A0A077Z1K0_TRITR Loading...

Tetratricopeptide repeat protein 39B

AlphaFold DB , UniProt , Accession A0A077Z1K0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 595 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	38.3	Very low	43.1	Very low	219 Å²	219	158.4 Å²	158.4	100%	1.079	82%	0.818	S	S	*	*				0	82.2	0	-163.4	180	96.7	0	0	105
2	E	40.2	Very low	43.7	Very low	197 Å²	197	158.1 Å²	158.1	92%	0.921	82%	0.819	S	S	*	*			trans	-121	92.6	172.9	-79.4	-180	167.3	0	0	104.5	A4	E2-A4 PolarHBondContact O-N 2.92Å
3	E	40.4	Very low	44	Very low	171 Å²	171	153.3 Å²	153.3	80%	0.799	82%	0.817	S	S	*	*			trans	-71.9	107.4	167.7	-72.8	173.5	158.1	0	0	106.3
4	A	46.3	Very low	43.9	Very low	87 Å²	87	152.1 Å²	152.1	72%	0.719	81%	0.809	S	S	*	*			trans	-87.3	107	169	0	0	0	0	0	107.7	E2 N6	E2-A4 PolarHBondContact O-N 2.92Å; A4-N6 PolarHBondContact O-N 2.83Å
5	D	46.1	Very low	44.8	Very low	160 Å²	160	155.5 Å²	155.5	86%	0.856	82%	0.819	S	S	*	*			trans	-53.5	99.9	167.4	-79.9	-38.1	0	0	0	109.8	A7	D5-A7 VanDerWaalsContact C-N 3.33Å; D5-A7 PolarHBondContact O-N 3.48Å; D5-A7 VanDerWaalsContact O-N 3.14Å
6	N	47.7	Very low	44.4	Very low	156 Å²	156	156.5 Å²	156.5	83%	0.834	82%	0.818	S	S	*	*			trans	-79	90.3	162.7	-89.4	-14.3	0	0	0	107.3	A4 E8	A4-N6 PolarHBondContact O-N 2.83Å; N6-E8 PolarHBondContact O-N 3Å; N6-E8 VanDerWaalsContact O-N 3.1Å
7	A	45.2	Very low	44.4	Very low	93 Å²	93	156.5 Å²	156.5	77%	0.769	82%	0.818	S	S	*	*			trans	-54.6	113.6	165.5	0	0	0	0	0	108.8	D5 E9	D5-A7 VanDerWaalsContact C-N 3.33Å; D5-A7 PolarHBondContact O-N 3.48Å; D5-A7 VanDerWaalsContact O-N 3.14Å; A7-E9 PolarHBondContact O-N 3.17Å; A7-E9 VanDerWaalsContact O-N 3.07Å
8	E	46.2	Very low	44.1	Very low	157 Å²	157	153.1 Å²	153.1	73%	0.734	81%	0.807	S	S	*	*			trans	-61.4	107.8	170.5	-69.9	178.3	161.5	0	0	108.1	N6 F10	N6-E8 PolarHBondContact O-N 3Å; N6-E8 VanDerWaalsContact O-N 3.1Å; E8-F10 HydrophobicContact CB-CE2 4.4Å; E8-F10 VanDerWaalsContact O-CD2 3.32Å; E8-F10 WeakPolarHBondContact O-CD2 3.1Å; E8-F10 PolarHBondContact O-N 3.17Å
9	E	41	Very low	43.9	Very low	162 Å²	162	151.6 Å²	151.6	76%	0.757	81%	0.807	S	S	*	*			trans	-64.2	100.9	171.1	-101.2	179.5	164.5	0	0	108.6	A7 H11	A7-E9 PolarHBondContact O-N 3.17Å; A7-E9 VanDerWaalsContact O-N 3.07Å; E9-H11 PolarHBondContact O-N 3.3Å
10	F	39.6	Very low	43.8	Very low	180 Å²	180	151.9 Å²	151.9	79%	0.789	80%	0.796	S	S	*	*			trans	-69.4	109.6	165.1	-72.1	-88.9	0	0	0	108	E8	E8-F10 HydrophobicContact CB-CE2 4.4Å; E8-F10 VanDerWaalsContact O-CD2 3.32Å; E8-F10 WeakPolarHBondContact O-CD2 3.1Å; E8-F10 PolarHBondContact O-N 3.17Å
11	H	43.8	Very low	43.9	Very low	160 Å²	160	152.7 Å²	152.7	74%	0.741	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-78.4	121.4	169	-67.1	-62.8	0	0	0	109.3	E9	E9-H11 PolarHBondContact O-N 3.3Å
12	D	50.4	Low	44.3	Very low	155 Å²	155	148 Å²	148	83%	0.829	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-58.7	137	171	-74.7	-33.6	0	0	0	110.2	L14	D12-L14 PolarHBondContact O-N 3.4Å
13	A	47	Very low	45.2	Very low	96 Å²	96	142 Å²	142	79%	0.793	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-61.2	124.4	174	0	0	0	0	0	109.1	E15	A13-E15 PolarHBondContact O-N 2.81Å
14	L	43	Very low	47	Very low	136 Å²	136	137.1 Å²	137.1	71%	0.712	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-57.5	124.1	177.9	-67.4	168.3	0	0	0	109.7	D12 E16	D12-L14 PolarHBondContact O-N 3.4Å; L14-E16 PolarHBondContact O-N 3.39Å
15	E	57.3	Low	48.9	Very low	204 Å²	204	138.5 Å²	138.5	95%	0.953	74%	0.74	S	S	*	*	S	Bend	trans	-60.1	-24.5	180	-72.4	-174.3	157.1	0	0	112.6	A13	A13-E15 PolarHBondContact O-N 2.81Å
16	E	38.1	Very low	51.1	Low	171 Å²	171	131.5 Å²	131.5	80%	0.799	70%	0.703	S	S	*	*	S	Bend	trans	-130.8	120.6	172.5	-69.4	-176.6	163.3	0	0	109.7	L14	L14-E16 PolarHBondContact O-N 3.39Å
17	L	44.7	Very low	53.2	Low	156 Å²	156	125.1 Å²	125.1	82%	0.817	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-62.6	132.7	166.4	-72.2	167.8	0	0	0	107.9
18	P	38.1	Very low	55.4	Low	96 Å²	96	122.9 Å²	122.9	62%	0.623	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-55.9	137.5	176.6	21.5	-30.7	0	0	0	109.6	R20	P18-R20 PolarHBondContact O-N 3.5Å; P18-R20 VanDerWaalsContact O-N 3.16Å
19	P	41.5	Very low	57.6	Low	125 Å²	125	116 Å²	116	81%	0.812	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-57.7	124.8	-179.3	21.2	-30.2	0	0	0	109	E21	P19-E21 PolarHBondContact O-N 2.87Å
20	R	42.1	Very low	60.2	Low	156 Å²	156	108.4 Å²	108.4	59%	0.589	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-48.4	126.3	174.1	173.7	177.5	151.4	141	-16.5	108.5	P18 N23 D28	P18-R20 PolarHBondContact O-N 3.5Å; P18-R20 VanDerWaalsContact O-N 3.16Å; R20-N23 PolarHBondContact NH2-ND2 3.34Å; R20-D28 IonicContact CZ-OD1 2.84Å; R20-D28 IonicContact NH2-OD1 3.74Å; R20-D28 PolarHBondContact NH2-OD1 3.16Å
21	E	46	Very low	62.8	Low	170 Å²	170	102.2 Å²	102.2	79%	0.794	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-52.9	126.9	170.5	-71.3	-171.4	166.7	0	0	108	P19 N23	P19-E21 PolarHBondContact O-N 2.87Å; E21-N23 PolarHBondContact O-N 2.75Å
22	P	46.2	Very low	65.3	Low	121 Å²	121	96.7 Å²	96.7	79%	0.786	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-60.4	116.5	-178.3	21.4	-29.4	0	0	0	108.4
23	N	59	Low	67.5	Low	71 Å²	71	89.5 Å²	89.5	38%	0.38	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-64.3	169.1	169.9	-84	-17	0	0	0	108.8	R20 E21 V25 V27 D28	R20-N23 PolarHBondContact NH2-ND2 3.34Å; E21-N23 PolarHBondContact O-N 2.75Å; N23-V25 PolarHBondContact O-N 3.37Å; N23-V27 HydrophobicContact CB-CB 4.02Å; N23-V27 HydrophobicContact CB-CG1 3.89Å; N23-V27 WeakPolarHBondContact ND2-CG1 3.34Å; N23-D28 WeakPolarHBondContact CB-OD1 3.21Å
24	S	78.1	Confident	69.8	Low	67 Å²	67	88.8 Å²	88.8	47%	0.469	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-56.8	144.9	170.1	73.6	0	0	0	0	110.2	L26 V27 D28	S24-L26 PolarHBondContact O-N 2.88Å; S24-V27 PolarHBondContact O-N 2.59Å; S24-V27 WeakPolarHBondContact OG-CG2 3.41Å; S24-V27 PolarHBondContact OG-N 3.02Å; S24-D28 PolarHBondContact O-N 2.96Å; S24-D28 VanDerWaalsContact O-N 3.16Å
25	V	86.6	Confident	72.3	Confident	117 Å²	117	86.5 Å²	86.5	71%	0.709	45%	0.451	S	S	*	.	H	α-helix	trans	-50.4	-33.1	178.1	175.9	0	0	0	0	111.8	N23 S29	N23-V25 PolarHBondContact O-N 3.37Å; V25-S29 WeakPolarHBondContact O-CB 3.32Å; V25-S29 PolarHBondContact O-N 3.39Å; V25-S29 VanDerWaalsContact O-N 3.09Å
26	L	91.1	Very high	74.2	Confident	13 Å²	13	76.8 Å²	76.8	7%	0.068	41%	0.406	C	S	.	.	H	α-helix	trans	-64.6	-47.1	175.8	179.1	61.1	0	0	0	112.7	S24 S29 I30 Y61 D125 H129 V186	S24-L26 PolarHBondContact O-N 2.88Å; L26-S29 WeakPolarHBondContact O-CB 3.24Å; L26-S29 PolarHBondContact O-N 2.82Å; L26-I30 HydrophobicContact CD1-CD1 4.23Å; L26-I30 HydrophobicContact CG-CD1 4.14Å; L26-I30 VanDerWaalsContact O-CG1 3.31Å; L26-I30 WeakPolarHBondContact O-CG1 3.41Å; L26-I30 PolarHBondContact O-N 3.06Å; L26-Y61 HydrophobicContact CD1-CD2 4.12Å; L26-Y61 HydrophobicContact CD1-CE2 3.81Å; L26-D125 HydrophobicContact CD2-CB 4.22Å; L26-H129 HydrophobicContact CD1-CB 3.93Å; L26-H129 HydrophobicContact CD2-CB 4.48Å; L26-V186 HydrophobicContact CD2-CG1 3.74Å
27	V	91.7	Very high	76.9	Confident	21 Å²	21	68.9 Å²	68.9	13%	0.127	37%	0.369	C	S	.	.	H	α-helix	trans	-65.9	-45.7	-179	169.6	0	0	0	0	110.7	N23 S24 S29 I30 E31 V186	N23-V27 HydrophobicContact CB-CB 4.02Å; N23-V27 HydrophobicContact CB-CG1 3.89Å; N23-V27 WeakPolarHBondContact ND2-CG1 3.34Å; S24-V27 PolarHBondContact O-N 2.59Å; S24-V27 WeakPolarHBondContact OG-CG2 3.41Å; S24-V27 PolarHBondContact OG-N 3.02Å; V27-S29 VanDerWaalsContact C-N 3.28Å; V27-S29 PolarHBondContact O-N 3.32Å; V27-I30 PolarHBondContact O-N 2.95Å; V27-E31 HydrophobicContact CG1-CG 4.44Å; V27-E31 WeakPolarHBondContact O-CG 3.25Å; V27-E31 PolarHBondContact O-N 3.39Å; V27-V186 HydrophobicContact CG2-CG2 3.47Å; V27-V186 VanDerWaalsContact CG2-CG2 3.47Å
28	D	91.2	Very high	79.4	Confident	47 Å²	47	64 Å²	64	25%	0.251	34%	0.344	S	S	.	.	H	α-helix	trans	-60.9	-41.1	177.2	-73.2	-24.3	0	0	0	111.1	R20 N23 S24 I30 E31 D32	R20-D28 IonicContact CZ-OD1 2.84Å; R20-D28 IonicContact NH2-OD1 3.74Å; R20-D28 PolarHBondContact NH2-OD1 3.16Å; N23-D28 WeakPolarHBondContact CB-OD1 3.21Å; S24-D28 PolarHBondContact O-N 2.96Å; S24-D28 VanDerWaalsContact O-N 3.16Å; D28-I30 PolarHBondContact O-N 3.41Å; D28-E31 PolarHBondContact O-N 3.16Å; D28-D32 WeakPolarHBondContact O-CB 3.41Å; D28-D32 PolarHBondContact O-N 3.37Å
29	S	93.3	Very high	82.2	Confident	12 Å²	12	60.4 Å²	60.4	8%	0.084	32%	0.319	C	S	.	.	H	α-helix	trans	-62.1	-37.5	176.4	-173.6	0	0	0	0	113.7	V25 L26 V27 T33 S59 Y61	V25-S29 WeakPolarHBondContact O-CB 3.32Å; V25-S29 PolarHBondContact O-N 3.39Å; V25-S29 VanDerWaalsContact O-N 3.09Å; L26-S29 WeakPolarHBondContact O-CB 3.24Å; L26-S29 PolarHBondContact O-N 2.82Å; V27-S29 VanDerWaalsContact C-N 3.28Å; V27-S29 PolarHBondContact O-N 3.32Å; S29-T33 WeakPolarHBondContact O-CB 3.2Å; S29-T33 PolarHBondContact O-N 3.47Å; S29-T33 PolarHBondContact O-OG1 3.32Å; S29-S59 PolarHBondContact OG-OG 2.92Å; S29-Y61 WeakPolarHBondContact OG-CB 3.39Å
