312 PolarHBondContact O-N 3.21Å; G309-Y313 PolarHBondContact O-N 3.14Å
310	V	98.6	Very high	96.7	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-62.6	-43.1	173.7	177.3	0	0	0	0	110.7	D287 Y288 W306 S307 Y313 E314 P320 P321 F322	D287-V310 VanDerWaalsContact O-CG1 3.31Å; D287-V310 WeakPolarHBondContact O-CG1 2.81Å; Y288-V310 HydrophobicContact CD1-CB 3.94Å; Y288-V310 HydrophobicContact CD1-CG1 3.37Å; Y288-V310 HydrophobicContact CE1-CG1 3.72Å; Y288-V310 HydrophobicContact CG-CG1 4.11Å; W306-V310 WeakPolarHBondContact O-CG2 3.42Å; W306-V310 PolarHBondContact O-N 3.42Å; S307-V310 WeakPolarHBondContact O-CB 3.43Å; S307-V310 PolarHBondContact O-N 3.34Å; V310-Y313 PolarHBondContact O-N 3.4Å; V310-E314 PolarHBondContact O-N 3.09Å; V310-P320 HydrophobicContact CG1-CB 3.63Å; V310-P321 HydrophobicContact CG1-CG 4.36Å; V310-P321 HydrophobicContact CG2-CG 4.4Å; V310-F322 HydrophobicContact CG2-CE2 4.13Å
311	I	98.6	Very high	97.1	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-62.9	-44.9	175.2	-66.5	174.7	0	0	0	111.1	I193 I213 P215 L218 Y288 S307 L308 Y313 E314 M315	I193-I311 HydrophobicContact CD1-CG2 4.33Å; I213-I311 HydrophobicContact CG2-CD1 3.59Å; P215-I311 HydrophobicContact CG-CG1 4.15Å; P215-I311 HydrophobicContact CG-CG2 4.48Å; L218-I311 HydrophobicContact CD1-CD1 3.97Å; L218-I311 HydrophobicContact CD1-CG2 4.48Å; Y288-I311 HydrophobicContact CD1-CG1 3.9Å; Y288-I311 HydrophobicContact CE1-CG1 3.97Å; S307-I311 WeakPolarHBondContact O-CG1 3.47Å; S307-I311 PolarHBondContact O-N 3.11Å; L308-I311 PolarHBondContact O-N 3.34Å; I311-Y313 VanDerWaalsContact C-N 3.3Å; I311-Y313 PolarHBondContact O-N 3.47Å; I311-E314 PolarHBondContact O-N 3.23Å; I311-E314 VanDerWaalsContact O-N 3.11Å; I311-M315 HydrophobicContact CG2-CE 3.71Å; I311-M315 HydrophobicContact CG2-CG 4.29Å; I311-M315 HydrophobicContact CG2-SD 4.1Å; I311-M315 WeakPolarHBondContact O-CG 3.48Å; I311-M315 PolarHBondContact O-N 3.39Å
312	M	98.8	Very high	97.3	Very high	0 Å²	0	3.8 Å²	3.8	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-59.3	-42	178	-176.9	176.7	171.7	0	0	111.6	T189 I193 L308 G309 M315 L316 A353 L356 I357 F360 F381	T189-M312 HydrophobicContact CG2-CG 3.96Å; I193-M312 HydrophobicContact CD1-CB 3.73Å; I193-M312 HydrophobicContact CD1-CG 4.33Å; I193-M312 HydrophobicContact CG1-CB 4.06Å; I193-M312 HydrophobicContact CG1-CG 4.1Å; L308-M312 WeakPolarHBondContact O-CB 3.33Å; L308-M312 PolarHBondContact O-N 3.06Å; G309-M312 PolarHBondContact O-N 3.21Å; M312-M315 PolarHBondContact O-N 3.02Å; M312-L316 HydrophobicContact CE-CD1 4.17Å; M312-L316 HydrophobicContact CG-CD1 4.32Å; M312-L316 WeakPolarHBondContact O-CG 3.42Å; M312-L316 PolarHBondContact O-N 2.96Å; M312-A353 HydrophobicContact CE-CB 3.92Å; M312-L356 HydrophobicContact CE-CB 4.22Å; M312-L356 HydrophobicContact CE-CD2 3.99Å; M312-L356 HydrophobicContact CE-CG 4.31Å; M312-L356 HydrophobicContact SD-CB 4.34Å; M312-L356 HydrophobicContact SD-CD2 3.74Å; M312-L356 HydrophobicContact SD-CG 3.88Å; M312-I357 HydrophobicContact CB-CG1 4.15Å; M312-I357 HydrophobicContact CE-CD1 4.47Å; M312-I357 HydrophobicContact CE-CG1 4.14Å; M312-I357 HydrophobicContact CG-CD1 4.13Å; M312-I357 HydrophobicContact CG-CG1 3.8Å; M312-I357 HydrophobicContact SD-CG1 3.79Å; M312-F360 HydrophobicContact SD-CE2 4.37Å; M312-F381 HydrophobicContact CE-CD1 3.78Å; M312-F381 HydrophobicContact CE-CD2 3.98Å; M312-F381 HydrophobicContact CE-CE1 3.5Å; M312-F381 HydrophobicContact CE-CE2 3.76Å; M312-F381 HydrophobicContact CE-CG 4Å; M312-F381 HydrophobicContact CE-CZ 3.52Å; M312-F381 HydrophobicContact SD-CE1 4.39Å
313	Y	98.8	Very high	97.1	Very high	5 Å²	5	3.5 Å²	3.5	2%	0.02	2%	0.019	C	C	.	.	H	α-helix	trans	-62.1	-46.3	172.9	-175.3	-73.3	0	0	0	111.2	G309 V310 I311 M315 L316 I317 Y319 P321 L341 T342 F343 I357	G309-Y313 PolarHBondContact O-N 3.14Å; V310-Y313 PolarHBondContact O-N 3.4Å; I311-Y313 VanDerWaalsContact C-N 3.3Å; I311-Y313 PolarHBondContact O-N 3.47Å; Y313-M315 VanDerWaalsContact C-N 3.34Å; Y313-M315 PolarHBondContact O-N 3.32Å; Y313-L316 PolarHBondContact O-N 2.85Å; Y313-I317 HydrophobicContact CD1-CB 3.81Å; Y313-I317 HydrophobicContact CD1-CG1 3.72Å; Y313-I317 HydrophobicContact CD1-CG2 4.39Å; Y313-I317 HydrophobicContact CD2-CG1 4.11Å; Y313-I317 HydrophobicContact CE1-CB 3.55Å; Y313-I317 HydrophobicContact CE1-CG1 3.59Å; Y313-I317 HydrophobicContact CE1-CG2 3.62Å; Y313-I317 HydrophobicContact CE2-CG1 4Å; Y313-I317 HydrophobicContact CG-CG1 3.99Å; Y313-I317 VanDerWaalsContact O-CB 3.26Å; Y313-I317 WeakPolarHBondContact O-CB 3.47Å; Y313-I317 VanDerWaalsContact O-CG1 3.29Å; Y313-I317 WeakPolarHBondContact O-CG1 3.34Å; Y313-I317 PolarHBondContact O-N 3.16Å; Y313-Y319 WeakPolarHBondContact CD1-O 3.4Å; Y313-Y319 HydrophobicContact CE1-CD2 4.36Å; Y313-Y319 HydrophobicContact CE1-CE2 4.15Å; Y313-Y319 VanDerWaalsContact CE1-O 3.3Å; Y313-Y319 WeakPolarHBondContact CE1-O 3.44Å; Y313-P321 HydrophobicContact CD1-CB 4.04Å; Y313-P321 VanDerWaalsContact CD1-CD 3.49Å; Y313-P321 HydrophobicContact CD1-CG 4.25Å; Y313-P321 HydrophobicContact CD2-CB 4.11Å; Y313-P321 HydrophobicContact CD2-CG 4.48Å; Y313-P321 HydrophobicContact CE1-CB 4.01Å; Y313-P321 HydrophobicContact CE2-CB 4.07Å; Y313-P321 HydrophobicContact CG-CB 4.09Å; Y313-P321 HydrophobicContact CG-CG 4.14Å; Y313-L341 HydrophobicContact CD2-CD1 4.29Å; Y313-L341 HydrophobicContact CE2-CD1 4.31Å; Y313-T342 WeakPolarHBondContact CE2-O 3.34Å; Y313-T342 PolarHBondContact OH-O 3.44Å; Y313-F343 HydrophobicContact CD2-CD1 4.16Å; Y313-F343 AromaticContact CD2-CE1 3.82Å; Y313-F343 HydrophobicContact CD2-CE1 3.82Å; Y313-F343 AromaticContact CE2-CD1 3.8Å; Y313-F343 HydrophobicContact CE2-CD1 3.8Å; Y313-F343 AromaticContact CE2-CE1 3.9Å; Y313-F343 HydrophobicContact CE2-CE1 3.9Å; Y313-I357 HydrophobicContact CD2-CD1 4.39Å; Y313-I357 HydrophobicContact CD2-CG2 4.19Å
314	E	98.1	Very high	96.8	Very high	8 Å²	8	4.1 Å²	4.1	4%	0.037	2%	0.024	C	C	.	.	H	α-helix	trans	-62	-39.9	179	-177.5	177.2	-169.3	0	0	112.6	L178 P215 W271 R275 Y288 V310 I311 L316 G318	L178-E314 HydrophobicContact CD1-CG 4.24Å; P215-E314 WeakPolarHBondContact CG-OE2 3.46Å; W271-E314 PolarHBondContact NE1-OE1 3.35Å; R275-E314 IonicContact NE-OE1 2.86Å; Y288-E314 WeakPolarHBondContact CE1-OE2 3.28Å; Y288-E314 PolarHBondContact OH-OE1 2.84Å; Y288-E314 PolarHBondContact OH-OE2 3.27Å; V310-E314 PolarHBondContact O-N 3.09Å; I311-E314 PolarHBondContact O-N 3.23Å; I311-E314 VanDerWaalsContact O-N 3.11Å; E314-L316 VanDerWaalsContact C-N 3.3Å; E314-L316 PolarHBondContact O-N 3.46Å; E314-G318 WeakPolarHBondContact O-CA 3.35Å; E314-G318 PolarHBondContact O-N 3.36Å
315	M	98.5	Very high	96.2	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-57.9	-43.6	175.7	-73.6	175.2	168.1	0	0	111.5	M174 L178 T183 L184 T189 I193 I311 M312 Y313	M174-M315 HydrophobicContact CE-CE 3.82Å; M174-M315 HydrophobicContact CG-CE 3.77Å; M174-M315 HydrophobicContact SD-CE 3.64Å; L178-M315 HydrophobicContact CD1-CG 4.37Å; L178-M315 HydrophobicContact CD2-CB 4.48Å; L178-M315 HydrophobicContact CD2-CG 4.12Å; T183-M315 CarbonylContact C-O 3.54Å; T183-M315 VanDerWaalsContact CA-O 3.31Å; T183-M315 WeakPolarHBondContact CA-O 3.39Å; T183-M315 WeakPolarHBondContact CB-O 3.43Å; L184-M315 HydrophobicContact CB-CB 4.39Å; L184-M315 HydrophobicContact CD1-CB 4.31Å; L184-M315 HydrophobicContact CD1-CE 4.31Å; L184-M315 HydrophobicContact CD1-CG 3.97Å; L184-M315 HydrophobicContact CD1-SD 4.15Å; L184-M315 HydrophobicContact CG-CB 4.45Å; L184-M315 PolarHBondContact N-O 2.96Å; T189-M315 HydrophobicContact CG2-CB 4.1Å; T189-M315 HydrophobicContact CG2-SD 3.99Å; I193-M315 HydrophobicContact CD1-CE 4.47Å; I193-M315 HydrophobicContact CD1-SD 3.83Å; I193-M315 HydrophobicContact CG1-SD 4.08Å; I311-M315 HydrophobicContact CG2-CE 3.71Å; I311-M315 HydrophobicContact CG2-CG 4.29Å; I311-M315 HydrophobicContact CG2-SD 4.1Å; I311-M315 WeakPolarHBondContact O-CG 3.48Å; I311-M315 PolarHBondContact O-N 3.39Å; M312-M315 PolarHBondContact O-N 3.02Å; Y313-M315 VanDerWaalsContact C-N 3.34Å; Y313-M315 PolarHBondContact O-N 3.32Å
316	L	98.4	Very high	95.4	Very high	15 Å²	15	13.4 Å²	13.4	8%	0.079	7%	0.071	C	C	.	.	H	α-helix	trans	-86.7	-31.2	-174.4	-64.1	173.3	0	0	0	113.8	E186 T189 M312 Y313 E314 I349 A353 I357	E186-L316 HydrophobicContact CB-CD2 4.5Å; E186-L316 HydrophobicContact CG-CD2 3.75Å; T189-L316 HydrophobicContact CG2-CD1 4.3Å; T189-L316 HydrophobicContact CG2-CD2 4.11Å; T189-L316 HydrophobicContact CG2-CG 4.04Å; T189-L316 WeakPolarHBondContact OG1-CD2 2.97Å; M312-L316 HydrophobicContact CE-CD1 4.17Å; M312-L316 HydrophobicContact CG-CD1 4.32Å; M312-L316 WeakPolarHBondContact O-CG 3.42Å; M312-L316 PolarHBondContact O-N 2.96Å; Y313-L316 PolarHBondContact O-N 2.85Å; E314-L316 VanDerWaalsContact C-N 3.3Å; E314-L316 PolarHBondContact O-N 3.46Å; L316-I349 HydrophobicContact CB-CD1 4.27Å; L316-I349 HydrophobicContact CD1-CD1 3.77Å; L316-I349 HydrophobicContact CD1-CG1 4.29Å; L316-A353 HydrophobicContact CD1-CB 3.82Å; L316-I357 HydrophobicContact CD1-CD1 4.26Å
317	I	97.8	Very high	94.6	Very high	6 Å²	6	14.7 Å²	14.7	3%	0.031	8%	0.08	C	C	.	.	H	α-helix	trans	-105.3	-26.2	-172.4	-51.9	-58.5	0	0	0	112.4	Y313 Y319 P344 V347 I349	Y313-I317 HydrophobicContact CD1-CB 3.81Å; Y313-I317 HydrophobicContact CD1-CG1 3.72Å; Y313-I317 HydrophobicContact CD1-CG2 4.39Å; Y313-I317 HydrophobicContact CD2-CG1 4.11Å; Y313-I317 HydrophobicContact CE1-CB 3.55Å; Y313-I317 HydrophobicContact CE1-CG1 3.59Å; Y313-I317 HydrophobicContact CE1-CG2 3.62Å; Y313-I317 HydrophobicContact CE2-CG1 4Å; Y313-I317 HydrophobicContact CG-CG1 3.99Å; Y313-I317 VanDerWaalsContact O-CB 3.26Å; Y313-I317 WeakPolarHBondContact O-CB 3.47Å; Y313-I317 VanDerWaalsContact O-CG1 3.29Å; Y313-I317 WeakPolarHBondContact O-CG1 3.34Å; Y313-I317 PolarHBondContact O-N 3.16Å; I317-Y319 HydrophobicContact CG2-CD1 4.36Å; I317-Y319 HydrophobicContact CG2-CE1 3.82Å; I317-Y319 HydrophobicContact CG2-CE2 4.21Å; I317-P344 HydrophobicContact CG2-CG 3.98Å; I317-V347 HydrophobicContact CD1-CB 4.24Å; I317-V347 HydrophobicContact CD1-CG1 3.63Å; I317-I349 HydrophobicContact CD1-CD1 4.25Å
318	G	95.9	Very high	94	Very high	3 Å²	3	17.5 Å²	17.5	3%	0.031	9%	0.092	C	C	.	.	S	Bend	trans	96.5	2.1	176.7	0	0	0	0	0	115.6	E314	E314-G318 WeakPolarHBondContact O-CA 3.35Å; E314-G318 PolarHBondContact O-N 3.36Å
319	Y	95.3	Very high	93.5	Very high	7 Å²	7	18.5 Å²	18.5	3%	0.027	10%	0.097	C	C	.	.	S	Bend	trans	-156.9	153.9	171.1	55.3	-93	0	0	0	109.6	S264 K267 A268 Y313 I317 C323 P344	S264-Y319 VanDerWaalsContact O-CE1 3.28Å; S264-Y319 WeakPolarHBondContact O-CE1 2.9Å; S264-Y319 WeakPolarHBondContact OG-CE1 3.28Å; S264-Y319 PolarHBondContact OG-OH 3.08Å; K267-Y319 HydrophobicContact CB-CD1 3.83Å; K267-Y319 HydrophobicContact CB-CD2 4.45Å; K267-Y319 HydrophobicContact CB-CE1 3.61Å; K267-Y319 HydrophobicContact CB-CE2 4.29Å; K267-Y319 HydrophobicContact CB-CG 4.24Å; K267-Y319 HydrophobicContact CD-CE1 4.45Å; K267-Y319 HydrophobicContact CD-CE2 4.1Å; A268-Y319 HydrophobicContact CB-CD1 3.9Å; Y313-Y319 WeakPolarHBondContact CD1-O 3.4Å; Y313-Y319 HydrophobicContact CE1-CD2 4.36Å; Y313-Y319 HydrophobicContact CE1-CE2 4.15Å; Y313-Y319 VanDerWaalsContact CE1-O 3.3Å; Y313-Y319 WeakPolarHBondContact CE1-O 3.44Å; I317-Y319 HydrophobicContact CG2-CD1 4.36Å; I317-Y319 HydrophobicContact CG2-CE1 3.82Å; I317-Y319 HydrophobicContact CG2-CE2 4.21Å; Y319-C323 VanDerWaalsContact CD2-SG 3.55Å; Y319-P344 WeakPolarHBondContact OH-CG 3.47Å
320	P	96.1	Very high	93	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.097	C	C	.	.			trans	-72.5	149.3	178.4	29.2	-32.8	0	0	0	111.1	W271 D287 Y288 V310 F322 C323	W271-P320 HydrophobicContact CD2-CG 4.33Å; W271-P320 HydrophobicContact CE3-CG 4.41Å; W271-P320 HydrophobicContact CH2-CG 3.41Å; W271-P320 VanDerWaalsContact CH2-CG 3.41Å; W271-P320 HydrophobicContact CZ2-CG 3.3Å; W271-P320 HydrophobicContact CZ3-CG 4Å; D287-P320 HydrophobicContact CB-CB 4.22Å; D287-P320 HydrophobicContact CB-CG 3.93Å; Y288-P320 HydrophobicContact CE1-CB 4.41Å; V310-P320 HydrophobicContact CG1-CB 3.63Å; P320-F322 PolarHBondContact O-N 2.98Å; P320-C323 HydrophobicContact CG-CB 4.04Å; P320-C323 PolarHBondContact O-N 3.46Å; P320-C323 VanDerWaalsContact O-N 3.15Å; P320-C323 PolarHBondContact O-SG 2.84Å
321	P	97	Very high	92.5	Very high	15 Å²	15	18.9 Å²	18.9	10%	0.097	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-29.4	-168.1	20.9	-33.9	0	0	0	114.1	V310 Y313 L341	V310-P321 HydrophobicContact CG1-CG 4.36Å; V310-P321 HydrophobicContact CG2-CG 4.4Å; Y313-P321 HydrophobicContact CD1-CB 4.04Å; Y313-P321 VanDerWaalsContact CD1-CD 3.49Å; Y313-P321 HydrophobicContact CD1-CG 4.25Å; Y313-P321 HydrophobicContact CD2-CB 4.11Å; Y313-P321 HydrophobicContact CD2-CG 4.48Å; Y313-P321 HydrophobicContact CE1-CB 4.01Å; Y313-P321 HydrophobicContact CE2-CB 4.07Å; Y313-P321 HydrophobicContact CG-CB 4.09Å; Y313-P321 HydrophobicContact CG-CG 4.14Å; P321-L341 HydrophobicContact CB-CD1 3.49Å; P321-L341 VanDerWaalsContact CB-CD1 3.49Å; P321-L341 HydrophobicContact CG-CD1 4.01Å