30	I	95.7	Very high	84.8	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-67.7	-45.9	173.6	-70	165.4	0	0	0	110.6	L26 V27 D28 T33 R34 Y61 H189 L242	L26-I30 HydrophobicContact CD1-CD1 4.23Å; L26-I30 HydrophobicContact CG-CD1 4.14Å; L26-I30 VanDerWaalsContact O-CG1 3.31Å; L26-I30 WeakPolarHBondContact O-CG1 3.41Å; L26-I30 PolarHBondContact O-N 3.06Å; V27-I30 PolarHBondContact O-N 2.95Å; D28-I30 PolarHBondContact O-N 3.41Å; I30-T33 PolarHBondContact O-N 3.48Å; I30-R34 WeakPolarHBondContact O-CB 3.32Å; I30-R34 PolarHBondContact O-N 2.88Å; I30-Y61 HydrophobicContact CD1-CE2 3.97Å; I30-Y61 HydrophobicContact CG1-CD1 4.14Å; I30-Y61 HydrophobicContact CG1-CD2 3.7Å; I30-Y61 HydrophobicContact CG1-CE1 3.93Å; I30-Y61 HydrophobicContact CG1-CE2 3.5Å; I30-Y61 HydrophobicContact CG1-CG 4.04Å; I30-H189 HydrophobicContact CD1-CB 4.16Å; I30-H189 VanDerWaalsContact CG2-CE1 3.4Å; I30-H189 WeakPolarHBondContact CG2-CE1 3.49Å; I30-H189 WeakPolarHBondContact CG2-ND1 3.38Å; I30-L242 HydrophobicContact CG2-CB 4.4Å; I30-L242 HydrophobicContact CG2-CD2 4.33Å
31	E	94.9	Very high	87.3	Confident	51 Å²	51	47.3 Å²	47.3	24%	0.238	25%	0.254	C	S	.	.	H	α-helix	trans	-65.4	-43.1	-178.3	-75.6	-58.2	143.5	0	0	112.6	V27 D28 T33 R34 H35	V27-E31 HydrophobicContact CG1-CG 4.44Å; V27-E31 WeakPolarHBondContact O-CG 3.25Å; V27-E31 PolarHBondContact O-N 3.39Å; D28-E31 PolarHBondContact O-N 3.16Å; E31-T33 VanDerWaalsContact C-N 3.28Å; E31-T33 PolarHBondContact O-N 3.17Å; E31-R34 WeakPolarHBondContact O-CB 3.42Å; E31-R34 PolarHBondContact O-N 3.49Å; E31-R34 VanDerWaalsContact O-N 3.12Å; E31-R34 IonicContact OE1-CZ 3.95Å; E31-R34 IonicContact OE1-NE 2.65Å; E31-R34 PolarHBondContact OE1-NE 3.28Å; E31-R34 IonicContact OE1-NH1 4Å; E31-R34 IonicContact OE1-NH2 3.29Å; E31-R34 PolarHBondContact OE1-NH2 2.87Å; E31-R34 IonicContact OE2-CZ 2.76Å; E31-R34 IonicContact OE2-NE 2.62Å; E31-R34 PolarHBondContact OE2-NE 3.29Å; E31-R34 IonicContact OE2-NH2 3.21Å; E31-R34 PolarHBondContact OE2-NH2 2.75Å; E31-H35 PolarHBondContact O-N 3.38Å
32	D	94.4	Very high	89.7	Confident	44 Å²	44	41.9 Å²	41.9	24%	0.235	23%	0.23	C	C	.	.	H	α-helix	trans	-57.1	-44.6	172.5	-72.9	-25.3	0	0	0	111.3	D28 R34 H35 A36 F51 R62	D28-D32 WeakPolarHBondContact O-CB 3.41Å; D28-D32 PolarHBondContact O-N 3.37Å; D32-R34 VanDerWaalsContact C-N 3.3Å; D32-R34 PolarHBondContact O-N 3.29Å; D32-H35 WeakPolarHBondContact O-CB 3.39Å; D32-H35 PolarHBondContact O-N 3.33Å; D32-A36 PolarHBondContact O-N 2.89Å; D32-F51 HydrophobicContact CB-CE1 3.94Å; D32-F51 HydrophobicContact CB-CZ 4.37Å; D32-F51 VanDerWaalsContact O-CE1 3.29Å; D32-F51 WeakPolarHBondContact O-CE1 3.48Å; D32-R62 VanDerWaalsContact CG-NH2 3.33Å; D32-R62 IonicContact OD1-NH2 2.76Å; D32-R62 IonicContact OD2-CZ 3.3Å; D32-R62 IonicContact OD2-NE 3.8Å; D32-R62 PolarHBondContact OD2-NE 3.43Å; D32-R62 IonicContact OD2-NH2 3.91Å; D32-R62 PolarHBondContact OD2-NH2 3.4Å
33	T	96.5	Very high	92.1	Very high	4 Å²	4	36.9 Å²	36.9	3%	0.025	20%	0.197	C	C	.	.	H	α-helix	trans	-68.8	-33.9	179.2	-54.3	0	0	0	0	111.1	S29 I30 E31 A36 M37 Y61 R62 L242	S29-T33 WeakPolarHBondContact O-CB 3.2Å; S29-T33 PolarHBondContact O-N 3.47Å; S29-T33 PolarHBondContact O-OG1 3.32Å; I30-T33 PolarHBondContact O-N 3.48Å; E31-T33 VanDerWaalsContact C-N 3.28Å; E31-T33 PolarHBondContact O-N 3.17Å; T33-A36 PolarHBondContact O-N 3.03Å; T33-M37 WeakPolarHBondContact O-CG 3.35Å; T33-M37 PolarHBondContact O-N 3.35Å; T33-Y61 WeakPolarHBondContact CG2-O 3.32Å; T33-Y61 VanDerWaalsContact OG1-C 3.26Å; T33-Y61 WeakPolarHBondContact OG1-CB 3.43Å; T33-Y61 PolarHBondContact OG1-O 2.76Å; T33-R62 PolarHBondContact OG1-N 3.27Å; T33-L242 HydrophobicContact CG2-CD1 4.25Å; T33-L242 HydrophobicContact CG2-CD2 3.81Å
34	R	95.8	Very high	93.8	Very high	81 Å²	81	36.6 Å²	36.6	31%	0.306	19%	0.193	S	C	.	.	H	α-helix	trans	-65.5	-41.2	173.5	-169	171.3	70.1	162.7	6.2	111.6	I30 E31 D32 M37 N38 Y240 L242	I30-R34 WeakPolarHBondContact O-CB 3.32Å; I30-R34 PolarHBondContact O-N 2.88Å; E31-R34 WeakPolarHBondContact O-CB 3.42Å; E31-R34 PolarHBondContact O-N 3.49Å; E31-R34 VanDerWaalsContact O-N 3.12Å; E31-R34 IonicContact OE1-CZ 3.95Å; E31-R34 IonicContact OE1-NE 2.65Å; E31-R34 PolarHBondContact OE1-NE 3.28Å; E31-R34 IonicContact OE1-NH1 4Å; E31-R34 IonicContact OE1-NH2 3.29Å; E31-R34 PolarHBondContact OE1-NH2 2.87Å; E31-R34 IonicContact OE2-CZ 2.76Å; E31-R34 IonicContact OE2-NE 2.62Å; E31-R34 PolarHBondContact OE2-NE 3.29Å; E31-R34 IonicContact OE2-NH2 3.21Å; E31-R34 PolarHBondContact OE2-NH2 2.75Å; D32-R34 VanDerWaalsContact C-N 3.3Å; D32-R34 PolarHBondContact O-N 3.29Å; R34-M37 PolarHBondContact O-N 3.16Å; R34-N38 VanDerWaalsContact O-CG 3.29Å; R34-N38 PolarHBondContact O-N 2.7Å; R34-N38 PolarHBondContact O-ND2 3.5Å; R34-Y240 PolarHBondContact NH1-O 3.16Å; R34-L242 HydrophobicContact CB-CD1 3.9Å; R34-L242 HydrophobicContact CG-CD1 4.35Å
35	H	96	Very high	94.5	Very high	87 Å²	87	34 Å²	34	40%	0.403	17%	0.173	S	C	.	.	H	α-helix	trans	-60.3	-48.1	173.5	179.4	70.5	0	0	0	111.5	E31 D32 M37 N38 L39 F51	E31-H35 PolarHBondContact O-N 3.38Å; D32-H35 WeakPolarHBondContact O-CB 3.39Å; D32-H35 PolarHBondContact O-N 3.33Å; H35-M37 VanDerWaalsContact C-N 3.31Å; H35-M37 PolarHBondContact O-N 2.87Å; H35-N38 WeakPolarHBondContact O-CB 2.98Å; H35-N38 PolarHBondContact O-N 3.21Å; H35-L39 PolarHBondContact O-N 3.42Å; H35-F51 AromaticContact CD2-CE2 3.73Å; H35-F51 AromaticContact CD2-CZ 3.71Å
36	A	96.6	Very high	94.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-60.4	-39.3	176.1	0	0	0	0	0	112.8	D32 T33 N38 L39 F40 A48 F51 M52	D32-A36 PolarHBondContact O-N 2.89Å; T33-A36 PolarHBondContact O-N 3.03Å; A36-N38 VanDerWaalsContact C-N 3.32Å; A36-N38 PolarHBondContact O-N 3.47Å; A36-L39 WeakPolarHBondContact O-CB 3.45Å; A36-L39 PolarHBondContact O-N 3.17Å; A36-F40 PolarHBondContact O-N 3.41Å; A36-A48 WeakPolarHBondContact O-CB 3.47Å; A36-F51 HydrophobicContact CB-CD1 3.95Å; A36-M52 HydrophobicContact CB-CE 4Å; A36-M52 HydrophobicContact CB-CG 3.43Å; A36-M52 VanDerWaalsContact CB-CG 3.43Å; A36-M52 HydrophobicContact CB-SD 3.54Å; A36-M52 VanDerWaalsContact CB-SD 3.54Å
37	M	95.9	Very high	95	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.025	19%	0.193	C	C	.	.	H	α-helix	trans	-65.1	-35.6	174.3	-73.9	-52.3	-43.3	0	0	112.3	T33 R34 H35 F40 F41 T69 L242 L246	T33-M37 WeakPolarHBondContact O-CG 3.35Å; T33-M37 PolarHBondContact O-N 3.35Å; R34-M37 PolarHBondContact O-N 3.16Å; H35-M37 VanDerWaalsContact C-N 3.31Å; H35-M37 PolarHBondContact O-N 2.87Å; M37-F40 HydrophobicContact CE-CB 4.26Å; M37-F40 HydrophobicContact CE-CD1 3.76Å; M37-F40 HydrophobicContact CE-CE1 4.44Å; M37-F40 HydrophobicContact CE-CG 4.15Å; M37-F40 WeakPolarHBondContact O-CB 3.32Å; M37-F40 PolarHBondContact O-N 2.99Å; M37-F41 HydrophobicContact CE-CD2 3.94Å; M37-F41 HydrophobicContact CE-CE2 3.44Å; M37-F41 VanDerWaalsContact CE-CE2 3.44Å; M37-F41 HydrophobicContact CE-CZ 4.2Å; M37-F41 WeakPolarHBondContact O-CD2 3.43Å; M37-F41 PolarHBondContact O-N 3.26Å; M37-T69 HydrophobicContact SD-CG2 4.08Å; M37-L242 HydrophobicContact CB-CD1 4.42Å; M37-L242 HydrophobicContact CG-CD1 3.96Å; M37-L246 HydrophobicContact CE-CD2 4.17Å
38	N	96.3	Very high	95.2	Very high	53 Å²	53	38.9 Å²	38.9	28%	0.283	19%	0.187	S	C	.	.	H	α-helix	trans	-64.8	-41.7	174.5	-70	-24.3	0	0	0	111.8	R34 H35 A36 F40 F41 N42 Y283	R34-N38 VanDerWaalsContact O-CG 3.29Å; R34-N38 PolarHBondContact O-N 2.7Å; R34-N38 PolarHBondContact O-ND2 3.5Å; H35-N38 WeakPolarHBondContact O-CB 2.98Å; H35-N38 PolarHBondContact O-N 3.21Å; A36-N38 VanDerWaalsContact C-N 3.32Å; A36-N38 PolarHBondContact O-N 3.47Å; N38-F40 VanDerWaalsContact C-N 3.34Å; N38-F41 PolarHBondContact O-N 3.43Å; N38-N42 PolarHBondContact O-N 2.97Å; N38-N42 VanDerWaalsContact O-N 3.13Å; N38-N42 PolarHBondContact O-ND2 2.83Å; N38-Y283 HydrophobicContact CB-CE1 4.32Å; N38-Y283 WeakPolarHBondContact OD1-CE1 3.36Å; N38-Y283 PolarHBondContact OD1-OH 2.87Å
39	L	96.8	Very high	95.3	Very high	21 Å²	21	38.1 Å²	38.1	11%	0.11	18%	0.184	C	C	.	.	H	α-helix	trans	-58.4	-47.9	172.3	-67.1	173.4	0	0	0	110.6	H35 A36 F41 N42 N43 Q44 E47 A48	H35-L39 PolarHBondContact O-N 3.42Å; A36-L39 WeakPolarHBondContact O-CB 3.45Å; A36-L39 PolarHBondContact O-N 3.17Å; L39-F41 PolarHBondContact O-N 3.09Å; L39-N42 CarbonylContact O-C 3.51Å; L39-N42 PolarHBondContact O-N 3.33Å; L39-N42 VanDerWaalsContact O-N 3.09Å; L39-N43 PolarHBondContact O-N 3.21Å; L39-Q44 HydrophobicContact CB-CB 4.14Å; L39-Q44 HydrophobicContact CD2-CB 4.38Å; L39-Q44 VanDerWaalsContact CD2-OE1 3.25Å; L39-Q44 WeakPolarHBondContact O-CB 3.49Å; L39-Q44 PolarHBondContact O-N 3.21Å; L39-E47 HydrophobicContact CD1-CB 4.35Å; L39-A48 HydrophobicContact CB-CB 3.87Å