322	F	95.3	Very high	92	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	8.9	-173.7	-46.9	-62.3	0	0	0	113.8	W306 V310 P320 T330 K333 V334 W337 L341	W306-F322 HydrophobicContact CH2-CE2 4.42Å; W306-F322 HydrophobicContact CH2-CZ 4.2Å; W306-F322 AromaticContact CZ2-CE2 3.5Å; W306-F322 HydrophobicContact CZ2-CE2 3.5Å; W306-F322 AromaticContact CZ2-CZ 3.7Å; W306-F322 HydrophobicContact CZ2-CZ 3.7Å; V310-F322 HydrophobicContact CG2-CE2 4.13Å; P320-F322 PolarHBondContact O-N 2.98Å; F322-T330 HydrophobicContact CB-CG2 4.32Å; F322-T330 WeakPolarHBondContact O-CA 3.26Å; F322-T330 WeakPolarHBondContact O-CG2 3.48Å; F322-K333 HydrophobicContact CB-CB 3.94Å; F322-K333 HydrophobicContact CD1-CB 4.14Å; F322-K333 HydrophobicContact CG-CB 4.48Å; F322-K333 WeakPolarHBondContact O-CD 3.44Å; F322-V334 HydrophobicContact CB-CG2 3.74Å; F322-V334 HydrophobicContact CD2-CG2 3.71Å; F322-V334 HydrophobicContact CG-CG2 3.75Å; F322-W337 HydrophobicContact CE1-CB 3.81Å; F322-W337 HydrophobicContact CZ-CB 3.87Å; F322-L341 HydrophobicContact CE1-CB 4Å; F322-L341 HydrophobicContact CE1-CD1 4.5Å; F322-L341 HydrophobicContact CZ-CB 4.24Å; F322-L341 HydrophobicContact CZ-CD1 4.27Å
323	C	90.4	Very high	91.8	Very high	4 Å²	4	20.7 Å²	20.7	3%	0.027	11%	0.106	C	C	.	.			trans	-57.7	145.7	-177.9	64.3	0	0	0	0	112.5	F259 W271 D287 Y319 P320 K333	F259-C323 WeakPolarHBondContact CE1-O 3.47Å; W271-C323 HydrophobicContact CE3-CB 3.82Å; W271-C323 HydrophobicContact CZ3-CB 3.9Å; D287-C323 VanDerWaalsContact OD1-CA 3.31Å; D287-C323 WeakPolarHBondContact OD1-CA 3.33Å; Y319-C323 VanDerWaalsContact CD2-SG 3.55Å; P320-C323 HydrophobicContact CG-CB 4.04Å; P320-C323 PolarHBondContact O-N 3.46Å; P320-C323 VanDerWaalsContact O-N 3.15Å; P320-C323 PolarHBondContact O-SG 2.84Å; C323-K333 PolarHBondContact O-NZ 3.49Å
324	S	87.7	Confident	91.5	Very high	15 Å²	15	20.4 Å²	20.4	11%	0.105	11%	0.105	C	C	.	.			trans	-151	170.8	176.7	-84.4	0	0	0	0	109.4	D256 T326 T330 K333	D256-S324 PolarHBondContact OD2-OG 3.21Å; S324-T326 PolarHBondContact O-N 3Å; S324-T330 PolarHBondContact N-OG1 3.02Å; S324-K333 WeakPolarHBondContact OG-CE 3.36Å; S324-K333 PolarHBondContact OG-NZ 2.85Å
325	E	83.2	Confident	91.2	Very high	142 Å²	142	21.4 Å²	21.4	66%	0.664	11%	0.11	S	C	*	.	S	Bend	trans	-68.4	-24.3	174.2	-62.4	-174	162.1	0	0	113	F259	F259-E325 HydrophobicContact CD2-CG 3.87Å; F259-E325 HydrophobicContact CE2-CG 4.33Å
326	T	82.3	Confident	91	Very high	56 Å²	56	23.2 Å²	23.2	34%	0.344	12%	0.12	S	C	.	.	S	Bend	trans	-129.1	145.3	-179.1	71	0	0	0	0	112.2	S324 Q328 E329 T330	S324-T326 PolarHBondContact O-N 3Å; T326-Q328 PolarHBondContact O-N 3.4Å; T326-E329 PolarHBondContact O-N 3.28Å; T326-E329 VanDerWaalsContact O-N 3.17Å; T326-E329 WeakPolarHBondContact OG1-CG 3.3Å; T326-E329 PolarHBondContact OG1-N 3.16Å; T326-T330 PolarHBondContact O-N 3.42Å; T326-T330 VanDerWaalsContact O-N 3.11Å; T326-T330 PolarHBondContact O-OG1 3.25Å
327	P	81.9	Confident	90.9	Very high	27 Å²	27	24.2 Å²	24.2	18%	0.175	12%	0.123	C	C	.	.	H	α-helix	trans	-56.2	-31.3	175.6	-25.1	32.6	0	0	0	114	T285 Y331	T285-P327 HydrophobicContact CG2-CB 4.36Å; T285-P327 HydrophobicContact CG2-CG 3.92Å; P327-Y331 WeakPolarHBondContact O-CB 3.41Å; P327-Y331 PolarHBondContact O-N 3.4Å
328	Q	83.6	Confident	90.8	Very high	64 Å²	64	30.8 Å²	30.8	30%	0.299	15%	0.151	S	C	.	.	H	α-helix	trans	-65.4	-43	178.6	-71.2	82.6	1.1	0	0	112.3	L249 T326 Y331 K332	L249-Q328 HydrophobicContact CD1-CG 4.41Å; L249-Q328 HydrophobicContact CD2-CB 3.67Å; L249-Q328 HydrophobicContact CD2-CG 3.7Å; T326-Q328 PolarHBondContact O-N 3.4Å; Q328-Y331 WeakPolarHBondContact O-CB 3.29Å; Q328-Y331 PolarHBondContact O-N 2.82Å; Q328-K332 PolarHBondContact O-N 3.5Å; Q328-K332 VanDerWaalsContact O-N 3.1Å
329	E	88	Confident	90.8	Very high	21 Å²	21	36.8 Å²	36.8	10%	0.098	18%	0.178	C	C	.	.	H	α-helix	trans	-74.2	-38.2	178	-66	-63.3	128.4	0	0	110.8	P254 S255 D256 T326 Y331 K332 K333	P254-E329 VanDerWaalsContact C-OE2 3.32Å; P254-E329 WeakPolarHBondContact CA-OE2 3.31Å; P254-E329 WeakPolarHBondContact CB-OE2 3.38Å; S255-E329 PolarHBondContact N-OE2 3.29Å; D256-E329 HydrophobicContact CB-CG 4.44Å; T326-E329 PolarHBondContact O-N 3.28Å; T326-E329 VanDerWaalsContact O-N 3.17Å; T326-E329 WeakPolarHBondContact OG1-CG 3.3Å; T326-E329 PolarHBondContact OG1-N 3.16Å; E329-Y331 VanDerWaalsContact C-N 3.3Å; E329-Y331 PolarHBondContact O-N 3.12Å; E329-K332 PolarHBondContact O-N 3.14Å; E329-K332 IonicContact OE1-NZ 3.53Å; E329-K332 PolarHBondContact OE1-NZ 3.39Å; E329-K333 WeakPolarHBondContact O-CG 3.42Å; E329-K333 PolarHBondContact O-N 3.14Å
330	T	89	Confident	90.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-55.7	-47	169.1	-60	0	0	0	0	110.7	P286 D287 F322 S324 T326 K332 K333 V334	P286-T330 HydrophobicContact CG-CG2 3.73Å; D287-T330 HydrophobicContact CB-CG2 4.41Å; D287-T330 WeakPolarHBondContact OD1-CG2 2.85Å; F322-T330 HydrophobicContact CB-CG2 4.32Å; F322-T330 WeakPolarHBondContact O-CA 3.26Å; F322-T330 WeakPolarHBondContact O-CG2 3.48Å; S324-T330 PolarHBondContact N-OG1 3.02Å; T326-T330 PolarHBondContact O-N 3.42Å; T326-T330 VanDerWaalsContact O-N 3.11Å; T326-T330 PolarHBondContact O-OG1 3.25Å; T330-K332 PolarHBondContact O-N 2.9Å; T330-K333 WeakPolarHBondContact O-CB 3.31Å; T330-K333 PolarHBondContact O-N 3.14Å; T330-K333 VanDerWaalsContact O-N 3.15Å; T330-V334 HydrophobicContact CG2-CG2 4.39Å; T330-V334 WeakPolarHBondContact O-CG2 3.46Å; T330-V334 PolarHBondContact O-N 3.19Å
331	Y	87.3	Confident	91	Very high	8 Å²	8	38.4 Å²	38.4	3%	0.031	19%	0.188	C	C	.	.	H	α-helix	trans	-57.5	-46.9	176.9	167.2	-93.4	0	0	0	112.4	Y246 L249 H251 F294 P327 Q328 E329 K333 V334 M335	Y246-Y331 AromaticContact CD1-CD1 3.92Å; Y246-Y331 HydrophobicContact CD1-CD1 3.92Å; Y246-Y331 AromaticContact CD1-CD2 3.61Å; Y246-Y331 HydrophobicContact CD1-CD2 3.61Å; Y246-Y331 HydrophobicContact CD1-CE1 4.45Å; Y246-Y331 HydrophobicContact CD1-CE2 4.16Å; Y246-Y331 AromaticContact CD1-CG 3.46Å; Y246-Y331 HydrophobicContact CD1-CG 3.46Å; Y246-Y331 VanDerWaalsContact CD1-CG 3.46Å; Y246-Y331 HydrophobicContact CD2-CD2 4.1Å; Y246-Y331 HydrophobicContact CD2-CE2 4.36Å; Y246-Y331 HydrophobicContact CE1-CD2 4.03Å; Y246-Y331 AromaticContact CE1-CG 3.8Å; Y246-Y331 HydrophobicContact CE1-CG 3.8Å; Y246-Y331 HydrophobicContact CE2-CD2 4.49Å; Y246-Y331 HydrophobicContact CG-CD1 4.49Å; Y246-Y331 AromaticContact CG-CD2 3.65Å; Y246-Y331 HydrophobicContact CG-CD2 3.65Å; Y246-Y331 AromaticContact CG-CE2 3.83Å; Y246-Y331 HydrophobicContact CG-CE2 3.83Å; Y246-Y331 AromaticContact CG-CG 4Å; Y246-Y331 HydrophobicContact CG-CG 4Å; L249-Y331 HydrophobicContact CB-CE1 4.2Å; L249-Y331 HydrophobicContact CD2-CD1 4.15Å; H251-Y331 PolarHBondContact CD2-OH 3.39Å; H251-Y331 VanDerWaalsContact CD2-OH 3.27Å; H251-Y331 PolarHBondContact NE2-OH 3.16Å; F294-Y331 HydrophobicContact CB-CE2 3.98Å; F294-Y331 HydrophobicContact CD1-CD2 4.06Å; F294-Y331 AromaticContact CD1-CE2 3.89Å; F294-Y331 HydrophobicContact CD1-CE2 3.89Å; F294-Y331 HydrophobicContact CD2-CD2 4.39Å; F294-Y331 HydrophobicContact CD2-CE2 4.3Å; F294-Y331 HydrophobicContact CE1-CD2 4.19Å; F294-Y331 HydrophobicContact CE1-CE2 4.48Å; F294-Y331 HydrophobicContact CE2-CD2 4.48Å; F294-Y331 HydrophobicContact CG-CD2 4.16Å; F294-Y331 AromaticContact CG-CE2 3.79Å; F294-Y331 HydrophobicContact CG-CE2 3.79Å; F294-Y331 HydrophobicContact CZ-CD2 4.39Å; P327-Y331 WeakPolarHBondContact O-CB 3.41Å; P327-Y331 PolarHBondContact O-N 3.4Å; Q328-Y331 WeakPolarHBondContact O-CB 3.29Å; Q328-Y331 PolarHBondContact O-N 2.82Å; E329-Y331 VanDerWaalsContact C-N 3.3Å; E329-Y331 PolarHBondContact O-N 3.12Å; Y331-K333 VanDerWaalsContact C-N 3.3Å; Y331-K333 PolarHBondContact O-N 3.4Å; Y331-V334 PolarHBondContact O-N 3.36Å; Y331-M335 HydrophobicContact CD1-CG 4.41Å; Y331-M335 HydrophobicContact CD2-CE 4.21Å; Y331-M335 HydrophobicContact CD2-CG 4.36Å; Y331-M335 HydrophobicContact CE1-CG 3.95Å; Y331-M335 HydrophobicContact CE2-CE 3.67Å; Y331-M335 HydrophobicContact CE2-CG 3.9Å; Y331-M335 HydrophobicContact CE2-SD 4.3Å; Y331-M335 WeakPolarHBondContact O-CG 3.26Å; Y331-M335 PolarHBondContact O-N 2.99Å
332	K	89.7	Confident	90.9	Very high	23 Å²	23	41.9 Å²	41.9	10%	0.1	21%	0.209	C	C	.	.	H	α-helix	trans	-61.7	-38.9	176.2	-71.6	174.8	-176.2	168.3	0	111.8	S252 P254 Q328 E329 T330 M335 N336	S252-K332 WeakPolarHBondContact O-CD 3.18Å; S252-K332 WeakPolarHBondContact O-CG 3.3Å; P254-K332 HydrophobicContact CB-CB 4.24Å; Q328-K332 PolarHBondContact O-N 3.5Å; Q328-K332 VanDerWaalsContact O-N 3.1Å; E329-K332 PolarHBondContact O-N 3.14Å; E329-K332 IonicContact OE1-NZ 3.53Å; E329-K332 PolarHBondContact OE1-NZ 3.39Å; T330-K332 PolarHBondContact O-N 2.9Å; K332-M335 PolarHBondContact O-N 3.44Å; K332-N336 WeakPolarHBondContact O-CB 3.43Å; K332-N336 PolarHBondContact O-N 2.69Å; K332-N336 VanDerWaalsContact O-N 3.09Å; K332-N336 PolarHBondContact O-ND2 2.79Å
333	K	93.6	Very high	91	Very high	15 Å²	15	44.1 Å²	44.1	7%	0.065	22%	0.219	C	C	.	.	H	α-helix	trans	-62.3	-48.1	174.7	-75.2	178	-178.5	171.2	0	111.5	P254 D256 F322 C323 S324 E329 T330 Y331 M335 N336 W337 T340	P254-K333 HydrophobicContact CB-CG 4.18Å; P254-K333 HydrophobicContact CG-CG 3.72Å; D256-K333 WeakPolarHBondContact OD1-CE 3.32Å; D256-K333 IonicContact OD1-NZ 2.66Å; D256-K333 WeakPolarHBondContact OD2-CE 3.43Å; D256-K333 IonicContact OD2-NZ 3.41Å; D256-K333 PolarHBondContact OD2-NZ 3.29Å; F322-K333 HydrophobicContact CB-CB 3.94Å; F322-K333 HydrophobicContact CD1-CB 4.14Å; F322-K333 HydrophobicContact CG-CB 4.48Å; F322-K333 WeakPolarHBondContact O-CD 3.44Å; C323-K333 PolarHBondContact O-NZ 3.49Å; S324-K333 WeakPolarHBondContact OG-CE 3.36Å; S324-K333 PolarHBondContact OG-NZ 2.85Å; E329-K333 WeakPolarHBondContact O-CG 3.42Å; E329-K333 PolarHBondContact O-N 3.14Å; T330-K333 WeakPolarHBondContact O-CB 3.31Å; T330-K333 PolarHBondContact O-N 3.14Å; T330-K333 VanDerWaalsContact O-N 3.15Å; Y331-K333 VanDerWaalsContact C-N 3.3Å; Y331-K333 PolarHBondContact O-N 3.4Å; K333-M335 PolarHBondContact O-N 3.14Å; K333-N336 CarbonylContact O-C 3.48Å; K333-N336 VanDerWaalsContact O-C 3.24Å; K333-N336 PolarHBondContact O-N 3.17Å; K333-N336 VanDerWaalsContact O-N 3.16Å; K333-W337 PolarHBondContact O-N 3.5Å; K333-W337 VanDerWaalsContact O-N 3.1Å; K333-T340 HydrophobicContact CB-CG2 4.35Å; K333-T340 HydrophobicContact CG-CG2 4.2Å; K333-T340 PolarHBondContact O-OG1 3.24Å
334	V	92.8	Very high	91.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.1	-45.6	176.8	171.8	0	0	0	0	111.4	I289 P291 F294 F322 T330 Y331 N336 W337	I289-V334 WeakPolarHBondContact O-CG1 3.37Å; P291-V334 HydrophobicContact CB-CG1 4.18Å; F294-V334 HydrophobicContact CE2-CG1 4.35Å; F322-V334 HydrophobicContact CB-CG2 3.74Å; F322-V334 HydrophobicContact CD2-CG2 3.71Å; F322-V334 HydrophobicContact CG-CG2 3.75Å; T330-V334 HydrophobicContact CG2-CG2 4.39Å; T330-V334 WeakPolarHBondContact O-CG2 3.46Å; T330-V334 PolarHBondContact O-N 3.19Å; Y331-V334 PolarHBondContact O-N 3.36Å; V334-N336 PolarHBondContact O-N 3.26Å; V334-W337 WeakPolarHBondContact O-CB 3.5Å; V334-W337 PolarHBondContact O-N 3.03Å
335	M	91.8	Very high	91.4	Very high	29 Å²	29	50.3 Å²	50.3	14%	0.143	26%	0.259	C	S	.	.	H	α-helix	trans	-63.6	-30	178.2	-72	-61.7	127.8	0	0	113.2	H251 P291 F294 Y331 K332 K333	H251-M335 HydrophobicContact CB-CB 4.48Å; P291-M335 HydrophobicContact CB-CE 4.14Å; P291-M335 WeakPolarHBondContact O-CE 3.49Å; F294-M335 HydrophobicContact CB-CE 3.47Å; F294-M335 VanDerWaalsContact CB-CE 3.47Å; F294-M335 HydrophobicContact CD2-CE 3.21Å; F294-M335 HydrophobicContact CE2-CE 4.16Å; F294-M335 HydrophobicContact CG-CE 3.6Å; Y331-M335 HydrophobicContact CD1-CG 4.41Å; Y331-M335 HydrophobicContact CD2-CE 4.21Å; Y331-M335 HydrophobicContact CD2-CG 4.36Å; Y331-M335 HydrophobicContact CE1-CG 3.95Å; Y331-M335 HydrophobicContact CE2-CE 3.67Å; Y331-M335 HydrophobicContact CE2-CG 3.9Å; Y331-M335 HydrophobicContact CE2-SD 4.3Å; Y331-M335 WeakPolarHBondContact O-CG 3.26Å; Y331-M335 PolarHBondContact O-N 2.99Å; K332-M335 PolarHBondContact O-N 3.44Å; K333-M335 PolarHBondContact O-N 3.14Å
336	N	94.7	Very high	91.8	Very high	37 Å²	37	48.6 Å²	48.6	20%	0.198	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	32.1	-179.9	-63.5	-75.6	0	0	0	112.1	H251 L253 K332 K333 V334 K338 E339 T340	H251-N336 PolarHBondContact O-ND2 3.05Å; H251-N336 PolarHBondContact O-OD1 3.11Å; L253-N336 HydrophobicContact CD2-CB 4.22Å; K332-N336 WeakPolarHBondContact O-CB 3.43Å; K332-N336 PolarHBondContact O-N 2.69Å; K332-N336 VanDerWaalsContact O-N 3.09Å; K332-N336 PolarHBondContact O-ND2 2.79Å; K333-N336 CarbonylContact O-C 3.48Å; K333-N336 VanDerWaalsContact O-C 3.24Å; K333-N336 PolarHBondContact O-N 3.17Å; K333-N336 VanDerWaalsContact O-N 3.16Å; V334-N336 PolarHBondContact O-N 3.26Å; N336-K338 PolarHBondContact O-N 3.26Å; N336-E339 PolarHBondContact O-N 2.91Å; N336-T340 HydrophobicContact CB-CG2 4.24Å; N336-T340 PolarHBondContact O-N 3.39Å; N336-T340 VanDerWaalsContact O-N 3.1Å; N336-T340 PolarHBondContact O-OG1 3.42Å
337	W	96.3	Very high	92.3	Very high	37 Å²	37	47.3 Å²	47.3	14%	0.14	24%	0.243	C	C	.	.	H	α-helix	trans	-53.1	-29.9	-173.9	64.7	-94.9	0	0	0	114.3	W306 F322 K333 V334 E339 T340 L341 C361 C362 E363	W306-W337 HydrophobicContact CH2-CB 3.74Å; W306-W337 AromaticContact CH2-CD1 3.8Å; W306-W337 HydrophobicContact CH2-CD2 4Å; W306-W337 AromaticContact CH2-CG 3.56Å; W306-W337 HydrophobicContact CH2-CG 3.56Å; W306-W337 HydrophobicContact CZ2-CB 4.34Å; W306-W337 HydrophobicContact CZ3-CD2 4.32Å; W306-W337 HydrophobicContact CZ3-CG 4.29Å; F322-W337 HydrophobicContact CE1-CB 3.81Å; F322-W337 HydrophobicContact CZ-CB 3.87Å; K333-W337 PolarHBondContact O-N 3.5Å; K333-W337 VanDerWaalsContact O-N 3.1Å; V334-W337 WeakPolarHBondContact O-CB 3.5Å; V334-W337 PolarHBondContact O-N 3.03Å; W337-E339 PolarHBondContact O-N 2.94Å; W337-T340 WeakPolarHBondContact CA-OG1 3.37Å; W337-T340 PolarHBondContact O-N 3.39Å; W337-L341 WeakPolarHBondContact O-CB 3.49Å; W337-L341 PolarHBondContact O-N 2.83Å; W337-C361 VanDerWaalsContact CE3-O 3.29Å; W337-C361 WeakPolarHBondContact CZ3-O 3.16Å; W337-C362 VanDerWaalsContact CH2-CA 3.48Å; W337-C362 HydrophobicContact CH2-CB 3.89Å; W337-C362 HydrophobicContact CZ3-CB 4.27Å; W337-E363 WeakPolarHBondContact CH2-OE2 3.47Å; W337-E363 HydrophobicContact CZ2-CG 3.94Å
338	K	96	Very high	92.9	Very high	143 Å²	143	51.8 Å²	51.8	62%	0.622	27%	0.272	S	S	*	.	H	α-helix	trans	-58.4	-29.8	176.5	-67.4	-174.7	178	-171.1	0	113.4	N336 E363	N336-K338 PolarHBondContact O-N 3.26Å; K338-E363 WeakPolarHBondContact CE-OE1 3.16Å; K338-E363 IonicContact NZ-OE1 2.71Å; K338-E363 PolarHBondContact NZ-OE1 2.84Å
339	E	95.4	Very high	93.5	Very high	129 Å²	129	49.7 Å²	49.7	60%	0.603	26%	0.263	S	S	*	.	H	α-helix	trans	-103.3	-28.3	179.9	-64	-179.2	-155.7	0	0	111.9	L253 N336 W337	L253-E339 WeakPolarHBondContact CD2-OE2 2.97Å; N336-E339 PolarHBondContact O-N 2.91Å; W337-E339 PolarHBondContact O-N 2.94Å
340	T	96.6	Very high	94	Very high	25 Å²	25	50.4 Å²	50.4	15%	0.153	27%	0.27	C	S	.	.	H	α-helix	trans	-98.2	-22.5	-171.1	64.2	0	0	0	0	114	K333 N336 W337 T342	K333-T340 HydrophobicContact CB-CG2 4.35Å; K333-T340 HydrophobicContact CG-CG2 4.2Å; K333-T340 PolarHBondContact O-OG1 3.24Å; N336-T340 HydrophobicContact CB-CG2 4.24Å; N336-T340 PolarHBondContact O-N 3.39Å; N336-T340 VanDerWaalsContact O-N 3.1Å; N336-T340 PolarHBondContact O-OG1 3.42Å; W337-T340 WeakPolarHBondContact CA-OG1 3.37Å; W337-T340 PolarHBondContact O-N 3.39Å; T340-T342 PolarHBondContact O-N 3.01Å
341	L	97.7	Very high	94.5	Very high	16 Å²	16	56.4 Å²	56.4	8%	0.084	30%	0.302	C	S	.	.			trans	-73.9	97.2	173.7	-179.3	57.7	0	0	0	109.5	Y313 P321 F322 W337 L358 C361	Y313-L341 HydrophobicContact CD2-CD1 4.29Å; Y313-L341 HydrophobicContact CE2-CD1 4.31Å; P321-L341 HydrophobicContact CB-CD1 3.49Å; P321-L341 VanDerWaalsContact CB-CD1 3.49Å; P321-L341 HydrophobicContact CG-CD1 4.01Å; F322-L341 HydrophobicContact CE1-CB 4Å; F322-L341 HydrophobicContact CE1-CD1 4.5Å; F322-L341 HydrophobicContact CZ-CB 4.24Å; F322-L341 HydrophobicContact CZ-CD1 4.27Å; W337-L341 WeakPolarHBondContact O-CB 3.49Å; W337-L341 PolarHBondContact O-N 2.83Å; L341-L358 HydrophobicContact CD2-CD2 3.81Å; L341-L358 HydrophobicContact CG-CD2 4.25Å; L341-C361 HydrophobicContact CD2-CB 3.58Å
342	T	96.5	Very high	95	Very high	89 Å²	89	59.9 Å²	59.9	55%	0.546	32%	0.317	S	S	.	.			trans	-131.8	152	-177.6	56.9	0	0	0	0	110.9	Y313 T340	Y313-T342 WeakPolarHBondContact CE2-O 3.34Å; Y313-T342 PolarHBondContact OH-O 3.44Å; T340-T342 PolarHBondContact O-N 3.01Å
343	F	97.3	Very high	95.4	Very high	47 Å²	47	58.8 Å²	58.8	21%	0.206	31%	0.313	C	S	.	.			trans	-101.8	127.1	176.3	-60.7	-83.9	0	0	0	109.3	Y313 I349 K354 I357 L358	Y313-F343 HydrophobicContact CD2-CD1 4.16Å; Y313-F343 AromaticContact CD2-CE1 3.82Å; Y313-F343 HydrophobicContact CD2-CE1 3.82Å; Y313-F343 AromaticContact CE2-CD1 3.8Å; Y313-F343 HydrophobicContact CE2-CD1 3.8Å; Y313-F343 AromaticContact CE2-CE1 3.9Å; Y313-F343 HydrophobicContact CE2-CE1 3.9Å; F343-I349 HydrophobicContact CD1-CD1 4.17Å; F343-I349 HydrophobicContact CE1-CD1 4.12Å; F343-K354 HydrophobicContact CD1-CG 4.04Å; F343-K354 HydrophobicContact CD2-CD 4.34Å; F343-K354 HydrophobicContact CD2-CG 4.19Å; F343-K354 HydrophobicContact CE1-CB 4.34Å; F343-K354 HydrophobicContact CE1-CG 3.94Å; F343-K354 HydrophobicContact CE2-CB 4.1Å; F343-K354 HydrophobicContact CE2-CG 4.1Å; F343-K354 HydrophobicContact CG-CD 4.41Å; F343-K354 HydrophobicContact CG-CG 4.16Å; F343-K354 HydrophobicContact CZ-CB 3.94Å; F343-K354 HydrophobicContact CZ-CG 3.97Å; F343-I357 HydrophobicContact CE1-CB 4.42Å; F343-I357 HydrophobicContact CE1-CD1 3.97Å; F343-I357 HydrophobicContact CE1-CG2 4.2Å; F343-I357 HydrophobicContact CZ-CB 4.19Å; F343-I357 HydrophobicContact CZ-CG2 3.98Å; F343-L358 HydrophobicContact CE2-CD1 4.21Å; F343-L358 HydrophobicContact CE2-CD2 4.04Å; F343-L358 HydrophobicContact CE2-CG 4.02Å; F343-L358 HydrophobicContact CZ-CD2 4.42Å; F343-L358 HydrophobicContact CZ-CG 4.22Å
344	P	94.8	Very high	95.7	Very high	16 Å²	16	61 Å²	61	10%	0.104	32%	0.322	C	S	.	.			trans	-62.5	127.9	178.4	-20	31.8	0	0	0	110.6	I317 Y319 E346 V347	I317-P344 HydrophobicContact CG2-CG 3.98Å; Y319-P344 WeakPolarHBondContact OH-CG 3.47Å; P344-E346 PolarHBondContact O-N 2.88Å; P344-E346 VanDerWaalsContact O-N 3.16Å; P344-V347 HydrophobicContact CB-CB 4.4Å; P344-V347 HydrophobicContact CB-CG2 3.95Å; P344-V347 HydrophobicContact CG-CG2 4.27Å; P344-V347 PolarHBondContact O-N 3.22Å; P344-V347 VanDerWaalsContact O-N 3.14Å
345	P	92.1	Very high	95.9	Very high	132 Å²	132	64.2 Å²	64.2	86%	0.857	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-22.8	-175.9	26.1	-35.3	0	0	0	113.2
346	E	91.1	Very high	96.3	Very high	106 Å²	106	62.9 Å²	62.9	50%	0.495	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-9.2	179.1	70.8	-88.9	-151.6	0	0	114.8	S264 P344	S264-E346 VanDerWaalsContact CB-OE1 3.26Å; S264-E346 WeakPolarHBondContact CB-OE1 3.21Å; S264-E346 PolarHBondContact N-OE1 2.91Å; P344-E346 PolarHBondContact O-N 2.88Å; P344-E346 VanDerWaalsContact O-N 3.16Å
347	V	92.8	Very high	96.5	Very high	30 Å²	30	61.1 Å²	61.1	18%	0.182	32%	0.323	C	S	.	.	S	Bend	trans	-100.4	123.8	-177.7	179.9	0	0	0	0	110.2	S264 I317 P344 I349	S264-V347 WeakPolarHBondContact OG-CG2 3.38Å; I317-V347 HydrophobicContact CD1-CB 4.24Å; I317-V347 HydrophobicContact CD1-CG1 3.63Å; P344-V347 HydrophobicContact CB-CB 4.4Å; P344-V347 HydrophobicContact CB-CG2 3.95Å; P344-V347 HydrophobicContact CG-CG2 4.27Å; P344-V347 PolarHBondContact O-N 3.22Å; P344-V347 VanDerWaalsContact O-N 3.14Å; V347-I349 PolarHBondContact O-N 3.03Å
348	P	93.6	Very high	96.6	Very high	121 Å²	121	63.1 Å²	63.1	79%	0.786	34%	0.336	S	S	*	.			trans	-70.7	126.3	177.3	29.5	-33.6	0	0	0	110.6
349	I	97.3	Very high	96.7	Very high	20 Å²	20	60.2 Å²	60.2	10%	0.103	32%	0.322	C	S	.	.			trans	-154.9	133.9	175.7	179	169.4	0	0	0	109.2	L316 I317 F343 V347 A353 K354 I357	L316-I349 HydrophobicContact CB-CD1 4.27Å; L316-I349 HydrophobicContact CD1-CD1 3.77Å; L316-I349 HydrophobicContact CD1-CG1 4.29Å; I317-I349 HydrophobicContact CD1-CD1 4.25Å; F343-I349 HydrophobicContact CD1-CD1 4.17Å; F343-I349 HydrophobicContact CE1-CD1 4.12Å; V347-I349 PolarHBondContact O-N 3.03Å; I349-A353 HydrophobicContact CD1-CB 4.01Å; I349-A353 HydrophobicContact CG1-CB 3.71Å; I349-K354 HydrophobicContact CD1-CG 4.08Å; I349-K354 HydrophobicContact CG1-CG 4.03Å; I349-K354 HydrophobicContact CG2-CD 4.28Å; I349-K354 HydrophobicContact CG2-CG 4.09Å; I349-K354 VanDerWaalsContact O-CE 3.27Å; I349-K354 WeakPolarHBondContact O-CE 3.39Å; I349-K354 PolarHBondContact O-NZ 3Å; I349-I357 HydrophobicContact CD1-CD1 4.02Å
350	S	98.3	Very high	96.8	Very high	36 Å²	36	54.1 Å²	54.1	25%	0.252	29%	0.293	S	S	.	.			trans	-69	155.9	-178.6	75.9	0	0	0	0	112.2	E186 K352 A353 K354	E186-S350 VanDerWaalsContact CD-OG 3.26Å; E186-S350 VanDerWaalsContact OE1-CB 3.23Å; E186-S350 WeakPolarHBondContact OE1-CB 3.31Å; E186-S350 PolarHBondContact OE1-N 3.02Å; E186-S350 PolarHBondContact OE1-OG 2.9Å; E186-S350 WeakPolarHBondContact OE2-CB 3.42Å; E186-S350 PolarHBondContact OE2-OG 2.84Å; S350-K352 PolarHBondContact O-N 3.21Å; S350-A353 PolarHBondContact O-N 3.07Å; S350-A353 WeakPolarHBondContact OG-CB 3.26Å; S350-A353 PolarHBondContact OG-N 2.95Å; S350-A353 VanDerWaalsContact OG-N 3.16Å; S350-K354 WeakPolarHBondContact O-CG 3.29Å; S350-K354 PolarHBondContact O-N 3.42Å
351	D	98.4	Very high	96.9	Very high	125 Å²	125	52.9 Å²	52.9	67%	0.668	29%	0.286	S	S	*	.	H	α-helix	trans	-66.6	-29.7	177.2	-62.4	-34	0	0	0	111.8	K354 D355	D351-K354 IonicContact OD1-NZ 2.79Å; D351-D355 VanDerWaalsContact O-CB 3.26Å; D351-D355 WeakPolarHBondContact O-CB 3.38Å; D351-D355 PolarHBondContact O-N 2.85Å
352	K	98.5	Very high	96.8	Very high	82 Å²	82	52.9 Å²	52.9	36%	0.357	29%	0.287	S	S	.	.	H	α-helix	trans	-62.2	-45.7	172.8	-68.7	179.9	169.7	-163.7	0	111.4	S350 L356 L380 F381 E383	S350-K352 PolarHBondContact O-N 3.21Å; K352-L356 PolarHBondContact O-N 3.33Å; K352-L356 VanDerWaalsContact O-N 3.11Å; K352-L380 HydrophobicContact CD-CB 4.37Å; K352-L380 WeakPolarHBondContact CD-O 3.43Å; K352-L380 HydrophobicContact CG-CB 4.38Å; K352-L380 PolarHBondContact NZ-O 3.45Å; K352-L380 VanDerWaalsContact NZ-O 3.15Å; K352-F381 HydrophobicContact CB-CB 4.31Å; K352-F381 HydrophobicContact CB-CD2 4.28Å; K352-E383 IonicContact NZ-OE2 3.23Å; K352-E383 PolarHBondContact NZ-OE2 3.27Å
353	A	98.6	Very high	96.7	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-66.6	-44.3	178.7	0	0	0	0	0	111.8	M312 L316 I349 S350 L356 I357 F381	M312-A353 HydrophobicContact CE-CB 3.92Å; L316-A353 HydrophobicContact CD1-CB 3.82Å; I349-A353 HydrophobicContact CD1-CB 4.01Å; I349-A353 HydrophobicContact CG1-CB 3.71Å; S350-A353 PolarHBondContact O-N 3.07Å; S350-A353 WeakPolarHBondContact OG-CB 3.26Å; S350-A353 PolarHBondContact OG-N 2.95Å; S350-A353 VanDerWaalsContact OG-N 3.16Å; A353-L356 PolarHBondContact O-N 3.43Å; A353-I357 WeakPolarHBondContact O-CG1 3.35Å; A353-I357 PolarHBondContact O-N 3.22Å; A353-F381 HydrophobicContact CB-CD2 3.93Å; A353-F381 HydrophobicContact CB-CE2 3.75Å
354	K	98.6	Very high	96.3	Very high	60 Å²	60	54 Å²	54	26%	0.261	28%	0.282	S	S	.	.	H	α-helix	trans	-59.7	-47.5	175.3	-68.4	175.1	-164	154.6	0	111.9	F343 I349 S350 D351 L356 I357 L358	F343-K354 HydrophobicContact CD1-CG 4.04Å; F343-K354 HydrophobicContact CD2-CD 4.34Å; F343-K354 HydrophobicContact CD2-CG 4.19Å; F343-K354 HydrophobicContact CE1-CB 4.34Å; F343-K354 HydrophobicContact CE1-CG 3.94Å; F343-K354 HydrophobicContact CE2-CB 4.1Å; F343-K354 HydrophobicContact CE2-CG 4.1Å; F343-K354 HydrophobicContact CG-CD 4.41Å; F343-K354 HydrophobicContact CG-CG 4.16Å; F343-K354 HydrophobicContact CZ-CB 3.94Å; F343-K354 HydrophobicContact CZ-CG 3.97Å; I349-K354 HydrophobicContact CD1-CG 4.08Å; I349-K354 HydrophobicContact CG1-CG 4.03Å; I349-K354 HydrophobicContact CG2-CD 4.28Å; I349-K354 HydrophobicContact CG2-CG 4.09Å; I349-K354 VanDerWaalsContact O-CE 3.27Å; I349-K354 WeakPolarHBondContact O-CE 3.39Å; I349-K354 PolarHBondContact O-NZ 3Å; S350-K354 WeakPolarHBondContact O-CG 3.29Å; S350-K354 PolarHBondContact O-N 3.42Å; D351-K354 IonicContact OD1-NZ 2.79Å; K354-L356 VanDerWaalsContact C-N 3.34Å; K354-L356 PolarHBondContact O-N 2.94Å; K354-I357 PolarHBondContact O-N 3.44Å; K354-L358 VanDerWaalsContact O-CG 3.29Å; K354-L358 WeakPolarHBondContact O-CG 3.49Å; K354-L358 PolarHBondContact O-N 3.3Å
355	D	98.6	Very high	96.1	Very high	69 Å²	69	58.1 Å²	58.1	37%	0.369	30%	0.3	S	S	.	.	H	α-helix	trans	-56.8	-48	178.6	175.7	74.9	0	0	0	111.3	D351 L358 R359	D351-D355 VanDerWaalsContact O-CB 3.26Å; D351-D355 WeakPolarHBondContact O-CB 3.38Å; D351-D355 PolarHBondContact O-N 2.85Å; D355-L358 PolarHBondContact O-N 3.15Å; D355-R359 WeakPolarHBondContact O-CB 3.29Å; D355-R359 WeakPolarHBondContact O-CG 3.16Å; D355-R359 PolarHBondContact O-N 3.34Å; D355-R359 IonicContact OD1-NE 2.9Å; D355-R359 IonicContact OD2-CZ 3.4Å; D355-R359 VanDerWaalsContact OD2-CZ 3.23Å; D355-R359 IonicContact OD2-NE 2.68Å; D355-R359 PolarHBondContact OD2-NE 3.27Å; D355-R359 IonicContact OD2-NH2 2.6Å; D355-R359 PolarHBondContact OD2-NH2 2.78Å