40	F	95.7	Very high	95.4	Very high	5 Å²	5	40.3 Å²	40.3	2%	0.022	20%	0.203	C	C	.	.	H	α-helix	trans	-57.1	-47.2	178.6	177.5	-87.3	0	0	0	112.8	A36 M37 N38 N42 N43 F45 A48 T69 I72 W320	A36-F40 PolarHBondContact O-N 3.41Å; M37-F40 HydrophobicContact CE-CB 4.26Å; M37-F40 HydrophobicContact CE-CD1 3.76Å; M37-F40 HydrophobicContact CE-CE1 4.44Å; M37-F40 HydrophobicContact CE-CG 4.15Å; M37-F40 WeakPolarHBondContact O-CB 3.32Å; M37-F40 PolarHBondContact O-N 2.99Å; N38-F40 VanDerWaalsContact C-N 3.34Å; F40-N42 PolarHBondContact O-N 3.45Å; F40-N43 PolarHBondContact O-N 3.33Å; F40-N43 VanDerWaalsContact O-N 3.12Å; F40-F45 AromaticContact CD2-CD1 3.64Å; F40-F45 HydrophobicContact CD2-CD1 3.64Å; F40-F45 HydrophobicContact CD2-CE1 4.17Å; F40-F45 AromaticContact CE2-CD1 3.75Å; F40-F45 HydrophobicContact CE2-CD1 3.75Å; F40-F45 HydrophobicContact CE2-CE1 4.06Å; F40-F45 HydrophobicContact CG-CD1 4.26Å; F40-F45 HydrophobicContact CZ-CD1 4.43Å; F40-F45 HydrophobicContact CZ-CE1 4.29Å; F40-F45 WeakPolarHBondContact O-CE1 3.44Å; F40-A48 HydrophobicContact CB-CB 4.08Å; F40-T69 HydrophobicContact CB-CG2 4.29Å; F40-T69 HydrophobicContact CD2-CG2 3.47Å; F40-T69 VanDerWaalsContact CD2-CG2 3.47Å; F40-T69 HydrophobicContact CE2-CG2 3.97Å; F40-T69 HydrophobicContact CG-CG2 3.96Å; F40-I72 HydrophobicContact CE1-CD1 3.94Å; F40-I72 HydrophobicContact CE1-CG2 4.19Å; F40-I72 HydrophobicContact CZ-CB 3.92Å; F40-I72 HydrophobicContact CZ-CD1 4.02Å; F40-I72 HydrophobicContact CZ-CG2 3.68Å; F40-W320 AromaticContact CE2-CH2 3.48Å; F40-W320 HydrophobicContact CE2-CH2 3.48Å; F40-W320 VanDerWaalsContact CE2-CH2 3.48Å; F40-W320 AromaticContact CE2-CZ2 3.88Å; F40-W320 HydrophobicContact CE2-CZ2 3.88Å; F40-W320 AromaticContact CZ-CH2 3.57Å; F40-W320 HydrophobicContact CZ-CH2 3.57Å; F40-W320 HydrophobicContact CZ-CZ2 4.42Å; F40-W320 HydrophobicContact CZ-CZ3 4.3Å
41	F	95.7	Very high	95.4	Very high	1 Å²	1	43.4 Å²	43.4	0%	0.004	22%	0.216	C	C	.	.	H	α-helix	trans	-69.7	-21.8	179.3	-80.6	-70.4	0	0	0	113.2	M37 N38 L39 N43 P245 L246 L249 M279 Y283 S286 L288	M37-F41 HydrophobicContact CE-CD2 3.94Å; M37-F41 HydrophobicContact CE-CE2 3.44Å; M37-F41 VanDerWaalsContact CE-CE2 3.44Å; M37-F41 HydrophobicContact CE-CZ 4.2Å; M37-F41 WeakPolarHBondContact O-CD2 3.43Å; M37-F41 PolarHBondContact O-N 3.26Å; N38-F41 PolarHBondContact O-N 3.43Å; L39-F41 PolarHBondContact O-N 3.09Å; F41-N43 VanDerWaalsContact C-N 3.26Å; F41-N43 PolarHBondContact O-N 2.96Å; F41-P245 HydrophobicContact CD2-CB 4.35Å; F41-P245 HydrophobicContact CD2-CG 4.43Å; F41-P245 HydrophobicContact CE2-CB 3.63Å; F41-P245 HydrophobicContact CE2-CG 3.67Å; F41-P245 HydrophobicContact CZ-CB 3.75Å; F41-P245 HydrophobicContact CZ-CG 4.21Å; F41-L246 HydrophobicContact CZ-CD2 4.41Å; F41-L249 HydrophobicContact CE1-CD1 3.73Å; F41-L249 HydrophobicContact CE1-CD2 4.31Å; F41-L249 HydrophobicContact CE1-CG 4.13Å; F41-L249 HydrophobicContact CZ-CD1 3.7Å; F41-L249 HydrophobicContact CZ-CG 4.24Å; F41-M279 HydrophobicContact CD1-CE 4.01Å; F41-M279 HydrophobicContact CE1-CE 3.6Å; F41-M279 HydrophobicContact CZ-CE 4.17Å; F41-Y283 HydrophobicContact CB-CD1 3.54Å; F41-Y283 HydrophobicContact CB-CD2 3.98Å; F41-Y283 HydrophobicContact CB-CE1 3.69Å; F41-Y283 HydrophobicContact CB-CE2 4.1Å; F41-Y283 HydrophobicContact CB-CG 3.69Å; F41-Y283 HydrophobicContact CD2-CE2 4.26Å; F41-Y283 HydrophobicContact CG-CD2 4.26Å; F41-Y283 HydrophobicContact CG-CE1 4.44Å; F41-Y283 HydrophobicContact CG-CE2 4.13Å; F41-Y283 HydrophobicContact CG-CG 4.46Å; F41-S286 WeakPolarHBondContact O-CA 3.32Å; F41-S286 WeakPolarHBondContact O-CB 3.4Å; F41-S286 PolarHBondContact O-OG 2.92Å; F41-L288 HydrophobicContact CE1-CD2 4.07Å
42	N	96.6	Very high	95.3	Very high	57 Å²	57	41 Å²	41	31%	0.305	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	20.5	171.3	-70.6	-60.5	0	0	0	113.2	N38 L39 F40 Q44	N38-N42 PolarHBondContact O-N 2.97Å; N38-N42 VanDerWaalsContact O-N 3.13Å; N38-N42 PolarHBondContact O-ND2 2.83Å; L39-N42 CarbonylContact O-C 3.51Å; L39-N42 PolarHBondContact O-N 3.33Å; L39-N42 VanDerWaalsContact O-N 3.09Å; F40-N42 PolarHBondContact O-N 3.45Å; N42-Q44 PolarHBondContact O-N 3.09Å
43	N	95.8	Very high	95.2	Very high	15 Å²	15	44.5 Å²	44.5	8%	0.08	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	12.1	178	-38.7	-61.2	0	0	0	115.3	L39 F40 F41 F45 E285 S287 Q317	L39-N43 PolarHBondContact O-N 3.21Å; F40-N43 PolarHBondContact O-N 3.33Å; F40-N43 VanDerWaalsContact O-N 3.12Å; F41-N43 VanDerWaalsContact C-N 3.26Å; F41-N43 PolarHBondContact O-N 2.96Å; N43-F45 VanDerWaalsContact C-N 3.26Å; N43-F45 HydrophobicContact CB-CE2 4.1Å; N43-F45 HydrophobicContact CB-CZ 4.1Å; N43-F45 WeakPolarHBondContact O-CD2 3.38Å; N43-F45 PolarHBondContact O-N 3.38Å; N43-F45 VanDerWaalsContact O-N 3.11Å; N43-E285 PolarHBondContact ND2-O 2.7Å; N43-S287 WeakPolarHBondContact OD1-CB 3.29Å; N43-S287 PolarHBondContact OD1-N 3.47Å; N43-S287 PolarHBondContact OD1-OG 3.43Å; N43-Q317 HydrophobicContact CB-CB 4.16Å
44	Q	95.3	Very high	94.9	Very high	66 Å²	66	49 Å²	49	31%	0.308	25%	0.249	S	C	.	.			trans	-88	63.8	176.1	-59.1	175.6	-88.7	0	0	109.5	L39 N42 E47 A48	L39-Q44 HydrophobicContact CB-CB 4.14Å; L39-Q44 HydrophobicContact CD2-CB 4.38Å; L39-Q44 VanDerWaalsContact CD2-OE1 3.25Å; L39-Q44 WeakPolarHBondContact O-CB 3.49Å; L39-Q44 PolarHBondContact O-N 3.21Å; N42-Q44 PolarHBondContact O-N 3.09Å; Q44-E47 HydrophobicContact CB-CB 4.16Å; Q44-E47 HydrophobicContact CB-CG 4.43Å; Q44-E47 VanDerWaalsContact NE2-CD 3.29Å; Q44-E47 PolarHBondContact NE2-OE1 3.25Å; Q44-E47 PolarHBondContact NE2-OE2 3.34Å; Q44-A48 WeakPolarHBondContact O-CB 3.46Å; Q44-A48 PolarHBondContact O-N 3.02Å
45	F	93.4	Very high	94.6	Very high	11 Å²	11	45.6 Å²	45.6	5%	0.048	24%	0.239	C	C	.	.	H	α-helix	trans	-69.2	-45.7	-167.7	-51.8	-66.4	0	0	0	112.7	F40 N43 A48 V49 Q317 E319 W320	F40-F45 AromaticContact CD2-CD1 3.64Å; F40-F45 HydrophobicContact CD2-CD1 3.64Å; F40-F45 HydrophobicContact CD2-CE1 4.17Å; F40-F45 AromaticContact CE2-CD1 3.75Å; F40-F45 HydrophobicContact CE2-CD1 3.75Å; F40-F45 HydrophobicContact CE2-CE1 4.06Å; F40-F45 HydrophobicContact CG-CD1 4.26Å; F40-F45 HydrophobicContact CZ-CD1 4.43Å; F40-F45 HydrophobicContact CZ-CE1 4.29Å; F40-F45 WeakPolarHBondContact O-CE1 3.44Å; N43-F45 VanDerWaalsContact C-N 3.26Å; N43-F45 HydrophobicContact CB-CE2 4.1Å; N43-F45 HydrophobicContact CB-CZ 4.1Å; N43-F45 WeakPolarHBondContact O-CD2 3.38Å; N43-F45 PolarHBondContact O-N 3.38Å; N43-F45 VanDerWaalsContact O-N 3.11Å; F45-A48 PolarHBondContact O-N 3.13Å; F45-V49 WeakPolarHBondContact O-CG2 3.47Å; F45-V49 PolarHBondContact O-N 3.48Å; F45-Q317 HydrophobicContact CE2-CB 4.23Å; F45-Q317 HydrophobicContact CE2-CG 4.15Å; F45-E319 WeakPolarHBondContact CB-OE2 3.32Å; F45-E319 HydrophobicContact CD2-CB 4.27Å; F45-W320 HydrophobicContact CB-CZ2 4.31Å; F45-W320 HydrophobicContact CD1-CH2 4Å; F45-W320 AromaticContact CD1-CZ2 3.62Å; F45-W320 HydrophobicContact CD1-CZ2 3.62Å; F45-W320 HydrophobicContact CD2-CD2 4.32Å; F45-W320 AromaticContact CD2-CE2 3.91Å; F45-W320 HydrophobicContact CD2-CG 4.48Å; F45-W320 HydrophobicContact CD2-CZ2 4.35Å; F45-W320 AromaticContact CD2-NE1 3.77Å; F45-W320 HydrophobicContact CE1-CE3 4.45Å; F45-W320 AromaticContact CE1-CH2 3.91Å; F45-W320 HydrophobicContact CE1-CH2 3.91Å; F45-W320 AromaticContact CE1-CZ2 3.94Å; F45-W320 HydrophobicContact CE1-CZ2 3.94Å; F45-W320 HydrophobicContact CE1-CZ3 4.16Å; F45-W320 HydrophobicContact CE2-CD2 4.11Å; F45-W320 HydrophobicContact CE2-CG 4.34Å; F45-W320 AromaticContact CG-CE2 3.83Å; F45-W320 AromaticContact CG-CZ2 3.84Å; F45-W320 HydrophobicContact CG-CZ2 3.84Å; F45-W320 AromaticContact CG-NE1 3.88Å; F45-W320 HydrophobicContact CZ-CD2 4.22Å; F45-W320 HydrophobicContact CZ-CE3 4.21Å; F45-W320 HydrophobicContact CZ-CH2 4.46Å; F45-W320 HydrophobicContact CZ-CZ2 4.42Å; F45-W320 HydrophobicContact CZ-CZ3 4.33Å
46	E	92.9	Very high	94.2	Very high	147 Å²	147	41.8 Å²	41.8	69%	0.687	22%	0.223	S	C	*	.	H	α-helix	trans	-62.6	-42.2	177.1	-71.6	-176	176.6	0	0	111.9	V49 A50	E46-V49 PolarHBondContact O-N 2.9Å; E46-A50 VanDerWaalsContact O-CB 3.31Å; E46-A50 WeakPolarHBondContact O-CB 3.42Å; E46-A50 PolarHBondContact O-N 3.17Å
47	E	95	Very high	94.1	Very high	107 Å²	107	45.8 Å²	45.8	50%	0.5	25%	0.245	S	C	.	.	H	α-helix	trans	-63.4	-43.5	176.8	-63.6	-179	-117.4	0	0	111.7	L39 Q44 V49 A50 F51	L39-E47 HydrophobicContact CD1-CB 4.35Å; Q44-E47 HydrophobicContact CB-CB 4.16Å; Q44-E47 HydrophobicContact CB-CG 4.43Å; Q44-E47 VanDerWaalsContact NE2-CD 3.29Å; Q44-E47 PolarHBondContact NE2-OE1 3.25Å; Q44-E47 PolarHBondContact NE2-OE2 3.34Å; E47-V49 VanDerWaalsContact C-N 3.3Å; E47-V49 PolarHBondContact O-N 3.38Å; E47-A50 PolarHBondContact O-N 2.84Å; E47-F51 VanDerWaalsContact O-CB 3.3Å; E47-F51 WeakPolarHBondContact O-CB 3.31Å; E47-F51 PolarHBondContact O-N 2.99Å
48	A	95.5	Very high	93.9	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-59.3	-42.6	175.7	0	0	0	0	0	111.9	A36 L39 F40 Q44 F45 M52	A36-A48 WeakPolarHBondContact O-CB 3.47Å; L39-A48 HydrophobicContact CB-CB 3.87Å; F40-A48 HydrophobicContact CB-CB 4.08Å; Q44-A48 WeakPolarHBondContact O-CB 3.46Å; Q44-A48 PolarHBondContact O-N 3.02Å; F45-A48 PolarHBondContact O-N 3.13Å; A48-M52 VanDerWaalsContact O-CE 3.25Å; A48-M52 WeakPolarHBondContact O-CE 3.38Å; A48-M52 WeakPolarHBondContact O-CG 3.42Å; A48-M52 PolarHBondContact O-N 3.45Å
49	V	93.9	Very high	93.8	Very high	32 Å²	32	49.1 Å²	49.1	19%	0.194	26%	0.263	C	S	.	.	H	α-helix	trans	-66.7	-49	177.8	169.4	0	0	0	0	110.9	F45 E46 E47 F51 M52 E53 F66	F45-V49 WeakPolarHBondContact O-CG2 3.47Å; F45-V49 PolarHBondContact O-N 3.48Å; E46-V49 PolarHBondContact O-N 2.9Å; E47-V49 VanDerWaalsContact C-N 3.3Å; E47-V49 PolarHBondContact O-N 3.38Å; V49-F51 PolarHBondContact O-N 3.19Å; V49-M52 PolarHBondContact O-N 3.38Å; V49-M52 VanDerWaalsContact O-N 3.16Å; V49-E53 WeakPolarHBondContact O-CB 3.38Å; V49-E53 PolarHBondContact O-N 3.2Å; V49-F66 HydrophobicContact CG1-CD2 4.14Å; V49-F66 HydrophobicContact CG1-CE2 3.68Å
50	A	94.8	Very high	93.7	Very high	57 Å²	57	48.3 Å²	48.3	47%	0.471	26%	0.259	S	S	.	.	H	α-helix	trans	-61.9	-32.5	179.5	0	0	0	0	0	112.4	E46 E47 P54	E46-A50 VanDerWaalsContact O-CB 3.31Å; E46-A50 WeakPolarHBondContact O-CB 3.42Å; E46-A50 PolarHBondContact O-N 3.17Å; E47-A50 PolarHBondContact O-N 2.84Å; A50-P54 WeakPolarHBondContact O-CD 3.48Å
51	F	95.2	Very high	93.8	Very high	68 Å²	68	48.1 Å²	48.1	30%	0.298	26%	0.259	S	S	.	.	H	α-helix	trans	-68.9	-38.7	175.7	-175	-90.1	0	0	0	112.6	D32 H35 A36 E47 V49	D32-F51 HydrophobicContact CB-CE1 3.94Å; D32-F51 HydrophobicContact CB-CZ 4.37Å; D32-F51 VanDerWaalsContact O-CE1 3.29Å; D32-F51 WeakPolarHBondContact O-CE1 3.48Å; H35-F51 AromaticContact CD2-CE2 3.73Å; H35-F51 AromaticContact CD2-CZ 3.71Å; A36-F51 HydrophobicContact CB-CD1 3.95Å; E47-F51 VanDerWaalsContact O-CB 3.3Å; E47-F51 WeakPolarHBondContact O-CB 3.31Å; E47-F51 PolarHBondContact O-N 2.99Å; V49-F51 PolarHBondContact O-N 3.19Å
52	M	93.8	Very high	93.8	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-83.9	-33.1	-177.1	-67.9	-175.5	-72.4	0	0	113.6	A36 A48 V49 G55 A56 F66 T69	A36-M52 HydrophobicContact CB-CE 4Å; A36-M52 HydrophobicContact CB-CG 3.43Å; A36-M52 VanDerWaalsContact CB-CG 3.43Å; A36-M52 HydrophobicContact CB-SD 3.54Å; A36-M52 VanDerWaalsContact CB-SD 3.54Å; A48-M52 VanDerWaalsContact O-CE 3.25Å; A48-M52 WeakPolarHBondContact O-CE 3.38Å; A48-M52 WeakPolarHBondContact O-CG 3.42Å; A48-M52 PolarHBondContact O-N 3.45Å; V49-M52 PolarHBondContact O-N 3.38Å; V49-M52 VanDerWaalsContact O-N 3.16Å; M52-G55 PolarHBondContact O-N 3.35Å; M52-G55 VanDerWaalsContact O-N 3.1Å; M52-A56 PolarHBondContact O-N 2.92Å; M52-A56 VanDerWaalsContact O-N 3.12Å; M52-F66 HydrophobicContact CB-CB 4.16Å; M52-F66 HydrophobicContact CE-CB 4.46Å; M52-F66 PolarHBondContact SD-N 2.95Å; M52-T69 HydrophobicContact CE-CG2 3.68Å
53	E	90.8	Very high	93.8	Very high	117 Å²	117	48.1 Å²	48.1	55%	0.547	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-53.2	-46.4	-172.4	-179.6	175.7	-151.9	0	0	114.2	V49 G55 A56 F66	V49-E53 WeakPolarHBondContact O-CB 3.38Å; V49-E53 PolarHBondContact O-N 3.2Å; E53-G55 PolarHBondContact O-N 3.14Å; E53-G55 VanDerWaalsContact O-N 3.13Å; E53-A56 WeakPolarHBondContact O-CB 3.37Å; E53-A56 PolarHBondContact O-N 3.39Å; E53-A56 VanDerWaalsContact O-N 3.1Å; E53-F66 HydrophobicContact CB-CE2 4.44Å
54	P	91	Very high	93.9	Very high	98 Å²	98	47.5 Å²	47.5	64%	0.636	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-60.4	-27.5	-179.7	-25.3	35	0	0	0	114.2	A50	A50-P54 WeakPolarHBondContact O-CD 3.48Å
55	G	88.7	Confident	93.9	Very high	10 Å²	10	44.5 Å²	44.5	10%	0.103	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-101.9	-0.9	179.2	0	0	0	0	0	114.2	M52 E53 N57 D58 S59	M52-G55 PolarHBondContact O-N 3.35Å; M52-G55 VanDerWaalsContact O-N 3.1Å; E53-G55 PolarHBondContact O-N 3.14Å; E53-G55 VanDerWaalsContact O-N 3.13Å; G55-N57 PolarHBondContact O-N 3.39Å; G55-D58 PolarHBondContact O-N 2.91Å; G55-S59 WeakPolarHBondContact O-CB 3.45Å; G55-S59 PolarHBondContact O-N 3.41Å
56	A	89.5	Confident	94.1	Very high	7 Å²	7	45.7 Å²	45.7	6%	0.058	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-20.1	-173.4	0	0	0	0	0	113.7	M52 E53 A63 H92	M52-A56 PolarHBondContact O-N 2.92Å; M52-A56 VanDerWaalsContact O-N 3.12Å; E53-A56 WeakPolarHBondContact O-CB 3.37Å; E53-A56 PolarHBondContact O-N 3.39Å; E53-A56 VanDerWaalsContact O-N 3.1Å; A56-A63 WeakPolarHBondContact O-CB 3.47Å; A56-H92 PolarHBondContact O-NE2 2.96Å
57	N	92.8	Very high	94.2	Very high	85 Å²	85	38.7 Å²	38.7	46%	0.455	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-24	178.5	-67.8	-52.2	0	0	0	114	G55 H92 K99	G55-N57 PolarHBondContact O-N 3.39Å; N57-H92 PolarHBondContact OD1-CE1 3.26Å; N57-H92 PolarHBondContact OD1-NE2 3.04Å; N57-K99 PolarHBondContact O-NZ 3.02Å
58	D	91.3	Very high	94.3	Very high	111 Å²	111	34 Å²	34	59%	0.594	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-131.5	2.8	-163.7	-56.5	-54.7	0	0	0	113.5	G55 Y100	G55-D58 PolarHBondContact O-N 2.91Å; D58-Y100 PolarHBondContact O-OH 3.47Å
59	S	94.8	Very high	94.2	Very high	16 Å²	16	34.2 Å²	34.2	11%	0.112	19%	0.19	C	C	.	.			trans	-130.4	121.5	173.2	156.1	0	0	0	0	109.9	S29 G55 Y61 R62 A63	S29-S59 PolarHBondContact OG-OG 2.92Å; G55-S59 WeakPolarHBondContact O-CB 3.45Å; G55-S59 PolarHBondContact O-N 3.41Å; S59-Y61 PolarHBondContact O-N 3.5Å; S59-Y61 PolarHBondContact OG-N 3.44Å; S59-R62 PolarHBondContact O-N 3.01Å; S59-R62 WeakPolarHBondContact OG-CG 3.26Å; S59-R62 PolarHBondContact OG-N 3.3Å; S59-R62 VanDerWaalsContact OG-N 3.08Å; S59-A63 VanDerWaalsContact O-CB 3.22Å; S59-A63 WeakPolarHBondContact O-CB 3.29Å; S59-A63 PolarHBondContact O-N 3.35Å
60	M	95.6	Very high	94.2	Very high	5 Å²	5	32.8 Å²	32.8	3%	0.025	18%	0.182	C	C	.	.	H	α-helix	trans	-57.2	-37.7	178.7	70.1	-178.1	81.9	0	0	112.6	L64 Y100 E126 H129 A130	M60-L64 VanDerWaalsContact O-CB 3.25Å; M60-L64 WeakPolarHBondContact O-CB 3.34Å; M60-L64 PolarHBondContact O-N 3Å; M60-L64 VanDerWaalsContact O-N 3.09Å; M60-Y100 HydrophobicContact CB-CD2 4.36Å; M60-Y100 HydrophobicContact CE-CD1 3.66Å; M60-Y100 HydrophobicContact CE-CD2 4.24Å; M60-Y100 HydrophobicContact CE-CE1 4.44Å; M60-Y100 HydrophobicContact CE-CG 3.57Å; M60-E126 HydrophobicContact CE-CG 3.52Å; M60-H129 HydrophobicContact SD-CB 4.08Å; M60-A130 HydrophobicContact CE-CB 4.12Å; M60-A130 HydrophobicContact SD-CB 3.99Å
61	Y	96.8	Very high	94.2	Very high	1 Å²	1	31.2 Å²	31.2	0%	0.004	17%	0.165	C	C	.	.	H	α-helix	trans	-80.1	-40.6	-176.9	-91.9	-80.4	0	0	0	112.2	L26 S29 I30 T33 S59 L64 G65 H129 L242 R243	L26-Y61 HydrophobicContact CD1-CD2 4.12Å; L26-Y61 HydrophobicContact CD1-CE2 3.81Å; S29-Y61 WeakPolarHBondContact OG-CB 3.39Å; I30-Y61 HydrophobicContact CD1-CE2 3.97Å; I30-Y61 HydrophobicContact CG1-CD1 4.14Å; I30-Y61 HydrophobicContact CG1-CD2 3.7Å; I30-Y61 HydrophobicContact CG1-CE1 3.93Å; I30-Y61 HydrophobicContact CG1-CE2 3.5Å; I30-Y61 HydrophobicContact CG1-CG 4.04Å; T33-Y61 WeakPolarHBondContact CG2-O 3.32Å; T33-Y61 VanDerWaalsContact OG1-C 3.26Å; T33-Y61 WeakPolarHBondContact OG1-CB 3.43Å; T33-Y61 PolarHBondContact OG1-O 2.76Å; S59-Y61 PolarHBondContact O-N 3.5Å; S59-Y61 PolarHBondContact OG-N 3.44Å; Y61-L64 PolarHBondContact O-N 3.45Å; Y61-G65 PolarHBondContact O-N 3.35Å; Y61-H129 HydrophobicContact CE2-CB 4.05Å; Y61-H129 AromaticContact CE2-ND1 3.46Å; Y61-H129 WeakPolarHBondContact CE2-ND1 3.33Å; Y61-H129 AromaticContact CZ-ND1 3.46Å; Y61-H129 PolarHBondContact OH-CE1 3.2Å; Y61-H129 PolarHBondContact OH-ND1 2.92Å; Y61-L242 HydrophobicContact CD1-CD2 3.68Å; Y61-L242 HydrophobicContact CE1-CD2 3.8Å; Y61-R243 VanDerWaalsContact CE1-NH2 3.28Å
62	R	95.9	Very high	94.1	Very high	56 Å²	56	28.7 Å²	28.7	21%	0.211	15%	0.154	C	C	.	.	H	α-helix	trans	-66.5	-39.9	174.6	-68.4	-178.5	178.3	-158.2	5.9	111.3	D32 T33 S59 L64 G65 F66	D32-R62 VanDerWaalsContact CG-NH2 3.33Å; D32-R62 IonicContact OD1-NH2 2.76Å; D32-R62 IonicContact OD2-CZ 3.3Å; D32-R62 IonicContact OD2-NE 3.8Å; D32-R62 PolarHBondContact OD2-NE 3.43Å; D32-R62 IonicContact OD2-NH2 3.91Å; D32-R62 PolarHBondContact OD2-NH2 3.4Å; T33-R62 PolarHBondContact OG1-N 3.27Å; S59-R62 PolarHBondContact O-N 3.01Å; S59-R62 WeakPolarHBondContact OG-CG 3.26Å; S59-R62 PolarHBondContact OG-N 3.3Å; S59-R62 VanDerWaalsContact OG-N 3.08Å; R62-L64 PolarHBondContact O-N 3.08Å; R62-G65 PolarHBondContact O-N 3.45Å; R62-F66 WeakPolarHBondContact O-CB 3.4Å; R62-F66 PolarHBondContact O-N 3.5Å