356	L	98.7	Very high	96.1	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.7	-42.6	179.6	178.4	54.5	0	0	0	112.5	M312 K352 A353 K354 L358 R359 F360 I368 N379 F381 F382	M312-L356 HydrophobicContact CE-CB 4.22Å; M312-L356 HydrophobicContact CE-CD2 3.99Å; M312-L356 HydrophobicContact CE-CG 4.31Å; M312-L356 HydrophobicContact SD-CB 4.34Å; M312-L356 HydrophobicContact SD-CD2 3.74Å; M312-L356 HydrophobicContact SD-CG 3.88Å; K352-L356 PolarHBondContact O-N 3.33Å; K352-L356 VanDerWaalsContact O-N 3.11Å; A353-L356 PolarHBondContact O-N 3.43Å; K354-L356 VanDerWaalsContact C-N 3.34Å; K354-L356 PolarHBondContact O-N 2.94Å; L356-L358 VanDerWaalsContact C-N 3.33Å; L356-L358 PolarHBondContact O-N 3.21Å; L356-R359 PolarHBondContact O-N 3.4Å; L356-F360 HydrophobicContact CD1-CD2 3.69Å; L356-F360 HydrophobicContact CD1-CE1 4.39Å; L356-F360 HydrophobicContact CD1-CE2 3.34Å; L356-F360 HydrophobicContact CD1-CG 4.37Å; L356-F360 HydrophobicContact CD1-CZ 3.73Å; L356-F360 HydrophobicContact CD2-CE2 3.86Å; L356-F360 HydrophobicContact CG-CD2 3.78Å; L356-F360 HydrophobicContact CG-CE2 3.48Å; L356-F360 VanDerWaalsContact CG-CE2 3.48Å; L356-F360 HydrophobicContact CG-CZ 4.31Å; L356-F360 WeakPolarHBondContact O-CD2 3.46Å; L356-F360 PolarHBondContact O-N 2.93Å; L356-I368 HydrophobicContact CD1-CD1 3.96Å; L356-I368 HydrophobicContact CD1-CG2 4.4Å; L356-N379 HydrophobicContact CD1-CB 4.44Å; L356-N379 WeakPolarHBondContact CD1-ND2 3.49Å; L356-F381 HydrophobicContact CB-CB 4.25Å; L356-F381 HydrophobicContact CD2-CB 3.8Å; L356-F381 HydrophobicContact CD2-CD1 3.47Å; L356-F381 VanDerWaalsContact CD2-CD1 3.47Å; L356-F381 HydrophobicContact CD2-CE1 4.35Å; L356-F381 HydrophobicContact CD2-CG 3.87Å; L356-F382 HydrophobicContact CD2-CD2 4.42Å; L356-F382 HydrophobicContact CD2-CE1 4.42Å; L356-F382 HydrophobicContact CD2-CE2 3.58Å; L356-F382 HydrophobicContact CD2-CZ 3.58Å
357	I	98.8	Very high	96.4	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-58.7	-46	175.1	-71.1	166	0	0	0	110.6	M312 Y313 L316 F343 I349 A353 K354 R359 F360 C361	M312-I357 HydrophobicContact CB-CG1 4.15Å; M312-I357 HydrophobicContact CE-CD1 4.47Å; M312-I357 HydrophobicContact CE-CG1 4.14Å; M312-I357 HydrophobicContact CG-CD1 4.13Å; M312-I357 HydrophobicContact CG-CG1 3.8Å; M312-I357 HydrophobicContact SD-CG1 3.79Å; Y313-I357 HydrophobicContact CD2-CD1 4.39Å; Y313-I357 HydrophobicContact CD2-CG2 4.19Å; L316-I357 HydrophobicContact CD1-CD1 4.26Å; F343-I357 HydrophobicContact CE1-CB 4.42Å; F343-I357 HydrophobicContact CE1-CD1 3.97Å; F343-I357 HydrophobicContact CE1-CG2 4.2Å; F343-I357 HydrophobicContact CZ-CB 4.19Å; F343-I357 HydrophobicContact CZ-CG2 3.98Å; I349-I357 HydrophobicContact CD1-CD1 4.02Å; A353-I357 WeakPolarHBondContact O-CG1 3.35Å; A353-I357 PolarHBondContact O-N 3.22Å; K354-I357 PolarHBondContact O-N 3.44Å; I357-R359 VanDerWaalsContact C-N 3.31Å; I357-R359 PolarHBondContact O-N 3.12Å; I357-F360 PolarHBondContact O-N 3.49Å; I357-C361 WeakPolarHBondContact O-CB 3.48Å; I357-C361 PolarHBondContact O-N 3.32Å
358	L	98.6	Very high	96.6	Very high	80 Å²	80	52.2 Å²	52.2	42%	0.419	26%	0.259	S	S	.	.	H	α-helix	trans	-64.5	-35.4	179	-69.8	172.4	0	0	0	112.1	L341 F343 K354 D355 L356 C361 C362	L341-L358 HydrophobicContact CD2-CD2 3.81Å; L341-L358 HydrophobicContact CG-CD2 4.25Å; F343-L358 HydrophobicContact CE2-CD1 4.21Å; F343-L358 HydrophobicContact CE2-CD2 4.04Å; F343-L358 HydrophobicContact CE2-CG 4.02Å; F343-L358 HydrophobicContact CZ-CD2 4.42Å; F343-L358 HydrophobicContact CZ-CG 4.22Å; K354-L358 VanDerWaalsContact O-CG 3.29Å; K354-L358 WeakPolarHBondContact O-CG 3.49Å; K354-L358 PolarHBondContact O-N 3.3Å; D355-L358 PolarHBondContact O-N 3.15Å; L356-L358 VanDerWaalsContact C-N 3.33Å; L356-L358 PolarHBondContact O-N 3.21Å; L358-C361 CarbonylContact O-C 3.56Å; L358-C361 PolarHBondContact O-N 3.27Å; L358-C362 WeakPolarHBondContact O-CB 3.49Å
359	R	98.2	Very high	96.6	Very high	82 Å²	82	46.5 Å²	46.5	31%	0.309	22%	0.222	S	C	.	.	H	α-helix	trans	-73.9	-27	175.8	-75.6	-160	-81.6	159.1	-22.5	114.1	D355 L356 I357 C362 I368 N379	D355-R359 WeakPolarHBondContact O-CB 3.29Å; D355-R359 WeakPolarHBondContact O-CG 3.16Å; D355-R359 PolarHBondContact O-N 3.34Å; D355-R359 IonicContact OD1-NE 2.9Å; D355-R359 IonicContact OD2-CZ 3.4Å; D355-R359 VanDerWaalsContact OD2-CZ 3.23Å; D355-R359 IonicContact OD2-NE 2.68Å; D355-R359 PolarHBondContact OD2-NE 3.27Å; D355-R359 IonicContact OD2-NH2 2.6Å; D355-R359 PolarHBondContact OD2-NH2 2.78Å; L356-R359 PolarHBondContact O-N 3.4Å; I357-R359 VanDerWaalsContact C-N 3.31Å; I357-R359 PolarHBondContact O-N 3.12Å; R359-C362 PolarHBondContact O-SG 3.5Å; R359-I368 HydrophobicContact CB-CB 4.12Å; R359-I368 HydrophobicContact CB-CG2 4.14Å; R359-I368 VanDerWaalsContact NH1-CD1 3.26Å; R359-I368 WeakPolarHBondContact O-CG2 3.29Å; R359-I368 PolarHBondContact O-N 3.47Å; R359-I368 VanDerWaalsContact O-N 3.09Å; R359-N379 PolarHBondContact NH1-ND2 3.15Å; R359-N379 PolarHBondContact NH2-ND2 2.53Å
360	F	98.6	Very high	96.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-75	-44	168.1	-78.2	-50.4	0	0	0	111.7	I193 W305 L308 M312 L356 I357 C362 R367 I368 I376	I193-F360 HydrophobicContact CG2-CE2 4.48Å; W305-F360 HydrophobicContact CB-CD1 4.06Å; W305-F360 HydrophobicContact CB-CE1 4.33Å; W305-F360 WeakPolarHBondContact O-CD1 3.47Å; L308-F360 HydrophobicContact CD2-CE1 4.34Å; L308-F360 HydrophobicContact CD2-CZ 3.96Å; L308-F360 HydrophobicContact CG-CZ 4.41Å; M312-F360 HydrophobicContact SD-CE2 4.37Å; L356-F360 HydrophobicContact CD1-CD2 3.69Å; L356-F360 HydrophobicContact CD1-CE1 4.39Å; L356-F360 HydrophobicContact CD1-CE2 3.34Å; L356-F360 HydrophobicContact CD1-CG 4.37Å; L356-F360 HydrophobicContact CD1-CZ 3.73Å; L356-F360 HydrophobicContact CD2-CE2 3.86Å; L356-F360 HydrophobicContact CG-CD2 3.78Å; L356-F360 HydrophobicContact CG-CE2 3.48Å; L356-F360 VanDerWaalsContact CG-CE2 3.48Å; L356-F360 HydrophobicContact CG-CZ 4.31Å; L356-F360 WeakPolarHBondContact O-CD2 3.46Å; L356-F360 PolarHBondContact O-N 2.93Å; I357-F360 PolarHBondContact O-N 3.49Å; F360-C362 PolarHBondContact O-N 3.3Å; F360-R367 WeakPolarHBondContact O-CD 3.41Å; F360-R367 VanDerWaalsContact O-CG 3.29Å; F360-R367 WeakPolarHBondContact O-CG 3.5Å; F360-R367 PolarHBondContact O-NE 3.33Å; F360-R367 VanDerWaalsContact O-NE 3.15Å; F360-I368 HydrophobicContact CD1-CG2 3.35Å; F360-I368 HydrophobicContact CE1-CG2 3.57Å; F360-I368 HydrophobicContact CG-CG2 4.03Å; F360-I368 HydrophobicContact CZ-CG2 4.42Å; F360-I376 HydrophobicContact CE1-CD1 4.16Å; F360-I376 HydrophobicContact CE1-CG1 4.34Å; F360-I376 HydrophobicContact CE1-CG2 4.08Å; F360-I376 HydrophobicContact CZ-CG2 3.8Å
361	C	98.1	Very high	96	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.262	C	S	.	.	S	Bend	trans	-97.7	57.1	-173.8	-62.3	0	0	0	0	112.4	W306 W337 L341 I357 L358	W306-C361 HydrophobicContact CD2-CB 4.49Å; W306-C361 VanDerWaalsContact CE3-CA 3.49Å; W306-C361 HydrophobicContact CE3-CB 4.18Å; W306-C361 HydrophobicContact CH2-CB 4.17Å; W306-C361 VanDerWaalsContact CZ3-CA 3.5Å; W306-C361 HydrophobicContact CZ3-CB 4.02Å; W337-C361 VanDerWaalsContact CE3-O 3.29Å; W337-C361 WeakPolarHBondContact CZ3-O 3.16Å; L341-C361 HydrophobicContact CD2-CB 3.58Å; I357-C361 WeakPolarHBondContact O-CB 3.48Å; I357-C361 PolarHBondContact O-N 3.32Å; L358-C361 CarbonylContact O-C 3.56Å; L358-C361 PolarHBondContact O-N 3.27Å
362	C	96.5	Very high	95.7	Very high	16 Å²	16	46.8 Å²	46.8	11%	0.108	24%	0.243	C	C	.	.	S	Bend	trans	-128.5	-172.9	173.1	69.7	0	0	0	0	112.9	W337 L358 R359 F360 W364 R367	W337-C362 VanDerWaalsContact CH2-CA 3.48Å; W337-C362 HydrophobicContact CH2-CB 3.89Å; W337-C362 HydrophobicContact CZ3-CB 4.27Å; L358-C362 WeakPolarHBondContact O-CB 3.49Å; R359-C362 PolarHBondContact O-SG 3.5Å; F360-C362 PolarHBondContact O-N 3.3Å; C362-W364 PolarHBondContact O-N 3.12Å; C362-R367 PolarHBondContact O-NE 2.88Å; C362-R367 PolarHBondContact O-NH2 3.09Å; C362-R367 WeakPolarHBondContact SG-CA 3.18Å
363	E	93.2	Very high	95.7	Very high	64 Å²	64	43.6 Å²	43.6	30%	0.299	23%	0.23	S	C	.	.			trans	-53	138.9	172.3	-62.8	92	161.3	0	0	111.1	W337 K338 E365 H366 R367	W337-E363 WeakPolarHBondContact CH2-OE2 3.47Å; W337-E363 HydrophobicContact CZ2-CG 3.94Å; K338-E363 WeakPolarHBondContact CE-OE1 3.16Å; K338-E363 IonicContact NZ-OE1 2.71Å; K338-E363 PolarHBondContact NZ-OE1 2.84Å; E363-E365 PolarHBondContact O-N 2.67Å; E363-H366 PolarHBondContact O-N 3.07Å; E363-H366 VanDerWaalsContact O-N 3.09Å; E363-R367 PolarHBondContact O-N 3.23Å
364	W	89.9	Confident	95.6	Very high	96 Å²	96	49.2 Å²	49.2	36%	0.364	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-26	-172.8	69.5	-86	0	0	0	112.8	E292 L302 C362 H366	E292-W364 HydrophobicContact CG-CB 4.38Å; L302-W364 HydrophobicContact CD1-CE3 4.41Å; L302-W364 WeakPolarHBondContact CD1-O 3.44Å; C362-W364 PolarHBondContact O-N 3.12Å; W364-H366 VanDerWaalsContact C-N 3.35Å
365	E	89.6	Confident	95.6	Very high	101 Å²	101	49.7 Å²	49.7	47%	0.472	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-29.8	176.7	-61.8	89.3	161.6	0	0	113.4	E363	E363-E365 PolarHBondContact O-N 2.67Å
366	H	92.8	Very high	95.5	Very high	144 Å²	144	46.4 Å²	46.4	67%	0.667	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.4	0.8	-177.8	-57.2	104.3	0	0	0	112.9	E363 W364 I368	E363-H366 PolarHBondContact O-N 3.07Å; E363-H366 VanDerWaalsContact O-N 3.09Å; W364-H366 VanDerWaalsContact C-N 3.35Å; H366-I368 PolarHBondContact O-N 3.47Å
367	R	96.8	Very high	95.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.25	C	S	.	.	S	Bend	trans	-64.3	133.6	-177.1	-169	175	-58.6	143.3	4.8	110.4	E292 L302 F360 C362 E363 G369 A370	E292-R367 IonicContact OE1-CZ 2.82Å; E292-R367 IonicContact OE1-NH1 3.55Å; E292-R367 PolarHBondContact OE1-NH1 3.33Å; E292-R367 IonicContact OE1-NH2 3.01Å; E292-R367 PolarHBondContact OE1-NH2 3.06Å; E292-R367 IonicContact OE2-CZ 3.72Å; E292-R367 IonicContact OE2-NH1 2.63Å; E292-R367 IonicContact OE2-NH2 3.03Å; E292-R367 PolarHBondContact OE2-NH2 2.86Å; L302-R367 WeakPolarHBondContact O-CD 3.16Å; L302-R367 PolarHBondContact O-NH1 3.4Å; F360-R367 WeakPolarHBondContact O-CD 3.41Å; F360-R367 VanDerWaalsContact O-CG 3.29Å; F360-R367 WeakPolarHBondContact O-CG 3.5Å; F360-R367 PolarHBondContact O-NE 3.33Å; F360-R367 VanDerWaalsContact O-NE 3.15Å; C362-R367 PolarHBondContact O-NE 2.88Å; C362-R367 PolarHBondContact O-NH2 3.09Å; C362-R367 WeakPolarHBondContact SG-CA 3.18Å; E363-R367 PolarHBondContact O-N 3.23Å; R367-G369 PolarHBondContact O-N 2.79Å; R367-A370 WeakPolarHBondContact O-CB 3.21Å; R367-A370 PolarHBondContact O-N 2.9Å
368	I	96.8	Very high	95.5	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	135.2	175.1	-161.8	179.2	0	0	0	110.3	L356 R359 F360 H366 E375 I376 N379	L356-I368 HydrophobicContact CD1-CD1 3.96Å; L356-I368 HydrophobicContact CD1-CG2 4.4Å; R359-I368 HydrophobicContact CB-CB 4.12Å; R359-I368 HydrophobicContact CB-CG2 4.14Å; R359-I368 VanDerWaalsContact NH1-CD1 3.26Å; R359-I368 WeakPolarHBondContact O-CG2 3.29Å; R359-I368 PolarHBondContact O-N 3.47Å; R359-I368 VanDerWaalsContact O-N 3.09Å; F360-I368 HydrophobicContact CD1-CG2 3.35Å; F360-I368 HydrophobicContact CE1-CG2 3.57Å; F360-I368 HydrophobicContact CG-CG2 4.03Å; F360-I368 HydrophobicContact CZ-CG2 4.42Å; H366-I368 PolarHBondContact O-N 3.47Å; I368-E375 WeakPolarHBondContact CD1-O 3.47Å; I368-E375 HydrophobicContact CG1-CB 4.29Å; I368-E375 HydrophobicContact CG1-CG 3.8Å; I368-I376 HydrophobicContact CB-CG1 4.48Å; I368-I376 HydrophobicContact CD1-CB 4.46Å; I368-I376 HydrophobicContact CD1-CG1 4.33Å; I368-I376 HydrophobicContact CG1-CG1 3.91Å; I368-I376 HydrophobicContact CG2-CG1 4.25Å; I368-N379 HydrophobicContact CD1-CB 4.34Å
369	G	94.4	Very high	95.5	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.01	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.7	-6.3	-171.7	0	0	0	0	0	114	L302 R367 S371 G372 E375	L302-G369 WeakPolarHBondContact CD2-O 3.37Å; R367-G369 PolarHBondContact O-N 2.79Å; G369-S371 VanDerWaalsContact C-N 3.27Å; G369-S371 PolarHBondContact O-N 3.34Å; G369-G372 WeakPolarHBondContact CA-O 3.21Å; G369-G372 PolarHBondContact O-N 2.93Å; G369-G372 VanDerWaalsContact O-N 3.15Å; G369-E375 PolarHBondContact N-OE2 3.2Å
370	A	91.6	Very high	95.5	Very high	47 Å²	47	50.8 Å²	50.8	39%	0.388	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-38.4	175.3	0	0	0	0	0	111.8	L302 R367 G372	L302-A370 HydrophobicContact CD1-CB 3.83Å; L302-A370 HydrophobicContact CD2-CB 4.5Å; R367-A370 WeakPolarHBondContact O-CB 3.21Å; R367-A370 PolarHBondContact O-N 2.9Å; A370-G372 VanDerWaalsContact C-N 3.34Å
371	S	90.7	Very high	95.5	Very high	115 Å²	115	51.2 Å²	51.2	80%	0.804	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	1.3	178.5	-63.8	0	0	0	0	113.1	G369	G369-S371 VanDerWaalsContact C-N 3.27Å; G369-S371 PolarHBondContact O-N 3.34Å