63	A	97.1	Very high	93.9	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.008	16%	0.161	C	C	.	.	H	α-helix	trans	-59.2	-47.3	173.8	0	0	0	0	0	111.5	A56 S59 A67 A93 V96	A56-A63 WeakPolarHBondContact O-CB 3.47Å; S59-A63 VanDerWaalsContact O-CB 3.22Å; S59-A63 WeakPolarHBondContact O-CB 3.29Å; S59-A63 PolarHBondContact O-N 3.35Å; A63-A67 WeakPolarHBondContact O-CB 3.28Å; A63-A67 PolarHBondContact O-N 3.04Å; A63-A93 HydrophobicContact CB-CB 4.13Å; A63-A93 WeakPolarHBondContact O-CB 3.46Å; A63-V96 HydrophobicContact CB-CB 4.11Å; A63-V96 HydrophobicContact CB-CG1 4.05Å; A63-V96 HydrophobicContact CB-CG2 4.4Å
64	L	97.3	Very high	93.8	Very high	3 Å²	3	24.6 Å²	24.6	2%	0.016	14%	0.135	C	C	.	.	H	α-helix	trans	-67.3	-41.3	177.6	178.4	65.1	0	0	0	112.5	M60 Y61 R62 A67 T68 C133 E136 A137	M60-L64 VanDerWaalsContact O-CB 3.25Å; M60-L64 WeakPolarHBondContact O-CB 3.34Å; M60-L64 PolarHBondContact O-N 3Å; M60-L64 VanDerWaalsContact O-N 3.09Å; Y61-L64 PolarHBondContact O-N 3.45Å; R62-L64 PolarHBondContact O-N 3.08Å; L64-A67 CarbonylContact O-C 3.43Å; L64-A67 PolarHBondContact O-N 3.41Å; L64-T68 VanDerWaalsContact O-CB 3.31Å; L64-T68 WeakPolarHBondContact O-CB 3.33Å; L64-T68 PolarHBondContact O-N 2.89Å; L64-T68 PolarHBondContact O-OG1 3.46Å; L64-C133 HydrophobicContact CD2-CB 3.76Å; L64-C133 VanDerWaalsContact CD2-SG 3.56Å; L64-E136 HydrophobicContact CD1-CB 3.96Å; L64-E136 HydrophobicContact CD2-CB 4.15Å; L64-E136 WeakPolarHBondContact CD2-OE2 3.38Å; L64-A137 HydrophobicContact CD1-CB 4.22Å
65	G	96.4	Very high	93.4	Very high	3 Å²	3	23 Å²	23	3%	0.031	12%	0.121	C	C	.	.	H	α-helix	trans	-59.9	-48.6	176.9	0	0	0	0	0	111.3	Y61 R62 A67 T68 T69	Y61-G65 PolarHBondContact O-N 3.35Å; R62-G65 PolarHBondContact O-N 3.45Å; G65-A67 VanDerWaalsContact C-N 3.32Å; G65-A67 PolarHBondContact O-N 3.11Å; G65-T68 WeakPolarHBondContact O-CB 3.49Å; G65-T68 PolarHBondContact O-N 3.38Å; G65-T69 PolarHBondContact O-N 3.2Å; G65-T69 PolarHBondContact O-OG1 3.02Å
66	F	95.9	Very high	93.1	Very high	36 Å²	36	23.9 Å²	23.9	16%	0.158	12%	0.123	C	C	.	.	H	α-helix	trans	-58.9	-43.5	174.5	177.8	-88.4	0	0	0	111.9	V49 M52 E53 R62 T68 T69 A70 A89	V49-F66 HydrophobicContact CG1-CD2 4.14Å; V49-F66 HydrophobicContact CG1-CE2 3.68Å; M52-F66 HydrophobicContact CB-CB 4.16Å; M52-F66 HydrophobicContact CE-CB 4.46Å; M52-F66 PolarHBondContact SD-N 2.95Å; E53-F66 HydrophobicContact CB-CE2 4.44Å; R62-F66 WeakPolarHBondContact O-CB 3.4Å; R62-F66 PolarHBondContact O-N 3.5Å; F66-T68 VanDerWaalsContact C-N 3.31Å; F66-T68 PolarHBondContact O-N 3.28Å; F66-T69 PolarHBondContact O-OG1 3.29Å; F66-A70 WeakPolarHBondContact O-CB 3.26Å; F66-A70 PolarHBondContact O-N 3.35Å; F66-A89 HydrophobicContact CD1-CB 3.89Å; F66-A89 HydrophobicContact CE1-CB 3.75Å
67	A	96.7	Very high	92.7	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-64.6	-35.9	174.7	0	0	0	0	0	112.7	A63 L64 G65 F71 A89 T90 A93	A63-A67 WeakPolarHBondContact O-CB 3.28Å; A63-A67 PolarHBondContact O-N 3.04Å; L64-A67 CarbonylContact O-C 3.43Å; L64-A67 PolarHBondContact O-N 3.41Å; G65-A67 VanDerWaalsContact C-N 3.32Å; G65-A67 PolarHBondContact O-N 3.11Å; A67-F71 WeakPolarHBondContact O-CB 3.46Å; A67-F71 PolarHBondContact O-N 3.22Å; A67-A89 HydrophobicContact CB-CB 4.17Å; A67-T90 HydrophobicContact CB-CG2 3.84Å; A67-A93 HydrophobicContact CB-CB 3.78Å
68	T	96.3	Very high	91.7	Very high	7 Å²	7	22.9 Å²	22.9	4%	0.043	12%	0.12	C	C	.	.	H	α-helix	trans	-70.8	-41.5	-179.1	-58.2	0	0	0	0	111.6	L64 G65 F66 F71 I72 Q140 L246	L64-T68 VanDerWaalsContact O-CB 3.31Å; L64-T68 WeakPolarHBondContact O-CB 3.33Å; L64-T68 PolarHBondContact O-N 2.89Å; L64-T68 PolarHBondContact O-OG1 3.46Å; G65-T68 WeakPolarHBondContact O-CB 3.49Å; G65-T68 PolarHBondContact O-N 3.38Å; F66-T68 VanDerWaalsContact C-N 3.31Å; F66-T68 PolarHBondContact O-N 3.28Å; T68-F71 WeakPolarHBondContact O-CB 3.4Å; T68-F71 PolarHBondContact O-N 3.13Å; T68-I72 HydrophobicContact CG2-CD1 4.08Å; T68-I72 VanDerWaalsContact O-CG1 3.3Å; T68-I72 WeakPolarHBondContact O-CG1 3.48Å; T68-I72 PolarHBondContact O-N 3.09Å; T68-Q140 PolarHBondContact OG1-NE2 3.22Å; T68-L246 HydrophobicContact CG2-CD1 4Å; T68-L246 HydrophobicContact CG2-CD2 4.16Å
69	T	94.3	Very high	91.1	Very high	5 Å²	5	20.1 Å²	20.1	3%	0.031	11%	0.106	C	C	.	.	H	α-helix	trans	-65.9	-43.1	175.7	56.8	0	0	0	0	111.2	M37 F40 M52 G65 F66 F71 I72 Q73	M37-T69 HydrophobicContact SD-CG2 4.08Å; F40-T69 HydrophobicContact CB-CG2 4.29Å; F40-T69 HydrophobicContact CD2-CG2 3.47Å; F40-T69 VanDerWaalsContact CD2-CG2 3.47Å; F40-T69 HydrophobicContact CE2-CG2 3.97Å; F40-T69 HydrophobicContact CG-CG2 3.96Å; M52-T69 HydrophobicContact CE-CG2 3.68Å; G65-T69 PolarHBondContact O-N 3.2Å; G65-T69 PolarHBondContact O-OG1 3.02Å; F66-T69 PolarHBondContact O-OG1 3.29Å; T69-F71 VanDerWaalsContact C-N 3.32Å; T69-F71 PolarHBondContact O-N 3.41Å; T69-I72 PolarHBondContact O-N 3.15Å; T69-Q73 WeakPolarHBondContact O-CB 3.44Å; T69-Q73 PolarHBondContact O-N 3.07Å
70	A	94	Very high	90.4	Very high	3 Å²	3	25.8 Å²	25.8	3%	0.025	14%	0.135	C	C	.	.	H	α-helix	trans	-61.7	-40.2	172.7	0	0	0	0	0	111.9	F66 Q73 A74 A86 A89	F66-A70 WeakPolarHBondContact O-CB 3.26Å; F66-A70 PolarHBondContact O-N 3.35Å; A70-Q73 PolarHBondContact O-N 3.42Å; A70-A74 WeakPolarHBondContact O-CB 3.17Å; A70-A74 PolarHBondContact O-N 3.32Å; A70-A86 HydrophobicContact CB-CB 4.18Å; A70-A86 WeakPolarHBondContact O-CB 3.42Å; A70-A89 HydrophobicContact CB-CB 4.23Å
71	F	94.1	Very high	90	Very high	24 Å²	24	31.4 Å²	31.4	11%	0.105	16%	0.161	C	C	.	.	H	α-helix	trans	-61.4	-48.1	175.3	167.3	-102.8	0	0	0	112.3	A67 T68 T69 Q73 A74 L75 Q140 L143 L144	A67-F71 WeakPolarHBondContact O-CB 3.46Å; A67-F71 PolarHBondContact O-N 3.22Å; T68-F71 WeakPolarHBondContact O-CB 3.4Å; T68-F71 PolarHBondContact O-N 3.13Å; T69-F71 VanDerWaalsContact C-N 3.32Å; T69-F71 PolarHBondContact O-N 3.41Å; F71-Q73 VanDerWaalsContact C-N 3.35Å; F71-A74 PolarHBondContact O-N 3.41Å; F71-L75 HydrophobicContact CD1-CD1 4.4Å; F71-L75 HydrophobicContact CD2-CG 4.33Å; F71-L75 HydrophobicContact CE1-CD1 3.64Å; F71-L75 HydrophobicContact CE1-CG 4.35Å; F71-L75 HydrophobicContact CE2-CD1 3.79Å; F71-L75 HydrophobicContact CE2-CD2 4.15Å; F71-L75 HydrophobicContact CE2-CG 3.92Å; F71-L75 HydrophobicContact CZ-CD1 3.3Å; F71-L75 HydrophobicContact CZ-CD2 4.47Å; F71-L75 HydrophobicContact CZ-CG 3.95Å; F71-L75 WeakPolarHBondContact O-CG 3.38Å; F71-L75 PolarHBondContact O-N 3.18Å; F71-Q140 HydrophobicContact CB-CB 4.5Å; F71-Q140 HydrophobicContact CB-CG 4.48Å; F71-Q140 HydrophobicContact CD1-CG 3.96Å; F71-Q140 HydrophobicContact CD2-CB 3.79Å; F71-Q140 HydrophobicContact CD2-CG 4.12Å; F71-Q140 HydrophobicContact CE1-CG 4.16Å; F71-Q140 HydrophobicContact CE2-CB 4.08Å; F71-Q140 HydrophobicContact CE2-CG 4.32Å; F71-Q140 HydrophobicContact CG-CB 4.03Å; F71-Q140 HydrophobicContact CG-CG 3.92Å; F71-Q140 HydrophobicContact CZ-CG 4.32Å; F71-L143 HydrophobicContact CE2-CB 3.82Å; F71-L143 HydrophobicContact CE2-CD1 4.34Å; F71-L143 HydrophobicContact CZ-CB 4.1Å; F71-L143 HydrophobicContact CZ-CD1 3.78Å; F71-L144 HydrophobicContact CD2-CD1 3.97Å; F71-L144 HydrophobicContact CD2-CD2 3.91Å; F71-L144 HydrophobicContact CD2-CG 3.69Å; F71-L144 HydrophobicContact CE2-CD2 4.39Å; F71-L144 HydrophobicContact CE2-CG 4.07Å
72	I	92.1	Very high	89.5	Confident	15 Å²	15	31.9 Å²	31.9	8%	0.077	16%	0.163	C	C	.	.	H	α-helix	trans	-62.2	-45.8	177.2	-64.5	164.2	0	0	0	109.6	F40 T68 T69 A74 L75 M76 L246	F40-I72 HydrophobicContact CE1-CD1 3.94Å; F40-I72 HydrophobicContact CE1-CG2 4.19Å; F40-I72 HydrophobicContact CZ-CB 3.92Å; F40-I72 HydrophobicContact CZ-CD1 4.02Å; F40-I72 HydrophobicContact CZ-CG2 3.68Å; T68-I72 HydrophobicContact CG2-CD1 4.08Å; T68-I72 VanDerWaalsContact O-CG1 3.3Å; T68-I72 WeakPolarHBondContact O-CG1 3.48Å; T68-I72 PolarHBondContact O-N 3.09Å; T69-I72 PolarHBondContact O-N 3.15Å; I72-A74 VanDerWaalsContact C-N 3.35Å; I72-A74 PolarHBondContact O-N 3.41Å; I72-L75 PolarHBondContact O-N 3.38Å; I72-M76 HydrophobicContact CG2-CG 4.04Å; I72-M76 WeakPolarHBondContact O-CB 3.23Å; I72-M76 WeakPolarHBondContact O-CG 3.23Å; I72-M76 PolarHBondContact O-N 3.42Å; I72-L246 HydrophobicContact CD1-CD2 3.85Å
73	Q	89.8	Confident	89.1	Confident	30 Å²	30	29.4 Å²	29.4	14%	0.14	16%	0.155	C	C	.	.	H	α-helix	trans	-54.3	-51.1	175.4	-173.6	-179.9	4.4	0	0	110.9	T69 A70 F71 L75 M76 T77 D82 W320	T69-Q73 WeakPolarHBondContact O-CB 3.44Å; T69-Q73 PolarHBondContact O-N 3.07Å; A70-Q73 PolarHBondContact O-N 3.42Å; F71-Q73 VanDerWaalsContact C-N 3.35Å; Q73-L75 VanDerWaalsContact C-N 3.34Å; Q73-L75 PolarHBondContact O-N 3.34Å; Q73-M76 PolarHBondContact O-N 3.29Å; Q73-M76 VanDerWaalsContact O-N 3.14Å; Q73-T77 HydrophobicContact CG-CG2 4.05Å; Q73-T77 WeakPolarHBondContact O-CB 3.37Å; Q73-T77 WeakPolarHBondContact O-CG2 3.27Å; Q73-T77 PolarHBondContact O-N 3.41Å; Q73-T77 PolarHBondContact O-OG1 3.42Å; Q73-T77 VanDerWaalsContact O-OG1 3.06Å; Q73-D82 HydrophobicContact CG-CB 4.41Å; Q73-W320 HydrophobicContact CB-CH2 3.74Å; Q73-W320 HydrophobicContact CB-CZ2 3.66Å; Q73-W320 HydrophobicContact CB-CZ3 4.45Å; Q73-W320 HydrophobicContact CG-CD2 4.31Å; Q73-W320 HydrophobicContact CG-CH2 4.14Å; Q73-W320 HydrophobicContact CG-CZ2 3.72Å
74	A	88.7	Confident	88.8	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-59	-40.9	179.1	0	0	0	0	0	113.6	A70 F71 I72 C78 D82 V83 A86 L144	A70-A74 WeakPolarHBondContact O-CB 3.17Å; A70-A74 PolarHBondContact O-N 3.32Å; F71-A74 PolarHBondContact O-N 3.41Å; I72-A74 VanDerWaalsContact C-N 3.35Å; I72-A74 PolarHBondContact O-N 3.41Å; A74-C78 WeakPolarHBondContact O-CA 3.48Å; A74-C78 PolarHBondContact O-N 3.36Å; A74-D82 HydrophobicContact CB-CB 4.37Å; A74-V83 HydrophobicContact CB-CG2 4.04Å; A74-A86 HydrophobicContact CB-CB 3.67Å; A74-L144 HydrophobicContact CB-CD2 3.74Å
75	L	84.4	Confident	88.6	Confident	66 Å²	66	38.2 Å²	38.2	35%	0.346	19%	0.194	S	C	.	.	H	α-helix	trans	-68.7	-34.8	176.8	-70.1	-166.1	0	0	0	112.8	F71 I72 Q73 C78 V147	F71-L75 HydrophobicContact CD1-CD1 4.4Å; F71-L75 HydrophobicContact CD2-CG 4.33Å; F71-L75 HydrophobicContact CE1-CD1 3.64Å; F71-L75 HydrophobicContact CE1-CG 4.35Å; F71-L75 HydrophobicContact CE2-CD1 3.79Å; F71-L75 HydrophobicContact CE2-CD2 4.15Å; F71-L75 HydrophobicContact CE2-CG 3.92Å; F71-L75 HydrophobicContact CZ-CD1 3.3Å; F71-L75 HydrophobicContact CZ-CD2 4.47Å; F71-L75 HydrophobicContact CZ-CG 3.95Å; F71-L75 WeakPolarHBondContact O-CG 3.38Å; F71-L75 PolarHBondContact O-N 3.18Å; I72-L75 PolarHBondContact O-N 3.38Å; Q73-L75 VanDerWaalsContact C-N 3.34Å; Q73-L75 PolarHBondContact O-N 3.34Å; L75-C78 PolarHBondContact O-SG 2.97Å; L75-V147 HydrophobicContact CD2-CG2 3.58Å
76	M	81.6	Confident	88.5	Confident	28 Å²	28	38.1 Å²	38.1	14%	0.138	19%	0.193	C	C	.	.	H	α-helix	trans	-81.9	-36.9	-177.6	-66.5	-55.8	-69.2	0	0	112.1	I72 Q73 L288 F323 L326	I72-M76 HydrophobicContact CG2-CG 4.04Å; I72-M76 WeakPolarHBondContact O-CB 3.23Å; I72-M76 WeakPolarHBondContact O-CG 3.23Å; I72-M76 PolarHBondContact O-N 3.42Å; Q73-M76 PolarHBondContact O-N 3.29Å; Q73-M76 VanDerWaalsContact O-N 3.14Å; M76-L288 HydrophobicContact CE-CD1 3.62Å; M76-L288 HydrophobicContact SD-CD1 4.23Å; M76-F323 HydrophobicContact CE-CD2 3.63Å; M76-F323 HydrophobicContact CE-CE2 3.53Å; M76-L326 HydrophobicContact CE-CD1 3.4Å; M76-L326 WeakPolarHBondContact O-CD1 3.32Å; M76-L326 HydrophobicContact SD-CD1 4.35Å
77	T	80.1	Confident	88.3	Confident	12 Å²	12	37.9 Å²	37.9	7%	0.074	19%	0.193	C	C	.	.	H	α-helix	trans	-88.8	-25.3	-178.8	69.4	0	0	0	0	112.9	Q73 N79 D82 Q322	Q73-T77 HydrophobicContact CG-CG2 4.05Å; Q73-T77 WeakPolarHBondContact O-CB 3.37Å; Q73-T77 WeakPolarHBondContact O-CG2 3.27Å; Q73-T77 PolarHBondContact O-N 3.41Å; Q73-T77 PolarHBondContact O-OG1 3.42Å; Q73-T77 VanDerWaalsContact O-OG1 3.06Å; T77-N79 PolarHBondContact O-N 3.42Å; T77-N79 PolarHBondContact OG1-N 3.13Å; T77-D82 WeakPolarHBondContact CB-OD2 3.4Å; T77-D82 PolarHBondContact OG1-OD2 3.03Å; T77-Q322 HydrophobicContact CG2-CB 3.94Å
78	C	72.3	Confident	88.2	Confident	58 Å²	58	42.4 Å²	42.4	39%	0.392	22%	0.217	S	C	.	.			trans	47.6	30.2	-171	-69.4	0	0	0	0	112.8	A74 L75	A74-C78 WeakPolarHBondContact O-CA 3.48Å; A74-C78 PolarHBondContact O-N 3.36Å; L75-C78 PolarHBondContact O-SG 2.97Å
79	N	78.9	Confident	88.2	Confident	53 Å²	53	42.4 Å²	42.4	28%	0.283	22%	0.218	S	C	.	.			trans	-88.9	131.4	-179.3	-175.7	-40.1	0	0	0	109.8	T77 H81 D82 V83	T77-N79 PolarHBondContact O-N 3.42Å; T77-N79 PolarHBondContact OG1-N 3.13Å; N79-H81 PolarHBondContact O-N 2.77Å; N79-H81 WeakPolarHBondContact OD1-CB 3.42Å; N79-H81 PolarHBondContact OD1-N 3.43Å; N79-D82 HydrophobicContact CB-CB 4.2Å; N79-D82 WeakPolarHBondContact CB-OD2 3.39Å; N79-D82 PolarHBondContact O-N 3.5Å; N79-V83 WeakPolarHBondContact O-CG2 3.4Å; N79-V83 PolarHBondContact O-N 3.45Å
80	D	81	Confident	88.3	Confident	135 Å²	135	42.1 Å²	42.1	72%	0.722	22%	0.216	S	C	*	.	H	α-helix	trans	-52.3	-40	-180	-65.4	-29	0	0	0	112.9	E84	D80-E84 WeakPolarHBondContact O-CB 3.26Å; D80-E84 PolarHBondContact O-N 2.84Å
81	H	86.2	Confident	88.3	Confident	123 Å²	123	47 Å²	47	57%	0.569	24%	0.236	S	C	*	.	H	α-helix	trans	-64.9	-44.3	177.4	172.7	-88.7	0	0	0	112	N79 E84 K85	N79-H81 PolarHBondContact O-N 2.77Å; N79-H81 WeakPolarHBondContact OD1-CB 3.42Å; N79-H81 PolarHBondContact OD1-N 3.43Å; H81-E84 PolarHBondContact O-N 3.35Å; H81-K85 WeakPolarHBondContact O-CB 3.38Å; H81-K85 PolarHBondContact O-N 3.26Å
82	D	87.5	Confident	88.4	Confident	12 Å²	12	48.9 Å²	48.9	6%	0.064	25%	0.245	C	C	.	.	H	α-helix	trans	-70.8	-37.4	-179	-61.7	-22.2	0	0	0	110.7	Q73 A74 T77 N79 K85 A86	Q73-D82 HydrophobicContact CG-CB 4.41Å; A74-D82 HydrophobicContact CB-CB 4.37Å; T77-D82 WeakPolarHBondContact CB-OD2 3.4Å; T77-D82 PolarHBondContact OG1-OD2 3.03Å; N79-D82 HydrophobicContact CB-CB 4.2Å; N79-D82 WeakPolarHBondContact CB-OD2 3.39Å; N79-D82 PolarHBondContact O-N 3.5Å; D82-K85 PolarHBondContact O-N 2.91Å; D82-A86 VanDerWaalsContact O-CB 3.3Å; D82-A86 WeakPolarHBondContact O-CB 3.23Å; D82-A86 PolarHBondContact O-N 3.11Å
83	V	87.3	Confident	88.7	Confident	4 Å²	4	48.1 Å²	48.1	2%	0.024	24%	0.242	C	C	.	.	H	α-helix	trans	-61.7	-44.5	173.1	173.7	0	0	0	0	110.9	A74 N79 A86 M87 V147 Q148	A74-V83 HydrophobicContact CB-CG2 4.04Å; N79-V83 WeakPolarHBondContact O-CG2 3.4Å; N79-V83 PolarHBondContact O-N 3.45Å; V83-A86 PolarHBondContact O-N 2.87Å; V83-M87 HydrophobicContact CG1-CG 4.49Å; V83-M87 WeakPolarHBondContact O-CB 3.3Å; V83-M87 VanDerWaalsContact O-CG 3.22Å; V83-M87 WeakPolarHBondContact O-CG 3.32Å; V83-M87 PolarHBondContact O-N 2.67Å; V83-V147 HydrophobicContact CG2-CG1 3.94Å; V83-Q148 HydrophobicContact CG1-CB 3.93Å; V83-Q148 HydrophobicContact CG1-CG 4.14Å
84	E	90.3	Very high	88.9	Confident	115 Å²	115	46.8 Å²	46.8	54%	0.537	24%	0.235	S	C	.	.	H	α-helix	trans	-64.1	-45.5	176.1	-174.8	174.4	-173.1	0	0	111.8	D80 H81 A86 M87 N88	D80-E84 WeakPolarHBondContact O-CB 3.26Å; D80-E84 PolarHBondContact O-N 2.84Å; H81-E84 PolarHBondContact O-N 3.35Å; E84-A86 VanDerWaalsContact C-N 3.34Å; E84-A86 PolarHBondContact O-N 3.46Å; E84-M87 PolarHBondContact O-N 2.89Å; E84-N88 PolarHBondContact O-N 2.93Å; E84-N88 PolarHBondContact O-ND2 3.21Å
85	K	93.1	Very high	89.3	Confident	74 Å²	74	50.9 Å²	50.9	32%	0.322	26%	0.257	S	S	.	.	H	α-helix	trans	-56	-48.1	174.3	-178.3	-176.8	176	-173.1	0	111	H81 D82 M87 N88 A89	H81-K85 WeakPolarHBondContact O-CB 3.38Å; H81-K85 PolarHBondContact O-N 3.26Å; D82-K85 PolarHBondContact O-N 2.91Å; K85-M87 PolarHBondContact O-N 3.19Å; K85-N88 PolarHBondContact O-N 3.33Å; K85-A89 WeakPolarHBondContact O-CB 3.23Å; K85-A89 PolarHBondContact O-N 3.4Å
86	A	94.3	Very high	89.8	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64.5	-39.5	178.6	0	0	0	0	0	112.4	A70 A74 D82 V83 E84 N88 A89 T90 L144	A70-A86 HydrophobicContact CB-CB 4.18Å; A70-A86 WeakPolarHBondContact O-CB 3.42Å; A74-A86 HydrophobicContact CB-CB 3.67Å; D82-A86 VanDerWaalsContact O-CB 3.3Å; D82-A86 WeakPolarHBondContact O-CB 3.23Å; D82-A86 PolarHBondContact O-N 3.11Å; V83-A86 PolarHBondContact O-N 2.87Å; E84-A86 VanDerWaalsContact C-N 3.34Å; E84-A86 PolarHBondContact O-N 3.46Å; A86-N88 VanDerWaalsContact C-N 3.34Å; A86-N88 PolarHBondContact O-N 3.07Å; A86-A89 PolarHBondContact O-N 3.14Å; A86-T90 WeakPolarHBondContact O-CB 3.5Å; A86-T90 WeakPolarHBondContact O-CG2 3.47Å; A86-T90 PolarHBondContact O-N 2.89Å; A86-T90 PolarHBondContact O-OG1 3.46Å; A86-L144 HydrophobicContact CB-CD1 3.62Å; A86-L144 HydrophobicContact CB-CD2 3.92Å; A86-L144 HydrophobicContact CB-CG 4.44Å
87	M	91.7	Very high	90.5	Very high	31 Å²	31	46.4 Å²	46.4	15%	0.153	24%	0.235	C	C	.	.	H	α-helix	trans	-63	-39.7	176.1	-78.7	-70.6	-76.2	0	0	112.3	V83 E84 K85 T90 K91 L144	V83-M87 HydrophobicContact CG1-CG 4.49Å; V83-M87 WeakPolarHBondContact O-CB 3.3Å; V83-M87 VanDerWaalsContact O-CG 3.22Å; V83-M87 WeakPolarHBondContact O-CG 3.32Å; V83-M87 PolarHBondContact O-N 2.67Å; E84-M87 PolarHBondContact O-N 2.89Å; K85-M87 PolarHBondContact O-N 3.19Å; M87-T90 PolarHBondContact O-OG1 3.23Å; M87-K91 WeakPolarHBondContact O-CB 3.49Å; M87-K91 PolarHBondContact O-N 3.4Å; M87-K91 VanDerWaalsContact O-N 3.16Å; M87-L144 HydrophobicContact CG-CB 3.97Å; M87-L144 HydrophobicContact CG-CD1 4.09Å; M87-L144 HydrophobicContact SD-CB 3.42Å; M87-L144 WeakPolarHBondContact SD-CB 3.42Å; M87-L144 HydrophobicContact SD-CD1 3.98Å; M87-L144 HydrophobicContact SD-CG 4.35Å