372	G	93.3	Very high	95.5	Very high	26 Å²	26	51.5 Å²	51.5	27%	0.268	28%	0.279	S	S	.	.			trans	122.7	163.3	-179.2	0	0	0	0	0	112.9	G369 A370 E374 E375	G369-G372 WeakPolarHBondContact CA-O 3.21Å; G369-G372 PolarHBondContact O-N 2.93Å; G369-G372 VanDerWaalsContact O-N 3.15Å; A370-G372 VanDerWaalsContact C-N 3.34Å; G372-E374 PolarHBondContact O-N 3.01Å; G372-E375 WeakPolarHBondContact O-CB 2.99Å; G372-E375 PolarHBondContact O-N 2.97Å
373	V	96.9	Very high	95.5	Very high	15 Å²	15	56.9 Å²	56.9	9%	0.091	30%	0.303	C	S	.	.	H	α-helix	trans	-61.8	-26.6	-174.4	71.3	0	0	0	0	113.4	V197 D201 E375 I376 K377	V197-V373 HydrophobicContact CG1-CG2 3.53Å; D201-V373 HydrophobicContact CB-CB 4.22Å; D201-V373 HydrophobicContact CB-CG2 3.84Å; D201-V373 WeakPolarHBondContact OD2-CG1 3.31Å; V373-E375 PolarHBondContact O-N 3.08Å; V373-I376 WeakPolarHBondContact O-CA 3.17Å; V373-I376 VanDerWaalsContact O-CB 3.31Å; V373-I376 WeakPolarHBondContact O-CB 3.12Å; V373-I376 PolarHBondContact O-N 2.64Å; V373-K377 HydrophobicContact CG2-CG 4.39Å; V373-K377 PolarHBondContact O-N 3.22Å
374	E	97.6	Very high	95.7	Very high	117 Å²	117	57.4 Å²	57.4	55%	0.547	33%	0.326	S	S	.	.	H	α-helix	trans	-62.6	-27.8	-179.6	-60.8	-52.4	130.8	0	0	112.9	G372 I376 K377 S378	G372-E374 PolarHBondContact O-N 3.01Å; E374-I376 VanDerWaalsContact C-N 3.28Å; E374-I376 PolarHBondContact O-N 2.83Å; E374-K377 PolarHBondContact O-N 3.43Å; E374-K377 IonicContact OE1-NZ 2.68Å; E374-K377 PolarHBondContact OE1-NZ 3.41Å; E374-S378 WeakPolarHBondContact O-CB 3.26Å; E374-S378 PolarHBondContact O-N 3.25Å; E374-S378 PolarHBondContact O-OG 3.16Å
375	E	97.4	Very high	96.1	Very high	70 Å²	70	54 Å²	54	33%	0.327	32%	0.316	S	S	.	.	H	α-helix	trans	-63.1	-37.3	171.9	-166	-168.5	-176	0	0	111.6	I368 G369 G372 V373 S378	I368-E375 WeakPolarHBondContact CD1-O 3.47Å; I368-E375 HydrophobicContact CG1-CB 4.29Å; I368-E375 HydrophobicContact CG1-CG 3.8Å; G369-E375 PolarHBondContact N-OE2 3.2Å; G372-E375 WeakPolarHBondContact O-CB 2.99Å; G372-E375 PolarHBondContact O-N 2.97Å; V373-E375 PolarHBondContact O-N 3.08Å; E375-S378 PolarHBondContact O-OG 3.3Å
376	I	98.3	Very high	96.4	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-70.8	-50.5	175.7	-54.9	171	0	0	0	109.3	V197 W305 F360 I368 V373 E374 S378 N379 F382	V197-I376 HydrophobicContact CG1-CB 4.44Å; V197-I376 HydrophobicContact CG1-CG2 4.08Å; V197-I376 HydrophobicContact CG2-CG2 3.71Å; W305-I376 HydrophobicContact CD2-CD1 3.66Å; W305-I376 HydrophobicContact CE3-CD1 3.88Å; W305-I376 HydrophobicContact CG-CD1 4.17Å; W305-I376 HydrophobicContact CH2-CD1 4.1Å; W305-I376 HydrophobicContact CZ2-CD1 3.88Å; W305-I376 HydrophobicContact CZ3-CD1 4.1Å; F360-I376 HydrophobicContact CE1-CD1 4.16Å; F360-I376 HydrophobicContact CE1-CG1 4.34Å; F360-I376 HydrophobicContact CE1-CG2 4.08Å; F360-I376 HydrophobicContact CZ-CG2 3.8Å; I368-I376 HydrophobicContact CB-CG1 4.48Å; I368-I376 HydrophobicContact CD1-CB 4.46Å; I368-I376 HydrophobicContact CD1-CG1 4.33Å; I368-I376 HydrophobicContact CG1-CG1 3.91Å; I368-I376 HydrophobicContact CG2-CG1 4.25Å; V373-I376 WeakPolarHBondContact O-CA 3.17Å; V373-I376 VanDerWaalsContact O-CB 3.31Å; V373-I376 WeakPolarHBondContact O-CB 3.12Å; V373-I376 PolarHBondContact O-N 2.64Å; E374-I376 VanDerWaalsContact C-N 3.28Å; E374-I376 PolarHBondContact O-N 2.83Å; I376-S378 PolarHBondContact O-N 3.22Å; I376-N379 VanDerWaalsContact O-CB 3.23Å; I376-N379 WeakPolarHBondContact O-CB 3.48Å; I376-N379 PolarHBondContact O-N 2.86Å; I376-N379 VanDerWaalsContact O-N 3.09Å; I376-F382 HydrophobicContact CG2-CE2 3.79Å; I376-F382 HydrophobicContact CG2-CZ 4.37Å; I376-F382 WeakPolarHBondContact O-CD2 3.46Å; I376-F382 WeakPolarHBondContact O-CE2 3.34Å
377	K	98.3	Very high	96.7	Very high	41 Å²	41	46.7 Å²	46.7	18%	0.178	28%	0.281	C	S	.	.	H	α-helix	trans	-60.7	-29.8	-175.8	-64.5	-176.3	-172	163.7	0	114	V373 E374 N379 W387	V373-K377 HydrophobicContact CG2-CG 4.39Å; V373-K377 PolarHBondContact O-N 3.22Å; E374-K377 PolarHBondContact O-N 3.43Å; E374-K377 IonicContact OE1-NZ 2.68Å; E374-K377 PolarHBondContact OE1-NZ 3.41Å; K377-N379 VanDerWaalsContact C-N 3.34Å; K377-W387 HydrophobicContact CB-CD2 4.12Å; K377-W387 HydrophobicContact CB-CG 4.49Å; K377-W387 HydrophobicContact CB-CH2 4.48Å; K377-W387 HydrophobicContact CB-CZ2 3.86Å; K377-W387 HydrophobicContact CD-CB 4.48Å; K377-W387 HydrophobicContact CD-CD2 3.87Å; K377-W387 HydrophobicContact CD-CE3 4.1Å; K377-W387 HydrophobicContact CD-CG 4.04Å; K377-W387 HydrophobicContact CG-CD2 3.73Å; K377-W387 HydrophobicContact CG-CE3 3.91Å; K377-W387 HydrophobicContact CG-CG 4.31Å; K377-W387 HydrophobicContact CG-CH2 3.98Å; K377-W387 HydrophobicContact CG-CZ2 3.83Å; K377-W387 HydrophobicContact CG-CZ3 4.01Å; K377-W387 PolarHBondContact O-NE1 3.22Å
378	S	97.6	Very high	96.6	Very high	93 Å²	93	53.8 Å²	53.8	65%	0.65	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	0.6	179.9	57	0	0	0	0	114.4	E374 E375 I376	E374-S378 WeakPolarHBondContact O-CB 3.26Å; E374-S378 PolarHBondContact O-N 3.25Å; E374-S378 PolarHBondContact O-OG 3.16Å; E375-S378 PolarHBondContact O-OG 3.3Å; I376-S378 PolarHBondContact O-N 3.22Å
379	N	98.3	Very high	96.6	Very high	6 Å²	6	58.1 Å²	58.1	3%	0.032	33%	0.334	C	S	.	.	S	Bend	trans	-63.8	139.3	176.1	-173.9	-51.5	0	0	0	111.5	L356 R359 I368 I376 K377 F381 F382	L356-N379 HydrophobicContact CD1-CB 4.44Å; L356-N379 WeakPolarHBondContact CD1-ND2 3.49Å; R359-N379 PolarHBondContact NH1-ND2 3.15Å; R359-N379 PolarHBondContact NH2-ND2 2.53Å; I368-N379 HydrophobicContact CD1-CB 4.34Å; I376-N379 VanDerWaalsContact O-CB 3.23Å; I376-N379 WeakPolarHBondContact O-CB 3.48Å; I376-N379 PolarHBondContact O-N 2.86Å; I376-N379 VanDerWaalsContact O-N 3.09Å; K377-N379 VanDerWaalsContact C-N 3.34Å; N379-F381 PolarHBondContact O-N 2.73Å; N379-F381 VanDerWaalsContact O-N 3.11Å; N379-F381 WeakPolarHBondContact OD1-CB 3.36Å; N379-F381 PolarHBondContact OD1-N 3.06Å; N379-F382 HydrophobicContact CB-CD2 3.92Å; N379-F382 HydrophobicContact CB-CE2 4.28Å; N379-F382 PolarHBondContact O-N 2.99Å
380	L	98.1	Very high	96.7	Very high	114 Å²	114	58.8 Å²	58.8	60%	0.597	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-58.5	-22.4	179.4	-67.6	176.5	0	0	0	114.8	K352 F382 E383	K352-L380 HydrophobicContact CD-CB 4.37Å; K352-L380 WeakPolarHBondContact CD-O 3.43Å; K352-L380 HydrophobicContact CG-CB 4.38Å; K352-L380 PolarHBondContact NZ-O 3.45Å; K352-L380 VanDerWaalsContact NZ-O 3.15Å; L380-F382 PolarHBondContact O-N 3.38Å; L380-E383 WeakPolarHBondContact O-CB 3.33Å; L380-E383 PolarHBondContact O-N 3.06Å
381	F	98.7	Very high	96.9	Very high	9 Å²	9	58 Å²	58	4%	0.039	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-64.5	-28.3	172.1	-178.3	-102.5	0	0	0	112	E186 T189 Q190 M312 K352 A353 L356 N379 E383	E186-F381 HydrophobicContact CB-CE2 4.44Å; T189-F381 HydrophobicContact CG2-CZ 4.27Å; Q190-F381 HydrophobicContact CB-CE1 3.93Å; Q190-F381 HydrophobicContact CB-CZ 4.03Å; Q190-F381 HydrophobicContact CG-CE1 4.19Å; Q190-F381 PolarHBondContact NE2-O 2.8Å; M312-F381 HydrophobicContact CE-CD1 3.78Å; M312-F381 HydrophobicContact CE-CD2 3.98Å; M312-F381 HydrophobicContact CE-CE1 3.5Å; M312-F381 HydrophobicContact CE-CE2 3.76Å; M312-F381 HydrophobicContact CE-CG 4Å; M312-F381 HydrophobicContact CE-CZ 3.52Å; M312-F381 HydrophobicContact SD-CE1 4.39Å; K352-F381 HydrophobicContact CB-CB 4.31Å; K352-F381 HydrophobicContact CB-CD2 4.28Å; A353-F381 HydrophobicContact CB-CD2 3.93Å; A353-F381 HydrophobicContact CB-CE2 3.75Å; L356-F381 HydrophobicContact CB-CB 4.25Å; L356-F381 HydrophobicContact CD2-CB 3.8Å; L356-F381 HydrophobicContact CD2-CD1 3.47Å; L356-F381 VanDerWaalsContact CD2-CD1 3.47Å; L356-F381 HydrophobicContact CD2-CE1 4.35Å; L356-F381 HydrophobicContact CD2-CG 3.87Å; N379-F381 PolarHBondContact O-N 2.73Å; N379-F381 VanDerWaalsContact O-N 3.11Å; N379-F381 WeakPolarHBondContact OD1-CB 3.36Å; N379-F381 PolarHBondContact OD1-N 3.06Å; F381-E383 VanDerWaalsContact C-N 3.33Å
382	F	98.6	Very high	97.1	Very high	6 Å²	6	58.8 Å²	58.8	3%	0.026	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-94.3	19.1	177.4	-57.7	-65.1	0	0	0	113.5	Q190 I193 A194 V197 L356 I376 N379 L380 G384 V385 W387	Q190-F382 HydrophobicContact CG-CD1 4.04Å; I193-F382 HydrophobicContact CB-CE1 4.31Å; I193-F382 HydrophobicContact CG2-CE1 3.88Å; I193-F382 HydrophobicContact CG2-CZ 3.7Å; A194-F382 HydrophobicContact CB-CD1 4.15Å; A194-F382 HydrophobicContact CB-CE1 4.13Å; V197-F382 HydrophobicContact CG2-CZ 4.44Å; L356-F382 HydrophobicContact CD2-CD2 4.42Å; L356-F382 HydrophobicContact CD2-CE1 4.42Å; L356-F382 HydrophobicContact CD2-CE2 3.58Å; L356-F382 HydrophobicContact CD2-CZ 3.58Å; I376-F382 HydrophobicContact CG2-CE2 3.79Å; I376-F382 HydrophobicContact CG2-CZ 4.37Å; I376-F382 WeakPolarHBondContact O-CD2 3.46Å; I376-F382 WeakPolarHBondContact O-CE2 3.34Å; N379-F382 HydrophobicContact CB-CD2 3.92Å; N379-F382 HydrophobicContact CB-CE2 4.28Å; N379-F382 PolarHBondContact O-N 2.99Å; L380-F382 PolarHBondContact O-N 3.38Å; F382-G384 PolarHBondContact O-N 3.29Å; F382-V385 HydrophobicContact CB-CB 4.25Å; F382-V385 HydrophobicContact CB-CG2 3.93Å; F382-V385 HydrophobicContact CD1-CG2 4.2Å; F382-V385 WeakPolarHBondContact O-CB 3.44Å; F382-V385 WeakPolarHBondContact O-CG2 3.2Å; F382-V385 PolarHBondContact O-N 2.96Å; F382-W387 HydrophobicContact CB-CZ2 3.79Å; F382-W387 HydrophobicContact CD1-CH2 4.15Å; F382-W387 AromaticContact CD1-CZ2 3.93Å; F382-W387 HydrophobicContact CD1-CZ2 3.93Å; F382-W387 HydrophobicContact CD2-CH2 4.3Å; F382-W387 AromaticContact CD2-CZ2 3.84Å; F382-W387 HydrophobicContact CD2-CZ2 3.84Å; F382-W387 HydrophobicContact CE1-CH2 4.25Å; F382-W387 HydrophobicContact CE1-CZ2 4.45Å; F382-W387 HydrophobicContact CE2-CH2 4.41Å; F382-W387 HydrophobicContact CE2-CZ2 4.39Å; F382-W387 HydrophobicContact CG-CH2 4.18Å; F382-W387 AromaticContact CG-CZ2 3.59Å; F382-W387 HydrophobicContact CG-CZ2 3.59Å; F382-W387 HydrophobicContact CZ-CH2 4.38Å
383	E	97.5	Very high	97	Very high	129 Å²	129	63.5 Å²	63.5	60%	0.603	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	126.5	172.2	-174.5	175.8	-172.4	0	0	110.3	Q190 K352 L380 F381	Q190-E383 PolarHBondContact NE2-O 3.21Å; K352-E383 IonicContact NZ-OE2 3.23Å; K352-E383 PolarHBondContact NZ-OE2 3.27Å; L380-E383 WeakPolarHBondContact O-CB 3.33Å; L380-E383 PolarHBondContact O-N 3.06Å; F381-E383 VanDerWaalsContact C-N 3.33Å
384	G	96.5	Very high	97	Very high	75 Å²	75	68.6 Å²	68.6	77%	0.773	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.8	-7.9	-177.8	0	0	0	0	0	115.4	F382 D386	F382-G384 PolarHBondContact O-N 3.29Å; G384-D386 PolarHBondContact O-N 3.33Å
385	V	98	Very high	96.9	Very high	26 Å²	26	63.6 Å²	63.6	16%	0.158	34%	0.337	C	S	.	.			trans	-73.5	126.1	177.3	177.9	0	0	0	0	110.8	Q190 A194 F382 W387 I390	Q190-V385 VanDerWaalsContact CD-CG2 3.49Å; Q190-V385 HydrophobicContact CG-CG2 3.67Å; A194-V385 HydrophobicContact CB-CG1 3.91Å; A194-V385 HydrophobicContact CB-CG2 4.49Å; F382-V385 HydrophobicContact CB-CB 4.25Å; F382-V385 HydrophobicContact CB-CG2 3.93Å; F382-V385 HydrophobicContact CD1-CG2 4.2Å; F382-V385 WeakPolarHBondContact O-CB 3.44Å; F382-V385 WeakPolarHBondContact O-CG2 3.2Å; F382-V385 PolarHBondContact O-N 2.96Å; V385-W387 HydrophobicContact CG1-CD2 3.9Å; V385-W387 HydrophobicContact CG1-CE3 4.42Å; V385-W387 HydrophobicContact CG1-CG 4.19Å; V385-W387 HydrophobicContact CG1-CZ2 4.13Å; V385-I390 HydrophobicContact CG1-CD1 4.19Å
386	D	97.4	Very high	96.9	Very high	45 Å²	45	62.3 Å²	62.3	24%	0.241	34%	0.339	C	S	.	.			trans	-93.4	96.7	169.6	-173.6	-26.9	0	0	0	109.6	G384 E388 H389 I390 R393	G384-D386 PolarHBondContact O-N 3.33Å; D386-E388 PolarHBondContact O-N 2.68Å; D386-E388 PolarHBondContact OD1-N 3.06Å; D386-E388 VanDerWaalsContact OD1-N 3.11Å; D386-H389 VanDerWaalsContact CG-ND1 3.34Å; D386-H389 PolarHBondContact O-N 3.24Å; D386-H389 IonicContact OD1-CG 3.8Å; D386-H389 PolarHBondContact OD1-N 3.41Å; D386-H389 IonicContact OD1-ND1 3.87Å; D386-H389 PolarHBondContact OD1-ND1 3.09Å; D386-H389 IonicContact OD2-CG 3.45Å; D386-H389 IonicContact OD2-ND1 2.71Å; D386-H389 PolarHBondContact OD2-ND1 3Å; D386-I390 VanDerWaalsContact O-CB 3.28Å; D386-I390 WeakPolarHBondContact O-CB 3.36Å; D386-I390 PolarHBondContact O-N 3.18Å; D386-R393 VanDerWaalsContact CB-NH1 3.29Å; D386-R393 IonicContact OD2-CZ 2.71Å; D386-R393 VanDerWaalsContact OD2-CZ 3.3Å; D386-R393 IonicContact OD2-NH1 3.62Å; D386-R393 IonicContact OD2-NH2 2.6Å; D386-R393 PolarHBondContact OD2-NH2 3.1Å