88	N	95.2	Very high	91.1	Very high	95 Å²	95	49.8 Å²	49.8	51%	0.508	25%	0.249	S	C	.	.	H	α-helix	trans	-70	-46.7	175.6	-71.9	-29.9	0	0	0	111.5	E84 K85 A86 T90 K91 H92	E84-N88 PolarHBondContact O-N 2.93Å; E84-N88 PolarHBondContact O-ND2 3.21Å; K85-N88 PolarHBondContact O-N 3.33Å; A86-N88 VanDerWaalsContact C-N 3.34Å; A86-N88 PolarHBondContact O-N 3.07Å; N88-T90 PolarHBondContact O-N 3.02Å; N88-K91 PolarHBondContact O-N 2.92Å; N88-H92 WeakPolarHBondContact O-CB 3.4Å; N88-H92 PolarHBondContact O-N 3.42Å
89	A	96.2	Very high	92.2	Very high	7 Å²	7	53.5 Å²	53.5	6%	0.058	26%	0.259	C	S	.	.	H	α-helix	trans	-61.1	-46.3	179.6	0	0	0	0	0	112.1	F66 A67 A70 K85 A86 K91 H92 A93	F66-A89 HydrophobicContact CD1-CB 3.89Å; F66-A89 HydrophobicContact CE1-CB 3.75Å; A67-A89 HydrophobicContact CB-CB 4.17Å; A70-A89 HydrophobicContact CB-CB 4.23Å; K85-A89 WeakPolarHBondContact O-CB 3.23Å; K85-A89 PolarHBondContact O-N 3.4Å; A86-A89 PolarHBondContact O-N 3.14Å; A89-K91 PolarHBondContact O-N 2.94Å; A89-H92 PolarHBondContact O-N 3.34Å; A89-A93 WeakPolarHBondContact O-CB 3.46Å; A89-A93 PolarHBondContact O-N 3.18Å
90	T	95.5	Very high	92.8	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68.9	-32.9	178.6	54.7	0	0	0	0	112.7	A67 A86 M87 N88 S94 Q140 R141 L144	A67-T90 HydrophobicContact CB-CG2 3.84Å; A86-T90 WeakPolarHBondContact O-CB 3.5Å; A86-T90 WeakPolarHBondContact O-CG2 3.47Å; A86-T90 PolarHBondContact O-N 2.89Å; A86-T90 PolarHBondContact O-OG1 3.46Å; M87-T90 PolarHBondContact O-OG1 3.23Å; N88-T90 PolarHBondContact O-N 3.02Å; T90-S94 PolarHBondContact O-N 3.3Å; T90-S94 VanDerWaalsContact O-N 3.09Å; T90-S94 PolarHBondContact O-OG 3.49Å; T90-Q140 HydrophobicContact CG2-CB 3.77Å; T90-R141 VanDerWaalsContact CB-CG 3.4Å; T90-R141 HydrophobicContact CG2-CG 4.43Å; T90-R141 WeakPolarHBondContact OG1-CG 3.43Å; T90-L144 HydrophobicContact CG2-CD1 4.13Å
91	K	95.1	Very high	93.4	Very high	104 Å²	104	49.1 Å²	49.1	45%	0.452	23%	0.229	S	C	.	.	H	α-helix	trans	-63.2	-50.2	169.9	178.7	-177.3	175.6	-166.9	0	110.9	M87 N88 A89 A93 S94 D95	M87-K91 WeakPolarHBondContact O-CB 3.49Å; M87-K91 PolarHBondContact O-N 3.4Å; M87-K91 VanDerWaalsContact O-N 3.16Å; N88-K91 PolarHBondContact O-N 2.92Å; A89-K91 PolarHBondContact O-N 2.94Å; K91-A93 VanDerWaalsContact C-N 3.33Å; K91-A93 PolarHBondContact O-N 3.43Å; K91-S94 PolarHBondContact O-N 2.98Å; K91-S94 VanDerWaalsContact O-N 3.17Å; K91-S94 PolarHBondContact O-OG 3.32Å; K91-D95 PolarHBondContact O-N 3.36Å
92	H	96.5	Very high	93.4	Very high	64 Å²	64	46 Å²	46	30%	0.296	21%	0.214	S	C	.	.	H	α-helix	trans	-58.1	-45.8	178	179.1	74.9	0	0	0	111.5	A56 N57 N88 A89 S94 D95 V96	A56-H92 PolarHBondContact O-NE2 2.96Å; N57-H92 PolarHBondContact OD1-CE1 3.26Å; N57-H92 PolarHBondContact OD1-NE2 3.04Å; N88-H92 WeakPolarHBondContact O-CB 3.4Å; N88-H92 PolarHBondContact O-N 3.42Å; A89-H92 PolarHBondContact O-N 3.34Å; H92-S94 VanDerWaalsContact C-N 3.32Å; H92-S94 PolarHBondContact O-N 2.92Å; H92-D95 WeakPolarHBondContact O-CB 3.41Å; H92-D95 PolarHBondContact O-N 2.86Å; H92-V96 WeakPolarHBondContact O-CG2 3.38Å; H92-V96 PolarHBondContact O-N 3.02Å
93	A	97.2	Very high	93	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-57.5	-42.9	175.8	0	0	0	0	0	112.4	A63 A67 A89 K91 D95 V96 C97 A137	A63-A93 HydrophobicContact CB-CB 4.13Å; A63-A93 WeakPolarHBondContact O-CB 3.46Å; A67-A93 HydrophobicContact CB-CB 3.78Å; A89-A93 WeakPolarHBondContact O-CB 3.46Å; A89-A93 PolarHBondContact O-N 3.18Å; K91-A93 VanDerWaalsContact C-N 3.33Å; K91-A93 PolarHBondContact O-N 3.43Å; A93-D95 VanDerWaalsContact C-N 3.33Å; A93-D95 PolarHBondContact O-N 3.43Å; A93-V96 PolarHBondContact O-N 3Å; A93-C97 WeakPolarHBondContact O-CB 3.25Å; A93-C97 PolarHBondContact O-N 3.41Å; A93-C97 PolarHBondContact O-SG 3.27Å; A93-A137 HydrophobicContact CB-CB 4.28Å
94	S	94.9	Very high	92.1	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.007	27%	0.269	C	S	.	.	H	α-helix	trans	-64	-37.3	174.9	61	0	0	0	0	112.9	T90 K91 H92 C97 E98 Y134 R141	T90-S94 PolarHBondContact O-N 3.3Å; T90-S94 VanDerWaalsContact O-N 3.09Å; T90-S94 PolarHBondContact O-OG 3.49Å; K91-S94 PolarHBondContact O-N 2.98Å; K91-S94 VanDerWaalsContact O-N 3.17Å; K91-S94 PolarHBondContact O-OG 3.32Å; H92-S94 VanDerWaalsContact C-N 3.32Å; H92-S94 PolarHBondContact O-N 2.92Å; S94-C97 PolarHBondContact O-N 3.44Å; S94-E98 PolarHBondContact O-N 3.02Å; S94-Y134 WeakPolarHBondContact O-CD2 3.43Å; S94-R141 PolarHBondContact OG-NH1 3.33Å
95	D	95.8	Very high	90.6	Very high	86 Å²	86	55.3 Å²	55.3	46%	0.46	27%	0.272	S	S	.	.	H	α-helix	trans	-69.3	-36.8	178.3	-63	-21.3	0	0	0	111.4	K91 H92 A93	K91-D95 PolarHBondContact O-N 3.36Å; H92-D95 WeakPolarHBondContact O-CB 3.41Å; H92-D95 PolarHBondContact O-N 2.86Å; A93-D95 VanDerWaalsContact C-N 3.33Å; A93-D95 PolarHBondContact O-N 3.43Å
96	V	96.1	Very high	88.6	Confident	1 Å²	1	58 Å²	58	1%	0.006	29%	0.289	C	S	.	.	H	α-helix	trans	-67.1	-47.7	173.5	173.8	0	0	0	0	110.8	A63 H92 A93 E98 K99 Y100	A63-V96 HydrophobicContact CB-CB 4.11Å; A63-V96 HydrophobicContact CB-CG1 4.05Å; A63-V96 HydrophobicContact CB-CG2 4.4Å; H92-V96 WeakPolarHBondContact O-CG2 3.38Å; H92-V96 PolarHBondContact O-N 3.02Å; A93-V96 PolarHBondContact O-N 3Å; V96-E98 VanDerWaalsContact C-N 3.25Å; V96-E98 PolarHBondContact O-N 2.92Å; V96-K99 WeakPolarHBondContact O-CB 3.42Å; V96-K99 PolarHBondContact O-N 3.23Å; V96-K99 VanDerWaalsContact O-N 3.14Å; V96-Y100 HydrophobicContact CG1-CE2 4.21Å; V96-Y100 VanDerWaalsContact O-CD2 3.29Å; V96-Y100 WeakPolarHBondContact O-CD2 3.45Å
97	C	95.7	Very high	86.4	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-59.4	-36.8	178.4	-65.5	0	0	0	0	112	A93 S94 K99 Y100 R101 C133 Y134	A93-C97 WeakPolarHBondContact O-CB 3.25Å; A93-C97 PolarHBondContact O-N 3.41Å; A93-C97 PolarHBondContact O-SG 3.27Å; S94-C97 PolarHBondContact O-N 3.44Å; C97-K99 PolarHBondContact O-N 3.45Å; C97-Y100 PolarHBondContact O-N 3.33Å; C97-R101 WeakPolarHBondContact O-CG 3.4Å; C97-R101 PolarHBondContact O-N 3.39Å; C97-C133 WeakPolarHBondContact SG-CB 3.35Å; C97-Y134 HydrophobicContact CB-CD2 4.37Å
98	E	93.4	Very high	84.3	Confident	82 Å²	82	61.9 Å²	61.9	38%	0.383	33%	0.329	S	S	.	.	H	α-helix	trans	-56	-32.6	178.2	-164.5	69.5	-164.1	0	0	112.9	S94 V96 Y100 R101 Y134	S94-E98 PolarHBondContact O-N 3.02Å; V96-E98 VanDerWaalsContact C-N 3.25Å; V96-E98 PolarHBondContact O-N 2.92Å; E98-Y100 PolarHBondContact O-N 2.96Å; E98-R101 VanDerWaalsContact CD-NH1 3.34Å; E98-R101 PolarHBondContact O-N 2.95Å; E98-R101 IonicContact OE1-NH1 3.16Å; E98-R101 PolarHBondContact OE1-NH1 3.42Å; E98-R101 WeakPolarHBondContact OE2-CD 3.41Å; E98-R101 IonicContact OE2-CZ 2.9Å; E98-R101 IonicContact OE2-NE 2.7Å; E98-R101 IonicContact OE2-NH1 3.39Å; E98-R101 PolarHBondContact OE2-NH1 2.95Å; E98-Y134 WeakPolarHBondContact OE2-CE2 3.46Å
99	K	94	Very high	82	Confident	136 Å²	136	66.3 Å²	66.3	59%	0.591	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-27.6	179.1	-57.2	174.7	-173.2	171.2	0	113.3	N57 V96 C97	N57-K99 PolarHBondContact O-NZ 3.02Å; V96-K99 WeakPolarHBondContact O-CB 3.42Å; V96-K99 PolarHBondContact O-N 3.23Å; V96-K99 VanDerWaalsContact O-N 3.14Å; C97-K99 PolarHBondContact O-N 3.45Å
100	Y	93	Very high	79.9	Confident	63 Å²	63	71.8 Å²	71.8	25%	0.247	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-11.8	-177.3	-60.9	-94.5	0	0	0	112.6	D58 M60 V96 C97 E98 E126 Q127	D58-Y100 PolarHBondContact O-OH 3.47Å; M60-Y100 HydrophobicContact CB-CD2 4.36Å; M60-Y100 HydrophobicContact CE-CD1 3.66Å; M60-Y100 HydrophobicContact CE-CD2 4.24Å; M60-Y100 HydrophobicContact CE-CE1 4.44Å; M60-Y100 HydrophobicContact CE-CG 3.57Å; V96-Y100 HydrophobicContact CG1-CE2 4.21Å; V96-Y100 VanDerWaalsContact O-CD2 3.29Å; V96-Y100 WeakPolarHBondContact O-CD2 3.45Å; C97-Y100 PolarHBondContact O-N 3.33Å; E98-Y100 PolarHBondContact O-N 2.96Å; Y100-E126 HydrophobicContact CD1-CG 4.38Å; Y100-Q127 WeakPolarHBondContact O-CG 3.49Å
101	R	92.2	Very high	77.7	Confident	34 Å²	34	75.6 Å²	75.6	13%	0.128	40%	0.397	C	S	.	.	S	Bend	trans	-69.2	153.5	176.4	-69.6	174.5	73.6	-149.2	-2.8	110.1	C97 E98 P103 A130 E131	C97-R101 WeakPolarHBondContact O-CG 3.4Å; C97-R101 PolarHBondContact O-N 3.39Å; E98-R101 VanDerWaalsContact CD-NH1 3.34Å; E98-R101 PolarHBondContact O-N 2.95Å; E98-R101 IonicContact OE1-NH1 3.16Å; E98-R101 PolarHBondContact OE1-NH1 3.42Å; E98-R101 WeakPolarHBondContact OE2-CD 3.41Å; E98-R101 IonicContact OE2-CZ 2.9Å; E98-R101 IonicContact OE2-NE 2.7Å; E98-R101 IonicContact OE2-NH1 3.39Å; E98-R101 PolarHBondContact OE2-NH1 2.95Å; R101-P103 WeakPolarHBondContact O-CD 3.44Å; R101-A130 HydrophobicContact CG-CB 3.87Å; R101-E131 HydrophobicContact CG-CG 4.43Å; R101-E131 IonicContact CZ-OE1 3.45Å; R101-E131 IonicContact CZ-OE2 2.62Å; R101-E131 IonicContact NE-OE1 3.37Å; R101-E131 PolarHBondContact NE-OE1 3.24Å; R101-E131 IonicContact NE-OE2 3.61Å; R101-E131 PolarHBondContact NE-OE2 2.93Å; R101-E131 IonicContact NH2-OE1 3.03Å; R101-E131 PolarHBondContact NH2-OE1 3.32Å; R101-E131 IonicContact NH2-OE2 3.06Å; R101-E131 PolarHBondContact NH2-OE2 2.86Å