387	W	97.7	Very high	96.8	Very high	45 Å²	45	63.6 Å²	63.6	17%	0.17	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-18.7	-175.8	-66.6	97.4	0	0	0	114.8	A194 V197 L198 K377 F382 V385	A194-W387 HydrophobicContact CB-CE3 4.47Å; A194-W387 HydrophobicContact CB-CH2 3.66Å; A194-W387 HydrophobicContact CB-CZ2 4.29Å; A194-W387 HydrophobicContact CB-CZ3 3.77Å; A194-W387 VanDerWaalsContact O-CZ3 3.27Å; A194-W387 WeakPolarHBondContact O-CZ3 3.49Å; V197-W387 HydrophobicContact CB-CH2 4.12Å; V197-W387 HydrophobicContact CB-CZ3 3.94Å; V197-W387 HydrophobicContact CG1-CH2 4.12Å; V197-W387 HydrophobicContact CG1-CZ3 3.93Å; V197-W387 HydrophobicContact CG2-CH2 4.47Å; L198-W387 HydrophobicContact CD1-CE3 4.09Å; L198-W387 HydrophobicContact CD2-CE3 3.77Å; L198-W387 HydrophobicContact CD2-CZ3 4.28Å; L198-W387 HydrophobicContact CG-CE3 3.78Å; L198-W387 HydrophobicContact CG-CZ3 4.04Å; K377-W387 HydrophobicContact CB-CD2 4.12Å; K377-W387 HydrophobicContact CB-CG 4.49Å; K377-W387 HydrophobicContact CB-CH2 4.48Å; K377-W387 HydrophobicContact CB-CZ2 3.86Å; K377-W387 HydrophobicContact CD-CB 4.48Å; K377-W387 HydrophobicContact CD-CD2 3.87Å; K377-W387 HydrophobicContact CD-CE3 4.1Å; K377-W387 HydrophobicContact CD-CG 4.04Å; K377-W387 HydrophobicContact CG-CD2 3.73Å; K377-W387 HydrophobicContact CG-CE3 3.91Å; K377-W387 HydrophobicContact CG-CG 4.31Å; K377-W387 HydrophobicContact CG-CH2 3.98Å; K377-W387 HydrophobicContact CG-CZ2 3.83Å; K377-W387 HydrophobicContact CG-CZ3 4.01Å; K377-W387 PolarHBondContact O-NE1 3.22Å; F382-W387 HydrophobicContact CB-CZ2 3.79Å; F382-W387 HydrophobicContact CD1-CH2 4.15Å; F382-W387 AromaticContact CD1-CZ2 3.93Å; F382-W387 HydrophobicContact CD1-CZ2 3.93Å; F382-W387 HydrophobicContact CD2-CH2 4.3Å; F382-W387 AromaticContact CD2-CZ2 3.84Å; F382-W387 HydrophobicContact CD2-CZ2 3.84Å; F382-W387 HydrophobicContact CE1-CH2 4.25Å; F382-W387 HydrophobicContact CE1-CZ2 4.45Å; F382-W387 HydrophobicContact CE2-CH2 4.41Å; F382-W387 HydrophobicContact CE2-CZ2 4.39Å; F382-W387 HydrophobicContact CG-CH2 4.18Å; F382-W387 AromaticContact CG-CZ2 3.59Å; F382-W387 HydrophobicContact CG-CZ2 3.59Å; F382-W387 HydrophobicContact CZ-CH2 4.38Å; V385-W387 HydrophobicContact CG1-CD2 3.9Å; V385-W387 HydrophobicContact CG1-CE3 4.42Å; V385-W387 HydrophobicContact CG1-CG 4.19Å; V385-W387 HydrophobicContact CG1-CZ2 4.13Å
388	E	95.6	Very high	96.6	Very high	150 Å²	150	66.2 Å²	66.2	70%	0.701	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-37.7	-179.9	-171.3	64.5	-154.7	0	0	110.9	D386	D386-E388 PolarHBondContact O-N 2.68Å; D386-E388 PolarHBondContact OD1-N 3.06Å; D386-E388 VanDerWaalsContact OD1-N 3.11Å
389	H	96.4	Very high	96.4	Very high	90 Å²	90	63.1 Å²	63.1	42%	0.417	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	8.6	-171.4	-50.6	97.7	0	0	0	114.7	D386 R391 E392 R393	D386-H389 VanDerWaalsContact CG-ND1 3.34Å; D386-H389 PolarHBondContact O-N 3.24Å; D386-H389 IonicContact OD1-CG 3.8Å; D386-H389 PolarHBondContact OD1-N 3.41Å; D386-H389 IonicContact OD1-ND1 3.87Å; D386-H389 PolarHBondContact OD1-ND1 3.09Å; D386-H389 IonicContact OD2-CG 3.45Å; D386-H389 IonicContact OD2-ND1 2.71Å; D386-H389 PolarHBondContact OD2-ND1 3Å; H389-R391 PolarHBondContact O-N 3.06Å; H389-E392 WeakPolarHBondContact CA-OE2 3.36Å; H389-E392 PolarHBondContact O-N 3.02Å; H389-R393 WeakPolarHBondContact O-CG 3Å; H389-R393 PolarHBondContact O-N 3.33Å
390	I	97.3	Very high	96.1	Very high	15 Å²	15	71 Å²	71	8%	0.077	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-34.7	-174.5	-171.6	167.6	0	0	0	112.3	W148 F191 A194 E195 L198 V385 D386	W148-I390 HydrophobicContact CH2-CG2 4.22Å; F191-I390 HydrophobicContact CD2-CD1 4.03Å; F191-I390 HydrophobicContact CD2-CG1 3.99Å; F191-I390 HydrophobicContact CE2-CD1 4.17Å; F191-I390 HydrophobicContact CE2-CG1 3.7Å; A194-I390 HydrophobicContact CB-CD1 3.75Å; E195-I390 HydrophobicContact CG-CD1 3.77Å; E195-I390 HydrophobicContact CG-CG1 4.07Å; E195-I390 HydrophobicContact CG-CG2 4.49Å; L198-I390 HydrophobicContact CD1-CG2 3.65Å; V385-I390 HydrophobicContact CG1-CD1 4.19Å; D386-I390 VanDerWaalsContact O-CB 3.28Å; D386-I390 WeakPolarHBondContact O-CB 3.36Å; D386-I390 PolarHBondContact O-N 3.18Å
391	R	95.9	Very high	95.8	Very high	30 Å²	30	68.3 Å²	68.3	11%	0.113	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-19.1	-176	-154.9	-176.9	-179.7	86.1	12	113.3	W148 D221 H225 V226 H389 R393	W148-R391 HydrophobicContact CH2-CB 4.11Å; W148-R391 HydrophobicContact CH2-CG 4.25Å; W148-R391 HydrophobicContact CZ2-CB 4.48Å; D221-R391 IonicContact OD2-CZ 3.3Å; D221-R391 IonicContact OD2-NH2 2.64Å; D221-R391 PolarHBondContact OD2-NH2 3.49Å; H225-R391 HydrophobicContact CB-CG 4.24Å; H225-R391 PolarHBondContact CE1-O 3.09Å; H225-R391 PolarHBondContact NE2-O 3.21Å; V226-R391 PolarHBondContact O-NH1 3.44Å; V226-R391 PolarHBondContact O-NH2 3.25Å; H389-R391 PolarHBondContact O-N 3.06Å; R391-R393 VanDerWaalsContact C-N 3.34Å
392	E	93.7	Very high	95.5	Very high	132 Å²	132	77.4 Å²	77.4	62%	0.617	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-14.4	177.1	-65.9	70.3	-155.4	0	0	111.9	H389	H389-E392 WeakPolarHBondContact CA-OE2 3.36Å; H389-E392 PolarHBondContact O-N 3.02Å
393	R	92.1	Very high	95.2	Very high	126 Å²	126	79.7 Å²	79.7	48%	0.475	42%	0.423	S	S	.	.	S	Bend	trans	-93.4	161.7	178.7	-70.6	176.3	-176.3	177.4	7.8	111.5	H225 D386 H389 R391 A395	H225-R393 PolarHBondContact CE1-O 3.18Å; H225-R393 PolarHBondContact NE2-O 3.4Å; H225-R393 VanDerWaalsContact NE2-O 3.12Å; D386-R393 VanDerWaalsContact CB-NH1 3.29Å; D386-R393 IonicContact OD2-CZ 2.71Å; D386-R393 VanDerWaalsContact OD2-CZ 3.3Å; D386-R393 IonicContact OD2-NH1 3.62Å; D386-R393 IonicContact OD2-NH2 2.6Å; D386-R393 PolarHBondContact OD2-NH2 3.1Å; H389-R393 WeakPolarHBondContact O-CG 3Å; H389-R393 PolarHBondContact O-N 3.33Å; R391-R393 VanDerWaalsContact C-N 3.34Å; R393-A395 PolarHBondContact O-N 3.49Å
394	P	95.9	Very high	94.8	Very high	121 Å²	121	79.7 Å²	79.7	79%	0.786	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-56.6	136.4	172.8	-23.3	34.2	0	0	0	111.6
395	A	96.8	Very high	94.5	Very high	12 Å²	12	79.6 Å²	79.6	10%	0.099	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-67.4	157.8	173.8	0	0	0	0	0	112	F191 K223 G224 R393 I397	F191-A395 HydrophobicContact CE1-CB 3.75Å; F191-A395 VanDerWaalsContact CZ-CA 3.43Å; F191-A395 HydrophobicContact CZ-CB 3.62Å; K223-A395 VanDerWaalsContact O-CB 3.3Å; K223-A395 WeakPolarHBondContact O-CB 3.35Å; G224-A395 WeakPolarHBondContact O-CB 3.22Å; R393-A395 PolarHBondContact O-N 3.49Å; A395-I397 VanDerWaalsContact C-N 3.25Å; A395-I397 PolarHBondContact O-N 2.99Å
396	A	96.9	Very high	94.2	Very high	44 Å²	44	79.2 Å²	79.2	36%	0.364	41%	0.405	S	S	.	.	S	Bend	trans	-59.4	-34.8	-180	0	0	0	0	0	113.3	E188 F191	E188-A396 HydrophobicContact CB-CB 4.36Å; E188-A396 HydrophobicContact CG-CB 4.15Å; F191-A396 HydrophobicContact CB-CB 3.69Å; F191-A396 HydrophobicContact CD1-CB 3.71Å; F191-A396 HydrophobicContact CD2-CB 4.45Å; F191-A396 HydrophobicContact CG-CB 3.68Å
397	I	96.2	Very high	94.1	Very high	27 Å²	27	78 Å²	78	14%	0.138	40%	0.399	C	S	.	.	S	Bend	trans	-122.5	122.8	174.5	-52.1	176.3	0	0	0	108.6	L177 K181 L184 E188 Y192 A395	L177-I397 HydrophobicContact CD1-CD1 4.16Å; L177-I397 HydrophobicContact CD2-CD1 4.03Å; K181-I397 HydrophobicContact CD-CD1 3.74Å; L184-I397 HydrophobicContact CD2-CD1 4.04Å; E188-I397 HydrophobicContact CG-CD1 4.27Å; E188-I397 HydrophobicContact CG-CG1 4.05Å; E188-I397 WeakPolarHBondContact OE1-CD1 3.47Å; E188-I397 WeakPolarHBondContact OE1-CG1 3.2Å; Y192-I397 HydrophobicContact CE2-CD1 3.92Å; Y192-I397 HydrophobicContact CE2-CG1 4.17Å; Y192-I397 VanDerWaalsContact OH-CB 3.3Å; Y192-I397 WeakPolarHBondContact OH-CB 3.49Å; A395-I397 VanDerWaalsContact C-N 3.25Å; A395-I397 PolarHBondContact O-N 2.99Å
398	S	93.2	Very high	93.9	Very high	95 Å²	95	79.1 Å²	79.1	66%	0.664	41%	0.414	S	S	*	.			trans	-72.5	136	174	-66	0	0	0	0	110.9
399	I	93.8	Very high	93.7	Very high	28 Å²	28	73.1 Å²	73.1	14%	0.144	39%	0.387	C	S	.	.			trans	-87.6	116.9	177.1	-61.5	-58.8	0	0	0	109.5	L220 G224 I401	L220-I399 HydrophobicContact CB-CD1 4.36Å; L220-I399 HydrophobicContact CD1-CD1 4.13Å; G224-I399 VanDerWaalsContact CA-CG1 3.42Å; I399-I401 HydrophobicContact CG2-CG2 3.73Å; I399-I401 PolarHBondContact O-N 2.82Å
400	E	92.2	Very high	93.4	Very high	171 Å²	171	70.4 Å²	70.4	80%	0.799	37%	0.373	S	S	*	.			trans	-86.2	107.5	175.6	-64.2	-177.2	-167.5	0	0	110
401	I	92.6	Very high	92.8	Very high	58 Å²	58	70.9 Å²	70.9	30%	0.297	38%	0.376	S	S	.	.			trans	-134.7	144.3	176.8	52.8	170.2	0	0	0	110.4	P170 I399 D406	P170-I401 HydrophobicContact CB-CD1 4.24Å; P170-I401 HydrophobicContact CB-CG2 4.08Å; P170-I401 HydrophobicContact CG-CD1 3.73Å; I399-I401 HydrophobicContact CG2-CG2 3.73Å; I399-I401 PolarHBondContact O-N 2.82Å; I401-D406 HydrophobicContact CB-CB 4.13Å; I401-D406 HydrophobicContact CG2-CB 4.22Å
402	K	92.4	Very high	92.3	Very high	201 Å²	201	77.5 Å²	77.5	87%	0.874	41%	0.408	S	S	*	.	S	Bend	trans	-100	-22.3	-176.1	-62.2	175.3	-176	172.8	0	113.3	D406	K402-D406 PolarHBondContact N-OD2 2.73Å
403	S	91.6	Very high	91.7	Very high	54 Å²	54	73 Å²	73	38%	0.378	39%	0.387	S	S	.	.	S	Bend	trans	-153.7	168.9	-178	61.4	0	0	0	0	111.4	D405 D406	S403-D405 WeakPolarHBondContact CB-OD1 3.5Å; S403-D405 PolarHBondContact O-N 2.91Å; S403-D405 PolarHBondContact OG-OD1 2.9Å; S403-D406 WeakPolarHBondContact O-CB 3.34Å; S403-D406 PolarHBondContact O-N 3.38Å; S403-D406 PolarHBondContact OG-N 2.72Å
404	I	88.7	Confident	91.2	Very high	129 Å²	129	71.3 Å²	71.3	66%	0.662	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-16.6	-179.3	60.8	167.8	0	0	0	113.5	V114 F168	V114-I404 HydrophobicContact CG2-CD1 4.14Å; V114-I404 HydrophobicContact CG2-CG1 4.45Å; F168-I404 WeakPolarHBondContact CD1-O 3.12Å
405	D	90.3	Very high	90.1	Very high	72 Å²	72	74.2 Å²	74.2	39%	0.385	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	14.2	179.6	61	-20.4	0	0	0	111.9	L105 V114 S403 T407	L105-D405 HydrophobicContact CD2-CB 3.96Å; V114-D405 HydrophobicContact CG2-CB 4.37Å; S403-D405 WeakPolarHBondContact CB-OD1 3.5Å; S403-D405 PolarHBondContact O-N 2.91Å; S403-D405 PolarHBondContact OG-OD1 2.9Å; D405-T407 PolarHBondContact O-N 3.45Å
406	D	92.8	Very high	88.9	Confident	18 Å²	18	74.9 Å²	74.9	10%	0.096	40%	0.399	C	S	.	.			trans	-63.5	126.1	178.1	-164.9	-29.9	0	0	0	110.6	F168 I401 K402 S403 S408	F168-D406 WeakPolarHBondContact CZ-O 3.46Å; I401-D406 HydrophobicContact CB-CB 4.13Å; I401-D406 HydrophobicContact CG2-CB 4.22Å; K402-D406 PolarHBondContact N-OD2 2.73Å; S403-D406 WeakPolarHBondContact O-CB 3.34Å; S403-D406 PolarHBondContact O-N 3.38Å; S403-D406 PolarHBondContact OG-N 2.72Å; D406-S408 WeakPolarHBondContact OD1-CB 3.44Å; D406-S408 PolarHBondContact OD1-N 3.05Å; D406-S408 PolarHBondContact OD1-OG 3.11Å
407	T	93.9	Very high	87.5	Confident	19 Å²	19	77.5 Å²	77.5	12%	0.117	41%	0.407	C	S	.	.			trans	-116.3	16.2	-179.6	55.2	0	0	0	0	112.9	K93 I95 L105 F168 D405 N409 F410	K93-T407 HydrophobicContact CD-CG2 4.16Å; K93-T407 VanDerWaalsContact CD-OG1 3.28Å; K93-T407 WeakPolarHBondContact CD-OG1 3.49Å; K93-T407 PolarHBondContact NZ-OG1 2.89Å; I95-T407 HydrophobicContact CG2-CG2 3.67Å; L105-T407 HydrophobicContact CD2-CG2 3.73Å; F168-T407 HydrophobicContact CZ-CG2 4.21Å; D405-T407 PolarHBondContact O-N 3.45Å; T407-N409 PolarHBondContact O-N 3.17Å; T407-F410 PolarHBondContact O-N 3.18Å
408	S	92.9	Very high	86.2	Confident	69 Å²	69	77 Å²	77	48%	0.483	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-15.8	-179.8	59.5	0	0	0	0	114.2	K180 D406 F410	K180-S408 PolarHBondContact NZ-O 3.28Å; D406-S408 WeakPolarHBondContact OD1-CB 3.44Å; D406-S408 PolarHBondContact OD1-N 3.05Å; D406-S408 PolarHBondContact OD1-OG 3.11Å; S408-F410 VanDerWaalsContact C-N 3.31Å
409	N	92.9	Very high	84.9	Confident	25 Å²	25	74.7 Å²	74.7	13%	0.134	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	5.1	170.9	-65.7	-43.6	0	0	0	114.1	P170 T176 K180 T407	P170-N409 WeakPolarHBondContact O-CB 3.42Å; P170-N409 PolarHBondContact O-ND2 2.88Å; T176-N409 WeakPolarHBondContact CG2-O 3.48Å; K180-N409 PolarHBondContact NZ-OD1 3.42Å; T407-N409 PolarHBondContact O-N 3.17Å
410	F	89.8	Confident	83.4	Confident	32 Å²	32	79.3 Å²	79.3	14%	0.14	40%	0.404	C	S	.	.	S	Bend	trans	-114.2	152.6	176.1	-63.5	-94.9	0	0	0	110.8	I95 F168 L169 T407 S408	I95-F410 HydrophobicContact CB-CD1 3.93Å; I95-F410 HydrophobicContact CB-CE1 4.32Å; I95-F410 HydrophobicContact CB-CG 4.16Å; I95-F410 HydrophobicContact CD1-CE1 4.37Å; I95-F410 HydrophobicContact CG2-CG 4.47Å; I95-F410 WeakPolarHBondContact O-CD1 3.45Å; F168-F410 HydrophobicContact CD2-CZ 4.46Å; F168-F410 HydrophobicContact CE2-CD2 4.41Å; F168-F410 AromaticContact CE2-CE2 3.48Å; F168-F410 HydrophobicContact CE2-CE2 3.48Å; F168-F410 VanDerWaalsContact CE2-CE2 3.48Å; F168-F410 AromaticContact CE2-CZ 3.56Å; F168-F410 HydrophobicContact CE2-CZ 3.56Å; F168-F410 HydrophobicContact CZ-CD2 4.45Å; F168-F410 AromaticContact CZ-CE2 3.66Å; F168-F410 HydrophobicContact CZ-CE2 3.66Å; F168-F410 HydrophobicContact CZ-CZ 4.21Å; L169-F410 VanDerWaalsContact O-CZ 3.29Å; L169-F410 WeakPolarHBondContact O-CZ 3.27Å; T407-F410 PolarHBondContact O-N 3.18Å; S408-F410 VanDerWaalsContact C-N 3.31Å
411	D	85.3	Confident	81.3	Confident	26 Å²	26	76.4 Å²	76.4	14%	0.139	40%	0.4	C	S	.	.			trans	-65.5	150.3	169.9	-78.6	-28.1	0	0	0	111.7	R276 F413	R276-D411 IonicContact CZ-OD1 3.98Å; R276-D411 IonicContact CZ-OD2 3.52Å; R276-D411 IonicContact NE-OD2 3.74Å; R276-D411 PolarHBondContact NE-OD2 3.41Å; R276-D411 IonicContact NH1-OD1 2.73Å; R276-D411 PolarHBondContact NH1-OD1 2.91Å; R276-D411 IonicContact NH1-OD2 3.73Å; R276-D411 PolarHBondContact NH1-OD2 3.15Å; R276-D411 IonicContact NH2-OD1 3.88Å; R276-D411 PolarHBondContact NH2-OD1 2.74Å; R276-D411 IonicContact NH2-OD2 2.96Å; R276-D411 PolarHBondContact NH2-OD2 3.32Å; D411-F413 HydrophobicContact CB-CE2 3.81Å; D411-F413 HydrophobicContact CB-CZ 4Å; D411-F413 WeakPolarHBondContact O-CD2 3.36Å; D411-F413 WeakPolarHBondContact O-CE2 3.4Å
412	E	84.4	Confident	79.1	Confident	168 Å²	168	79.3 Å²	79.3	79%	0.785	42%	0.42	S	S	*	.			trans	-78.9	124	171.7	-65.9	-163.3	160.7	0	0	110.5
413	F	81.8	Confident	76.7	Confident	39 Å²	39	76.1 Å²	76.1	17%	0.171	42%	0.417	C	S	.	.			trans	-110.9	136.3	174	-64.8	-84.9	0	0	0	109.4	V94 I95 R97 F280 D411	V94-F413 HydrophobicContact CB-CB 4.1Å; V94-F413 HydrophobicContact CG1-CB 3.8Å; V94-F413 HydrophobicContact CG1-CG 4.25Å; I95-F413 WeakPolarHBondContact O-CE2 3.5Å; R97-F413 HydrophobicContact CB-CD1 4.31Å; R97-F413 HydrophobicContact CB-CE1 4.19Å; R97-F413 HydrophobicContact CG-CD1 3.83Å; R97-F413 HydrophobicContact CG-CE1 4.21Å; R97-F413 HydrophobicContact CG-CG 4.43Å; F280-F413 AromaticContact CE1-CE1 3.65Å; F280-F413 HydrophobicContact CE1-CE1 3.65Å; F280-F413 AromaticContact CE1-CZ 3.98Å; F280-F413 HydrophobicContact CE1-CZ 3.98Å; F280-F413 HydrophobicContact CE2-CE1 4.23Å; F280-F413 AromaticContact CZ-CE1 3.36Å; F280-F413 HydrophobicContact CZ-CE1 3.36Å; F280-F413 AromaticContact CZ-CZ 3.72Å; F280-F413 HydrophobicContact CZ-CZ 3.72Å; D411-F413 HydrophobicContact CB-CE2 3.81Å; D411-F413 HydrophobicContact CB-CZ 4Å; D411-F413 WeakPolarHBondContact O-CD2 3.36Å; D411-F413 WeakPolarHBondContact O-CE2 3.4Å
414	P	79.9	Confident	74.3	Confident	90 Å²	90	77 Å²	77	58%	0.584	43%	0.428	S	S	*	.			trans	-61.7	156.8	170.5	24.5	-29.3	0	0	0	109.8	R97	R97-P414 PolarHBondContact NH2-O 3.43Å
415	E	73.7	Confident	71.8	Confident	181 Å²	181	77.8 Å²	77.8	85%	0.846	44%	0.439	S	S	*	.			trans	-58.6	151.5	172	-73	-161.8	159.5	0	0	111.1	R97	R97-E415 PolarHBondContact NH2-O 2.93Å
416	S	71.8	Confident	69.4	Low	27 Å²	27	77.3 Å²	77.3	19%	0.189	44%	0.441	C	S	.	.			trans	-130.7	140.7	-175.8	172.7	0	0	0	0	109.3	E102 R104 I418	E102-S416 WeakPolarHBondContact OE2-CB 3.33Å; E102-S416 PolarHBondContact OE2-OG 3.22Å; R104-S416 PolarHBondContact NH2-O 2.9Å; S416-I418 PolarHBondContact O-N 2.89Å; S416-I418 PolarHBondContact OG-N 3.35Å
417	D	67.8	Low	66.9	Low	99 Å²	99	84.7 Å²	84.7	53%	0.529	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-81.2	12.9	179.3	-72.6	-14.2	0	0	0	112.8	L419 K420	D417-L419 PolarHBondContact O-N 3.1Å; D417-L419 VanDerWaalsContact O-N 3.08Å; D417-K420 HydrophobicContact CB-CB 4.22Å; D417-K420 HydrophobicContact CB-CD 4.11Å; D417-K420 HydrophobicContact CB-CG 4.3Å; D417-K420 WeakPolarHBondContact O-CA 3.46Å; D417-K420 WeakPolarHBondContact O-CB 3.37Å; D417-K420 PolarHBondContact O-N 3.21Å; D417-K420 VanDerWaalsContact OD1-CD 3.26Å; D417-K420 WeakPolarHBondContact OD1-CD 2.87Å; D417-K420 WeakPolarHBondContact OD1-CE 3.4Å; D417-K420 IonicContact OD1-NZ 3.73Å; D417-K420 PolarHBondContact OD1-NZ 3.2Å; D417-K420 IonicContact OD2-NZ 3.03Å
418	I	69.4	Low	64.5	Low	17 Å²	17	89.9 Å²	89.9	9%	0.087	50%	0.503	C	S	.	.	G	3₁₀ helix	trans	-57.9	-28.7	-177.5	-147	171.7	0	0	0	113.3	E102 I119 R121 S416	E102-I418 HydrophobicContact CG-CB 4.49Å; E102-I418 HydrophobicContact CG-CD1 4.01Å; E102-I418 HydrophobicContact CG-CG2 3.77Å; E102-I418 WeakPolarHBondContact OE1-CG2 3.43Å; I119-I418 HydrophobicContact CD1-CG2 3.92Å; I119-I418 HydrophobicContact CG2-CD1 4.37Å; I119-I418 HydrophobicContact CG2-CG2 4.38Å; R121-I418 HydrophobicContact CG-CD1 4.08Å; R121-I418 HydrophobicContact CG-CG1 4.27Å; S416-I418 PolarHBondContact O-N 2.89Å; S416-I418 PolarHBondContact OG-N 3.35Å
419	L	65.7	Low	62	Low	45 Å²	45	90.3 Å²	90.3	24%	0.236	50%	0.504	C	S	.	.	G	3₁₀ helix	trans	-89.8	-10.4	177.3	-66.5	-171.1	0	0	0	112.6	L86 R104 M117 I119 Y163 D417	L86-L419 HydrophobicContact CD1-CD2 4.16Å; L86-L419 HydrophobicContact CD2-CD2 3.89Å; R104-L419 VanDerWaalsContact CZ-CD1 3.43Å; M117-L419 HydrophobicContact CE-CD1 4.48Å; I119-L419 HydrophobicContact CD1-CD2 3.63Å; I119-L419 HydrophobicContact CD1-CG 4.15Å; I119-L419 HydrophobicContact CG1-CD2 4.46Å; Y163-L419 HydrophobicContact CE1-CD2 4.26Å; D417-L419 PolarHBondContact O-N 3.1Å; D417-L419 VanDerWaalsContact O-N 3.08Å
420	K	60.9	Low	59.7	Low	126 Å²	126	97.1 Å²	97.1	55%	0.548	54%	0.535	S	S	.	.	S	Bend	trans	-80.2	133.3	173	-64.3	-172.5	-172.3	155	0	108	D417 T422	D417-K420 HydrophobicContact CB-CB 4.22Å; D417-K420 HydrophobicContact CB-CD 4.11Å; D417-K420 HydrophobicContact CB-CG 4.3Å; D417-K420 WeakPolarHBondContact O-CA 3.46Å; D417-K420 WeakPolarHBondContact O-CB 3.37Å; D417-K420 PolarHBondContact O-N 3.21Å; D417-K420 VanDerWaalsContact OD1-CD 3.26Å; D417-K420 WeakPolarHBondContact OD1-CD 2.87Å; D417-K420 WeakPolarHBondContact OD1-CE 3.4Å; D417-K420 IonicContact OD1-NZ 3.73Å; D417-K420 PolarHBondContact OD1-NZ 3.2Å; D417-K420 IonicContact OD2-NZ 3.03Å; K420-T422 PolarHBondContact O-N 2.72Å
421	P	49.7	Very low	57.5	Low	110 Å²	110	100.1 Å²	100.1	71%	0.714	56%	0.556	S	S	*	*			trans	-62.7	108.2	171.3	23.4	-29	0	0	0	108.3	V423	P421-V423 PolarHBondContact O-N 3.1Å
422	T	45.6	Very low	55.7	Low	119 Å²	119	103.6 Å²	103.6	73%	0.73	58%	0.575	S	S	*	*			trans	-62.8	118.8	168.8	0.9	0	0	0	0	107.3	K420 A424	K420-T422 PolarHBondContact O-N 2.72Å; T422-A424 VanDerWaalsContact C-N 3.28Å; T422-A424 PolarHBondContact O-N 3.16Å
423	V	41.5	Very low	54	Low	134 Å²	134	100.3 Å²	100.3	81%	0.812	56%	0.556	S	S	*	*			trans	-61	102.2	159.4	-177.3	0	0	0	0	104.6	P421 T425	P421-V423 PolarHBondContact O-N 3.1Å; V423-T425 PolarHBondContact O-N 3.31Å
424	A	42.2	Very low	52.5	Low	72 Å²	72	106.5 Å²	106.5	60%	0.595	58%	0.583	S	S	*	*			trans	-59.4	104.7	-173.1	0	0	0	0	0	109.9	T422 S426	T422-A424 VanDerWaalsContact C-N 3.28Å; T422-A424 PolarHBondContact O-N 3.16Å; A424-S426 PolarHBondContact O-N 3.47Å
425	T	35.7	Very low	51.1	Low	145 Å²	145	106 Å²	106	89%	0.89	58%	0.575	S	S	*	*			trans	-84.6	35.6	158.4	46.3	0	0	0	0	110.4	V423	V423-T425 PolarHBondContact O-N 3.31Å
426	S	40.2	Very low	50.4	Low	62 Å²	62	103.1 Å²	103.1	43%	0.434	56%	0.56	S	S	.	*			trans	-95.5	121.3	167.1	54.2	0	0	0	0	108.3	A424 H428	A424-S426 PolarHBondContact O-N 3.47Å; S426-H428 PolarHBondContact O-N 3.32Å
427	N	39.9	Very low	50	Low	174 Å²	174	104.7 Å²	104.7	93%	0.93	57%	0.566	S	S	*	*			trans	-67.2	24.3	172	-78.3	-23.7	0	0	0	113.1
428	H	42.8	Very low	49.9	Very low	127 Å²	127	106.8 Å²	106.8	59%	0.588	57%	0.567	S	S	*	*	S	Bend	trans	-100.9	122.6	176.2	-78.9	-68.2	0	0	0	109.4	S426 E430	S426-H428 PolarHBondContact O-N 3.32Å; H428-E430 PolarHBondContact O-N 3.26Å
429	P	40.4	Very low	49.7	Very low	78 Å²	78	107.4 Å²	107.4	51%	0.506	57%	0.571	S	S	.	*			trans	-64	131	-175.7	25.6	-31.7	0	0	0	110.5	T431 D432	P429-T431 PolarHBondContact O-N 3.09Å; P429-D432 PolarHBondContact O-N 3.08Å; P429-D432 VanDerWaalsContact O-N 3.14Å
430	E	45	Very low	50.1	Low	169 Å²	169	105.6 Å²	105.6	79%	0.79	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.3	-17.2	177.8	-76.2	-171	136.8	0	0	114.6	H428 D432	H428-E430 PolarHBondContact O-N 3.26Å; E430-D432 PolarHBondContact O-N 3.36Å
431	T	44.3	Very low	50.3	Low	94 Å²	94	101.5 Å²	101.5	58%	0.577	55%	0.545	S	S	*	.	H	α-helix	trans	-66	-30.4	179.3	45.7	0	0	0	0	113.8	P429	P429-T431 PolarHBondContact O-N 3.09Å
432	D	46.6	Very low	51.3	Low	99 Å²	99	98.9 Å²	98.9	53%	0.529	53%	0.525	S	S	.	.	H	α-helix	trans	-76.5	-31.9	-176.5	-104.9	-10.1	0	0	0	113.2	P429 E430 N435	P429-D432 PolarHBondContact O-N 3.08Å; P429-D432 VanDerWaalsContact O-N 3.14Å; E430-D432 PolarHBondContact O-N 3.36Å; D432-N435 PolarHBondContact O-N 3.16Å
433	Y	48.3	Very low	52.8	Low	99 Å²	99	93.5 Å²	93.5	39%	0.388	49%	0.492	S	S	.	.	H	α-helix	trans	-73.7	-38.3	179.3	-74.6	-79.1	0	0	0	112.7	A123 L126 N435 K436 D437	A123-Y433 HydrophobicContact CB-CE1 3.87Å; L126-Y433 HydrophobicContact CD1-CD1 4.39Å; Y433-N435 PolarHBondContact O-N 3.21Å; Y433-K436 PolarHBondContact O-N 3.44Å; Y433-D437 PolarHBondContact O-N 2.95Å
434	K	50.3	Low	54.6	Low	170 Å²	170	91 Å²	91	74%	0.739	48%	0.477	S	S	*	.	H	α-helix	trans	-60.3	-30.1	173.1	-84	-177.5	179.2	170.2	0	112.7	K436	K434-K436 VanDerWaalsContact C-N 3.34Å; K434-K436 PolarHBondContact O-N 3.01Å
435	N	51.8	Low	56.5	Low	80 Å²	80	90.3 Å²	90.3	43%	0.428	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-14.7	-178.5	-82.1	-12.8	0	0	0	114.1	D432 Y433 W438	D432-N435 PolarHBondContact O-N 3.16Å; Y433-N435 PolarHBondContact O-N 3.21Å; N435-W438 PolarHBondContact O-NE1 3.01Å
436	K	58.6	Low	58.4	Low	119 Å²	119	84.3 Å²	84.3	52%	0.517	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	-4.2	179.9	-68.3	-173.8	-179.4	178.1	0	114.8	L126 Y433 K434 W438 V439	L126-K436 HydrophobicContact CD1-CB 4.16Å; L126-K436 HydrophobicContact CD2-CB 4.29Å; L126-K436 HydrophobicContact CD2-CD 4.46Å; Y433-K436 PolarHBondContact O-N 3.44Å; K434-K436 VanDerWaalsContact C-N 3.34Å; K434-K436 PolarHBondContact O-N 3.01Å; K436-W438 PolarHBondContact O-N 3.25Å; K436-V439 WeakPolarHBondContact O-CG1 3.46Å; K436-V439 VanDerWaalsContact O-CG2 3.27Å; K436-V439 WeakPolarHBondContact O-CG2 3.36Å; K436-V439 PolarHBondContact O-N 2.63Å; K436-V439 VanDerWaalsContact O-N 3.12Å
437	D	64.1	Low	60.3	Low	61 Å²	61	81.6 Å²	81.6	33%	0.326	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-61.1	-20.8	-177.9	-135	13.8	0	0	0	113.3	K122 Y433 V439 F440	K122-D437 IonicContact NZ-OD1 2.77Å; K122-D437 PolarHBondContact NZ-OD1 3.02Å; K122-D437 IonicContact NZ-OD2 3.13Å; Y433-D437 PolarHBondContact O-N 2.95Å; D437-V439 PolarHBondContact O-N 3.23Å; D437-F440 PolarHBondContact O-N 3.21Å; D437-F440 VanDerWaalsContact O-N 3.15Å
438	W	65.2	Low	61.7	Low	142 Å²	142	74.6 Å²	74.6	54%	0.538	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-61	-22.1	176.1	69.7	-92.1	0	0	0	113.8	N435 K436 F440 I441	N435-W438 PolarHBondContact O-NE1 3.01Å; K436-W438 PolarHBondContact O-N 3.25Å; W438-F440 PolarHBondContact O-N 3.1Å; W438-I441 HydrophobicContact CB-CD1 3.69Å; W438-I441 HydrophobicContact CB-CG1 4.39Å; W438-I441 VanDerWaalsContact O-CB 3.28Å; W438-I441 WeakPolarHBondContact O-CB 3.41Å; W438-I441 WeakPolarHBondContact O-CD1 3.03Å; W438-I441 WeakPolarHBondContact O-CG1 3.49Å; W438-I441 PolarHBondContact O-N 2.97Å; W438-I441 VanDerWaalsContact O-N 3.08Å
439	V	65.7	Low	62.8	Low	30 Å²	30	71.8 Å²	71.8	18%	0.182	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-67.3	-19.2	178	-54.8	0	0	0	0	112.7	L126 V131 K436 D437	L126-V439 HydrophobicContact CD2-CG2 3.95Å; V131-V439 HydrophobicContact CG1-CB 4.16Å; V131-V439 HydrophobicContact CG1-CG2 4Å; V131-V439 HydrophobicContact CG2-CG2 4.12Å; K436-V439 WeakPolarHBondContact O-CG1 3.46Å; K436-V439 VanDerWaalsContact O-CG2 3.27Å; K436-V439 WeakPolarHBondContact O-CG2 3.36Å; K436-V439 PolarHBondContact O-N 2.63Å; K436-V439 VanDerWaalsContact O-N 3.12Å; D437-V439 PolarHBondContact O-N 3.23Å
440	F	73.1	Confident	63.7	Low	7 Å²	7	68.3 Å²	68.3	3%	0.031	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-98.4	12.8	175.9	-52.7	-65.8	0	0	0	112.5	K122 M125 L126 V131 I134 Q157 L162 D437 W438 Y443	K122-F440 HydrophobicContact CB-CE2 4.12Å; K122-F440 HydrophobicContact CB-CZ 4.46Å; K122-F440 HydrophobicContact CD-CD2 4.12Å; K122-F440 HydrophobicContact CD-CE2 4.12Å; K122-F440 HydrophobicContact CG-CD2 4.28Å; K122-F440 HydrophobicContact CG-CE2 3.91Å; K122-F440 HydrophobicContact CG-CZ 4.32Å; M125-F440 HydrophobicContact CB-CZ 4.3Å; L126-F440 HydrophobicContact CD1-CE2 4.4Å; L126-F440 HydrophobicContact CD2-CE2 4.4Å; L126-F440 HydrophobicContact CD2-CZ 4.33Å; L126-F440 HydrophobicContact CG-CE2 4.3Å; L126-F440 HydrophobicContact CG-CZ 4.24Å; V131-F440 HydrophobicContact CG1-CD1 4.48Å; V131-F440 HydrophobicContact CG1-CE1 4.09Å; V131-F440 HydrophobicContact CG2-CE1 3.98Å; V131-F440 HydrophobicContact CG2-CZ 4.02Å; I134-F440 HydrophobicContact CD1-CE1 4.16Å; Q157-F440 PolarHBondContact NE2-O 2.95Å; L162-F440 HydrophobicContact CD1-CD1 3.73Å; L162-F440 HydrophobicContact CD1-CE1 3.67Å; L162-F440 HydrophobicContact CD1-CZ 4.42Å; L162-F440 HydrophobicContact CD2-CB 4.23Å; L162-F440 HydrophobicContact CD2-CD1 4.01Å; L162-F440 HydrophobicContact CD2-CG 4.03Å; L162-F440 HydrophobicContact CG-CD1 4.45Å; D437-F440 PolarHBondContact O-N 3.21Å; D437-F440 VanDerWaalsContact O-N 3.15Å; W438-F440 PolarHBondContact O-N 3.1Å; F440-Y443 WeakPolarHBondContact O-CB 3.47Å; F440-Y443 PolarHBondContact O-N 3.46Å
441	I	66.1	Low	64	Low	41 Å²	41	61.8 Å²	61.8	21%	0.21	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	141.6	170.4	-72.3	167.8	0	0	0	109.3	M22 N29 W438 Y443	M22-I441 HydrophobicContact CG-CD1 4.37Å; N29-I441 WeakPolarHBondContact ND2-CG2 2.99Å; W438-I441 HydrophobicContact CB-CD1 3.69Å; W438-I441 HydrophobicContact CB-CG1 4.39Å; W438-I441 VanDerWaalsContact O-CB 3.28Å; W438-I441 WeakPolarHBondContact O-CB 3.41Å; W438-I441 WeakPolarHBondContact O-CD1 3.03Å; W438-I441 WeakPolarHBondContact O-CG1 3.49Å; W438-I441 PolarHBondContact O-N 2.97Å; W438-I441 VanDerWaalsContact O-N 3.08Å; I441-Y443 PolarHBondContact O-N 2.7Å
442	N	69.9	Low	64.1	Low	55 Å²	55	60.7 Å²	60.7	29%	0.294	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.6	7.1	-171.5	-55.2	-24.3	0	0	0	115.6	N29 R138 T444	N29-N442 PolarHBondContact ND2-ND2 2.96Å; N29-N442 VanDerWaalsContact ND2-ND2 3.18Å; N29-N442 PolarHBondContact OD1-ND2 3.39Å; R138-N442 PolarHBondContact NH1-O 3.11Å; N442-T444 PolarHBondContact O-N 2.82Å
443	Y	76.4	Confident	64	Low	5 Å²	5	56.9 Å²	56.9	2%	0.02	27%	0.274	C	S	.	.			trans	-56.8	-32.8	176.9	-172.7	-100.4	0	0	0	112.6	I134 S155 F156 Q157 L162 Y163 L164 F440 I441 Y445	I134-Y443 HydrophobicContact CG2-CD2 4.26Å; I134-Y443 HydrophobicContact CG2-CE2 3.56Å; S155-Y443 PolarHBondContact OG-O 2.77Å; F156-Y443 WeakPolarHBondContact O-CD1 3.47Å; F156-Y443 WeakPolarHBondContact O-CE1 3.09Å; Q157-Y443 HydrophobicContact CB-CD1 4.18Å; L162-Y443 HydrophobicContact CB-CE1 3.78Å; L162-Y443 HydrophobicContact CB-CE2 4.31Å; L162-Y443 HydrophobicContact CD1-CD2 4.45Å; L162-Y443 HydrophobicContact CD1-CE2 4.1Å; L162-Y443 HydrophobicContact CD2-CD1 3.99Å; L162-Y443 HydrophobicContact CD2-CD2 4.38Å; L162-Y443 HydrophobicContact CD2-CE1 4.12Å; L162-Y443 HydrophobicContact CD2-CG 4.11Å; L162-Y443 HydrophobicContact CG-CE1 4.45Å; Y163-Y443 WeakPolarHBondContact O-CE1 3.46Å; L164-Y443 WeakPolarHBondContact CD2-OH 3.16Å; L164-Y443 VanDerWaalsContact CG-OH 3.23Å; L164-Y443 WeakPolarHBondContact CG-OH 3.39Å; F440-Y443 WeakPolarHBondContact O-CB 3.47Å; F440-Y443 PolarHBondContact O-N 3.46Å; I441-Y443 PolarHBondContact O-N 2.7Å; Y443-Y445 PolarHBondContact O-N 3.45Å
444	T	80.6	Confident	63.6	Low	83 Å²	83	60.2 Å²	60.2	51%	0.509	29%	0.286	S	S	.	.			trans	-69.5	123.3	-177.2	-51.4	0	0	0	0	112.8	S155 N442	S155-T444 VanDerWaalsContact O-CA 3.23Å; S155-T444 WeakPolarHBondContact O-CA 3.24Å; S155-T444 WeakPolarHBondContact O-CG2 3.45Å; N442-T444 PolarHBondContact O-N 2.82Å
445	Y	81	Confident	62.9	Low	56 Å²	56	54.3 Å²	54.3	22%	0.22	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	151.5	178.3	170.5	-96.9	0	0	0	111.4	V142 M152 Y154 S155 Y443 R447	V142-Y445 HydrophobicContact CB-CE2 4.28Å; V142-Y445 HydrophobicContact CG1-CD2 4.11Å; V142-Y445 HydrophobicContact CG1-CE2 3.53Å; V142-Y445 HydrophobicContact CG2-CD1 3.91Å; V142-Y445 HydrophobicContact CG2-CD2 3.73Å; V142-Y445 HydrophobicContact CG2-CE1 3.96Å; V142-Y445 HydrophobicContact CG2-CE2 3.8Å; V142-Y445 HydrophobicContact CG2-CG 3.77Å; M152-Y445 HydrophobicContact CE-CD1 3.44Å; M152-Y445 VanDerWaalsContact CE-CD1 3.44Å; M152-Y445 HydrophobicContact CE-CE1 3.77Å; M152-Y445 HydrophobicContact CE-CG 4.2Å; Y154-Y445 WeakPolarHBondContact CA-O 3.37Å; S155-Y445 PolarHBondContact N-O 2.72Å; S155-Y445 PolarHBondContact O-N 3.05Å; S155-Y445 VanDerWaalsContact OG-CB 3.27Å; S155-Y445 WeakPolarHBondContact OG-CB 3.47Å; S155-Y445 PolarHBondContact OG-N 3.1Å; Y443-Y445 PolarHBondContact O-N 3.45Å; Y445-R447 HydrophobicContact CE1-CB 3.75Å
446	K	76.5	Confident	61.9	Low	19 Å²	19	55 Å²	55	8%	0.083	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	120.3	172.9	-54.9	-168.8	-171.6	-162.2	0	110.6	F76 L79 T82 L84 Y154	F76-K446 WeakPolarHBondContact CE2-O 3.39Å; L79-K446 HydrophobicContact CD1-CD 4.41Å; L79-K446 HydrophobicContact CD2-CD 4.41Å; L79-K446 HydrophobicContact CG-CD 3.9Å; L79-K446 PolarHBondContact O-NZ 3.49Å; T82-K446 PolarHBondContact O-NZ 2.85Å; L84-K446 HydrophobicContact CD1-CD 3.97Å; L84-K446 HydrophobicContact CD1-CG 4.39Å; Y154-K446 HydrophobicContact CD1-CB 4.27Å; Y154-K446 HydrophobicContact CD1-CG 4.32Å
447	R	79.1	Confident	60.7	Low	5 Å²	5	54.1 Å²	54.1	2%	0.019	29%	0.29	C	S	.	.			trans	-75.9	140.5	178.9	-167.6	173.3	-75.6	-134.1	9.4	111.5	L141 A144 D145 K151 M152 F153 Y445 E449 G450	L141-R447 PolarHBondContact O-NH2 3.33Å; A144-R447 PolarHBondContact O-NH2 3.27Å; D145-R447 IonicContact OD1-NH1 3.68Å; D145-R447 PolarHBondContact OD1-NH1 3.09Å; D145-R447 VanDerWaalsContact OD1-NH1 3.13Å; K151-R447 VanDerWaalsContact CE-CD 3.5Å; M152-R447 WeakPolarHBondContact O-CD 3.49Å; M152-R447 PolarHBondContact O-NE 2.58Å; F153-R447 WeakPolarHBondContact O-CB 3.42Å; F153-R447 PolarHBondContact O-N 3.17Å; Y445-R447 HydrophobicContact CE1-CB 3.75Å; R447-E449 WeakPolarHBondContact CD-OE2 3.36Å; R447-E449 WeakPolarHBondContact CG-OE2 3.45Å; R447-G450 PolarHBondContact O-N 3.01Å; R447-G450 VanDerWaalsContact O-N 3.11Å
448	F	70.7	Confident	59.2	Low	27 Å²	27	53.6 Å²	53.6	12%	0.118	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-60.2	-46.6	178.8	-174.3	-103.1	0	0	0	112.1	K72 E73 F76 G450 L451	K72-F448 HydrophobicContact CB-CZ 4Å; E73-F448 HydrophobicContact CG-CE2 4.23Å; E73-F448 HydrophobicContact CG-CZ 4.22Å; E73-F448 WeakPolarHBondContact OE1-CE2 3.43Å; F76-F448 HydrophobicContact CB-CD2 3.78Å; F76-F448 HydrophobicContact CB-CE2 3.73Å; F76-F448 AromaticContact CD1-CD2 3.44Å; F76-F448 HydrophobicContact CD1-CD2 3.44Å; F76-F448 VanDerWaalsContact CD1-CD2 3.44Å; F76-F448 AromaticContact CD1-CE2 3.96Å; F76-F448 HydrophobicContact CD1-CE2 3.96Å; F76-F448 HydrophobicContact CD2-CB 4.48Å; F76-F448 AromaticContact CD2-CD2 3.88Å; F76-F448 HydrophobicContact CD2-CD2 3.88Å; F76-F448 HydrophobicContact CE1-CB 4.42Å; F76-F448 AromaticContact CE1-CD2 3.79Å; F76-F448 HydrophobicContact CE1-CD2 3.79Å; F76-F448 VanDerWaalsContact CE2-CA 3.47Å; F76-F448 HydrophobicContact CE2-CB 4.16Å; F76-F448 HydrophobicContact CE2-CD2 4.25Å; F76-F448 AromaticContact CG-CD2 3.44Å; F76-F448 HydrophobicContact CG-CD2 3.44Å; F76-F448 VanDerWaalsContact CG-CD2 3.44Å; F76-F448 AromaticContact CG-CE2 3.91Å; F76-F448 HydrophobicContact CG-CE2 3.91Å; F76-F448 HydrophobicContact CZ-CB 4.08Å; F76-F448 HydrophobicContact CZ-CD2 4.18Å; F448-G450 PolarHBondContact O-N 3.06Å; F448-G450 VanDerWaalsContact O-N 3.14Å; F448-L451 WeakPolarHBondContact O-CD1 3.11Å; F448-L451 PolarHBondContact O-N 3.36Å
449	E	65.9	Low	57.7	Low	68 Å²	68	51.9 Å²	51.9	32%	0.318	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-68.6	-11.5	178.1	-59.3	72	-148.2	0	0	112.9	R447 L451 T452	R447-E449 WeakPolarHBondContact CD-OE2 3.36Å; R447-E449 WeakPolarHBondContact CG-OE2 3.45Å; E449-L451 PolarHBondContact O-N 3.26Å; E449-L451 VanDerWaalsContact O-N 3.12Å; E449-T452 WeakPolarHBondContact CA-OG1 3.42Å; E449-T452 PolarHBondContact O-N 3.39Å; E449-T452 PolarHBondContact O-OG1 2.93Å
450	G	57.8	Low	56.6	Low	5 Å²	5	58.6 Å²	58.6	5%	0.052	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-63.9	-9.9	172.3	0	0	0	0	0	113.8	Y154 R447 F448	Y154-G450 PolarHBondContact OH-O 2.69Å; R447-G450 PolarHBondContact O-N 3.01Å; R447-G450 VanDerWaalsContact O-N 3.11Å; F448-G450 PolarHBondContact O-N 3.06Å; F448-G450 VanDerWaalsContact O-N 3.14Å
451	L	52.6	Low	54.7	Low	33 Å²	33	64.4 Å²	64.4	17%	0.173	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-81.2	-31.6	170.3	-67.1	157.9	0	0	0	113	E75 F76 L79 F448 E449	E75-L451 HydrophobicContact CB-CD2 4.08Å; F76-L451 VanDerWaalsContact CA-CD1 3.47Å; F76-L451 HydrophobicContact CB-CD1 3.46Å; F76-L451 VanDerWaalsContact CB-CD1 3.46Å; F76-L451 HydrophobicContact CD2-CD1 3.81Å; F76-L451 HydrophobicContact CD2-CG 4.47Å; F76-L451 HydrophobicContact CG-CD1 4.06Å; L79-L451 HydrophobicContact CB-CD2 3.97Å; L79-L451 HydrophobicContact CD2-CD2 3.76Å; L79-L451 HydrophobicContact CD2-CG 4.05Å; L79-L451 HydrophobicContact CG-CD2 4.42Å; F448-L451 WeakPolarHBondContact O-CD1 3.11Å; F448-L451 PolarHBondContact O-N 3.36Å; E449-L451 PolarHBondContact O-N 3.26Å; E449-L451 VanDerWaalsContact O-N 3.12Å
452	T	44.9	Very low	53.3	Low	70 Å²	70	70.4 Å²	70.4	43%	0.429	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-6.5	-169.1	38.1	0	0	0	0	113.9	K72 E449 R454	K72-T452 HydrophobicContact CD-CG2 4.24Å; E449-T452 WeakPolarHBondContact CA-OG1 3.42Å; E449-T452 PolarHBondContact O-N 3.39Å; E449-T452 PolarHBondContact O-OG1 2.93Å; T452-R454 PolarHBondContact O-N 2.91Å; T452-R454 VanDerWaalsContact O-N 3.11Å
453	A	44.6	Very low	51.6	Low	20 Å²	20	72.2 Å²	72.2	17%	0.165	40%	0.399	C	S	.	.			trans	-80.1	29.3	169.6	0	0	0	0	0	112.8	H113 G455	H113-A453 PolarHBondContact ND1-O 3.49Å; H113-A453 VanDerWaalsContact ND1-O 3.1Å; A453-G455 PolarHBondContact O-N 3.02Å
454	R	40.1	Very low	49.9	Very low	169 Å²	169	75.3 Å²	75.3	64%	0.638	43%	0.432	S	S	*	.	S	Bend	trans	-61	99.5	144	-72.4	-168	-163.1	-179.4	13.1	103.6	E75 T452 A456	E75-R454 IonicContact OE1-NH2 2.77Å; T452-R454 PolarHBondContact O-N 2.91Å; T452-R454 VanDerWaalsContact O-N 3.11Å; R454-A456 PolarHBondContact O-N 2.92Å
455	G	36.3	Very low	47.6	Very low	45 Å²	45	84.9 Å²	84.9	46%	0.464	47%	0.467	S	S	.	.			trans	-40.5	124.9	-179.8	0	0	0	0	0	107.6	A453 I457	A453-G455 PolarHBondContact O-N 3.02Å; G455-I457 PolarHBondContact O-N 3.27Å
456	A	30.6	Very low	46	Very low	95 Å²	95	86.3 Å²	86.3	79%	0.785	48%	0.479	S	S	*	.			trans	-54.5	101.8	160	0	0	0	0	0	103.6	R454 P458	R454-A456 PolarHBondContact O-N 2.92Å; A456-P458 WeakPolarHBondContact O-CD 3.31Å
457	I	32.6	Very low	44.4	Very low	101 Å²	101	89.8 Å²	89.8	52%	0.518	50%	0.5	S	S	.	.			trans	-51.5	113.7	171.3	-65.9	172.5	0	0	0	102.8	G455 S459 M461 K462	G455-I457 PolarHBondContact O-N 3.27Å; I457-S459 PolarHBondContact O-N 2.71Å; I457-M461 HydrophobicContact CG2-CB 3.47Å; I457-M461 VanDerWaalsContact CG2-CB 3.47Å; I457-M461 HydrophobicContact CG2-CG 4.47Å; I457-M461 HydrophobicContact CG2-SD 4.36Å; I457-K462 HydrophobicContact CG2-CG 4.45Å
458	P	34.1	Very low	42.4	Very low	50 Å²	50	94.6 Å²	94.6	33%	0.325	53%	0.527	S	S	.	.			trans	-51.6	138.3	-177.9	-27.9	36.1	0	0	0	108.1	A456 Y460 M461	A456-P458 WeakPolarHBondContact O-CD 3.31Å; P458-Y460 HydrophobicContact CB-CD1 3.35Å; P458-Y460 HydrophobicContact CB-CD2 4.48Å; P458-Y460 HydrophobicContact CB-CE1 3.03Å; P458-Y460 HydrophobicContact CB-CE2 4.22Å; P458-Y460 HydrophobicContact CB-CG 4.08Å; P458-Y460 HydrophobicContact CG-CD1 4.47Å; P458-Y460 HydrophobicContact CG-CE1 3.73Å; P458-Y460 PolarHBondContact O-N 3.13Å; P458-M461 PolarHBondContact O-N 3.23Å
459	S	32.1	Very low	40.8	Very low	106 Å²	106	98.5 Å²	98.5	74%	0.741	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-51.7	-25.3	-175.2	39.5	0	0	0	0	113	I457 M461 K462	I457-S459 PolarHBondContact O-N 2.71Å; S459-M461 VanDerWaalsContact C-N 3.35Å; S459-M461 PolarHBondContact O-N 3.1Å; S459-K462 PolarHBondContact O-N 3.31Å
460	Y	43.4	Very low	39.2	Very low	171 Å²	171	100.4 Å²	100.4	67%	0.671	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-69.4	-21	175.2	67.7	-104.3	0	0	0	115.2	P458 K462	P458-Y460 HydrophobicContact CB-CD1 3.35Å; P458-Y460 HydrophobicContact CB-CD2 4.48Å; P458-Y460 HydrophobicContact CB-CE1 3.03Å; P458-Y460 HydrophobicContact CB-CE2 4.22Å; P458-Y460 HydrophobicContact CB-CG 4.08Å; P458-Y460 HydrophobicContact CG-CD1 4.47Å; P458-Y460 HydrophobicContact CG-CE1 3.73Å; P458-Y460 PolarHBondContact O-N 3.13Å; Y460-K462 VanDerWaalsContact C-N 3.34Å
461	M	34.4	Very low	38	Very low	128 Å²	128	106.8 Å²	106.8	63%	0.631	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-84.1	-5.9	172.9	-79	-168.9	-166.8	0	0	113.2	I457 P458 S459	I457-M461 HydrophobicContact CG2-CB 3.47Å; I457-M461 VanDerWaalsContact CG2-CB 3.47Å; I457-M461 HydrophobicContact CG2-CG 4.47Å; I457-M461 HydrophobicContact CG2-SD 4.36Å; P458-M461 PolarHBondContact O-N 3.23Å; S459-M461 VanDerWaalsContact C-N 3.35Å; S459-M461 PolarHBondContact O-N 3.1Å
462	K	36.7	Very low	36.9	Very low	167 Å²	167	112.1 Å²	112.1	73%	0.726	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-86.5	-8.4	175.1	-71.1	-175.4	178.3	177.9	0	113.7	I457 S459 Y460 G464	I457-K462 HydrophobicContact CG2-CG 4.45Å; S459-K462 PolarHBondContact O-N 3.31Å; Y460-K462 VanDerWaalsContact C-N 3.34Å; K462-G464 PolarHBondContact O-N 3.21Å
463	A	32.5	Very low	36.3	Very low	93 Å²	93	115.3 Å²	115.3	77%	0.769	65%	0.645	S	S	*	*			trans	-97.4	82.9	176.7	0	0	0	0	0	109.8
464	G	40.9	Very low	35.6	Very low	70 Å²	70	123.3 Å²	123.3	72%	0.722	69%	0.685	S	S	*	*			trans	-177.6	54.7	-178.3	0	0	0	0	0	112.5	K462	K462-G464 PolarHBondContact O-N 3.21Å
465	K	33.7	Very low	35.2	Very low	284 Å²	284	119.1 Å²	119.1	100%	1.235	69%	0.69	S	S	*	*			trans	-137.7	0	154.7	-85.7	-164.6	177.3	-176.7	0	109

Retrieved 465 of 465 residues in 821.6 ms (Link to these results)

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