102	K	86.3	Confident	75.4	Confident	58 Å²	58	73.4 Å²	73.4	25%	0.252	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-58.9	125.4	174.7	-170.4	169.8	-173.4	168.3	0	109.6	N104 D121 H122 F123	K102-N104 PolarHBondContact O-N 2.93Å; K102-D121 WeakPolarHBondContact CE-OD1 3.4Å; K102-D121 IonicContact NZ-OD1 3.12Å; K102-D121 PolarHBondContact NZ-OD1 3.3Å; K102-H122 PolarHBondContact NZ-O 2.9Å; K102-F123 HydrophobicContact CB-CD1 4.23Å; K102-F123 HydrophobicContact CB-CE1 3.59Å; K102-F123 HydrophobicContact CB-CZ 4.21Å; K102-F123 HydrophobicContact CD-CD1 4.22Å; K102-F123 HydrophobicContact CD-CE1 3.7Å; K102-F123 HydrophobicContact CD-CE2 4.15Å; K102-F123 HydrophobicContact CD-CZ 3.62Å; K102-F123 HydrophobicContact CG-CE1 4.29Å
103	P	79.9	Confident	72.9	Confident	91 Å²	91	79.5 Å²	79.5	59%	0.591	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-57.2	129.8	-179	-25.1	32.9	0	0	0	111.7	R101 N105	R101-P103 WeakPolarHBondContact O-CD 3.44Å; P103-N105 PolarHBondContact O-N 3.23Å
104	N	67.8	Low	70.6	Confident	123 Å²	123	83.3 Å²	83.3	66%	0.658	46%	0.458	S	S	*	.			trans	-71.4	82	169.7	-84	-32.6	0	0	0	109.1	K102 L106	K102-N104 PolarHBondContact O-N 2.93Å; N104-L106 PolarHBondContact O-N 3.09Å
105	N	58	Low	68.1	Low	111 Å²	111	85.7 Å²	85.7	59%	0.594	48%	0.475	S	S	*	.			trans	-70.1	83.6	172.8	-76.3	-9.7	0	0	0	109.6	P103 A107 G108 R109	P103-N105 PolarHBondContact O-N 3.23Å; N105-A107 PolarHBondContact O-N 2.77Å; N105-G108 PolarHBondContact O-N 3.18Å; N105-R109 PolarHBondContact O-N 2.69Å; N105-R109 VanDerWaalsContact O-N 3.12Å
106	L	52.6	Low	65.6	Low	132 Å²	132	87.4 Å²	87.4	69%	0.691	49%	0.494	S	S	*	.	H	α-helix	trans	-57.3	-32.2	171.6	-147.4	133	0	0	0	110.4	N104 R109 L110	N104-L106 PolarHBondContact O-N 3.09Å; L106-R109 PolarHBondContact O-N 3.07Å; L106-L110 HydrophobicContact CD2-CD1 4.01Å; L106-L110 PolarHBondContact O-N 3.01Å; L106-L110 VanDerWaalsContact O-N 3.14Å
107	A	46.6	Very low	62.9	Low	80 Å²	80	93.2 Å²	93.2	66%	0.661	53%	0.525	S	S	*	.	H	α-helix	trans	-65.1	-37.3	172.1	0	0	0	0	0	113.5	N105 A111	N105-A107 PolarHBondContact O-N 2.77Å; A107-A111 WeakPolarHBondContact O-CB 3.44Å; A107-A111 PolarHBondContact O-N 3.41Å
108	G	48.3	Very low	60.4	Low	31 Å²	31	100.4 Å²	100.4	32%	0.32	56%	0.562	S	S	.	*	H	α-helix	trans	-69	-41.7	175.9	0	0	0	0	0	112	N105 L110 A111 T112	N105-G108 PolarHBondContact O-N 3.18Å; G108-L110 PolarHBondContact O-N 2.73Å; G108-A111 WeakPolarHBondContact O-CB 3.27Å; G108-A111 PolarHBondContact O-N 2.56Å; G108-A111 VanDerWaalsContact O-N 3.16Å; G108-T112 PolarHBondContact O-N 2.46Å; G108-T112 PolarHBondContact O-OG1 3.37Å
109	R	47.1	Very low	58.1	Low	188 Å²	188	104.2 Å²	104.2	71%	0.709	58%	0.579	S	S	*	*	H	α-helix	trans	-65	-34.2	176.3	-80.6	-176.5	151.1	172.1	-4.3	114	N105 L106 T112 F113	N105-R109 PolarHBondContact O-N 2.69Å; N105-R109 VanDerWaalsContact O-N 3.12Å; L106-R109 PolarHBondContact O-N 3.07Å; R109-T112 WeakPolarHBondContact CA-OG1 3.41Å; R109-T112 PolarHBondContact O-OG1 3.18Å; R109-F113 PolarHBondContact O-N 3.29Å
110	L	51.9	Low	56.1	Low	122 Å²	122	105 Å²	105	64%	0.639	59%	0.585	S	S	*	*	H	α-helix	trans	-72	-36.6	171.6	-90.6	152.1	0	0	0	111.8	L106 G108 F113	L106-L110 HydrophobicContact CD2-CD1 4.01Å; L106-L110 PolarHBondContact O-N 3.01Å; L106-L110 VanDerWaalsContact O-N 3.14Å; G108-L110 PolarHBondContact O-N 2.73Å; L110-F113 PolarHBondContact O-N 3.24Å
111	A	48.9	Very low	54.6	Low	80 Å²	80	105.7 Å²	105.7	66%	0.661	59%	0.593	S	S	*	*	H	α-helix	trans	-67.4	-33.9	174.9	0	0	0	0	0	112.7	A107 G108	A107-A111 WeakPolarHBondContact O-CB 3.44Å; A107-A111 PolarHBondContact O-N 3.41Å; G108-A111 WeakPolarHBondContact O-CB 3.27Å; G108-A111 PolarHBondContact O-N 2.56Å; G108-A111 VanDerWaalsContact O-N 3.16Å
112	T	46.5	Very low	53.9	Low	59 Å²	59	110.9 Å²	110.9	36%	0.362	62%	0.619	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.7	6.2	178.9	51.7	0	0	0	0	114.7	G108 R109 G114 S115	G108-T112 PolarHBondContact O-N 2.46Å; G108-T112 PolarHBondContact O-OG1 3.37Å; R109-T112 WeakPolarHBondContact CA-OG1 3.41Å; R109-T112 PolarHBondContact O-OG1 3.18Å; T112-G114 PolarHBondContact O-N 3.14Å; T112-S115 PolarHBondContact O-N 2.8Å
113	F	45	Very low	54	Low	191 Å²	191	108.6 Å²	108.6	84%	0.838	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-4	178.7	-135.3	-92.8	0	0	0	113.8	R109 L110	R109-F113 PolarHBondContact O-N 3.29Å; L110-F113 PolarHBondContact O-N 3.24Å
114	G	47.9	Very low	54.6	Low	80 Å²	80	107.7 Å²	107.7	83%	0.825	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132	4.5	175.2	0	0	0	0	0	116.3	T112	T112-G114 PolarHBondContact O-N 3.14Å
115	S	42.6	Very low	55.7	Low	52 Å²	52	103 Å²	103	36%	0.364	58%	0.577	S	S	.	*			trans	-115.5	113.7	177.9	64.7	0	0	0	0	110.8	T112 N117	T112-S115 PolarHBondContact O-N 2.8Å; S115-N117 PolarHBondContact O-N 3.21Å
116	S	43.3	Very low	57.4	Low	121 Å²	121	101.3 Å²	101.3	85%	0.846	57%	0.565	S	S	*	*			trans	-65.6	8.1	170.7	42.9	0	0	0	0	114.5	I118	S116-I118 PolarHBondContact O-N 3.43Å
117	N	39.1	Very low	59.4	Low	124 Å²	124	97 Å²	97	66%	0.663	54%	0.541	S	S	*	.			trans	-78	82	162.4	-64.9	-7.5	0	0	0	107.4	S115 E119	S115-N117 PolarHBondContact O-N 3.21Å; N117-E119 PolarHBondContact O-N 3.01Å
118	I	43.2	Very low	61.7	Low	151 Å²	151	93.2 Å²	93.2	77%	0.774	51%	0.51	S	S	*	.			trans	-57	99.9	155.6	-59.7	167.6	0	0	0	103.5	S116 E120	S116-I118 PolarHBondContact O-N 3.43Å; I118-E120 PolarHBondContact O-N 2.9Å
119	E	45	Very low	64	Low	161 Å²	161	91.7 Å²	91.7	75%	0.752	50%	0.495	S	S	*	.			trans	-49.5	113.9	162.2	-75.1	-179.6	164.2	0	0	104.8	N117 D121	N117-E119 PolarHBondContact O-N 3.01Å; E119-D121 PolarHBondContact O-N 3.42Å
120	E	52.8	Low	66.3	Low	152 Å²	152	82.8 Å²	82.8	71%	0.71	46%	0.461	S	S	*	.			trans	-49.3	115.4	169.6	-80.2	179.1	168.5	0	0	105.2	I118 H122	I118-E120 PolarHBondContact O-N 2.9Å; E120-H122 PolarHBondContact O-N 3.44Å; E120-H122 PolarHBondContact O-ND1 3.33Å; E120-H122 IonicContact OE2-CE1 3.08Å
121	D	61.8	Low	68.3	Low	79 Å²	79	77.1 Å²	77.1	42%	0.422	43%	0.431	S	S	.	.			trans	-75	78.4	-163.6	-155.5	12.6	0	0	0	106.3	K102 E119 F123 Y175	K102-D121 WeakPolarHBondContact CE-OD1 3.4Å; K102-D121 IonicContact NZ-OD1 3.12Å; K102-D121 PolarHBondContact NZ-OD1 3.3Å; E119-D121 PolarHBondContact O-N 3.42Å; D121-F123 HydrophobicContact CB-CE2 4.19Å; D121-F123 WeakPolarHBondContact O-CD2 3.41Å; D121-F123 PolarHBondContact O-N 3.26Å; D121-F123 VanDerWaalsContact O-N 3.16Å; D121-Y175 WeakPolarHBondContact CB-OH 3.41Å; D121-Y175 PolarHBondContact OD2-OH 3.35Å
122	H	78.3	Confident	70.6	Confident	142 Å²	142	73.3 Å²	73.3	66%	0.657	40%	0.4	S	S	*	.			trans	-68.2	114.6	-176.8	-75.2	74.7	0	0	0	107.2	K102 E120	K102-H122 PolarHBondContact NZ-O 2.9Å; E120-H122 PolarHBondContact O-N 3.44Å; E120-H122 PolarHBondContact O-ND1 3.33Å; E120-H122 IonicContact OE2-CE1 3.08Å
123	F	87.6	Confident	73	Confident	11 Å²	11	70.5 Å²	70.5	5%	0.048	38%	0.382	C	S	.	.			trans	-96.5	146.1	168.7	-77.6	-96.9	0	0	0	108.6	K102 D121 Q127 L128 K171 Y175 H179	K102-F123 HydrophobicContact CB-CD1 4.23Å; K102-F123 HydrophobicContact CB-CE1 3.59Å; K102-F123 HydrophobicContact CB-CZ 4.21Å; K102-F123 HydrophobicContact CD-CD1 4.22Å; K102-F123 HydrophobicContact CD-CE1 3.7Å; K102-F123 HydrophobicContact CD-CE2 4.15Å; K102-F123 HydrophobicContact CD-CZ 3.62Å; K102-F123 HydrophobicContact CG-CE1 4.29Å; D121-F123 HydrophobicContact CB-CE2 4.19Å; D121-F123 WeakPolarHBondContact O-CD2 3.41Å; D121-F123 PolarHBondContact O-N 3.26Å; D121-F123 VanDerWaalsContact O-N 3.16Å; F123-Q127 HydrophobicContact CD1-CB 3.95Å; F123-L128 HydrophobicContact CB-CD1 4.3Å; F123-L128 HydrophobicContact CB-CD2 3.68Å; F123-L128 HydrophobicContact CB-CG 3.7Å; F123-L128 HydrophobicContact CD1-CD2 3.84Å; F123-L128 HydrophobicContact CD1-CG 4.45Å; F123-L128 HydrophobicContact CD2-CD2 4.34Å; F123-L128 HydrophobicContact CG-CD2 3.67Å; F123-L128 HydrophobicContact CG-CG 4.23Å; F123-K171 VanDerWaalsContact CE1-NZ 3.3Å; F123-Y175 HydrophobicContact CD2-CD1 4.09Å; F123-Y175 HydrophobicContact CD2-CD2 4.43Å; F123-Y175 AromaticContact CD2-CE1 3.56Å; F123-Y175 HydrophobicContact CD2-CE1 3.56Å; F123-Y175 AromaticContact CD2-CE2 3.95Å; F123-Y175 HydrophobicContact CD2-CE2 3.95Å; F123-Y175 AromaticContact CD2-CZ 3.49Å; F123-Y175 VanDerWaalsContact CD2-CZ 3.49Å; F123-Y175 HydrophobicContact CE2-CD2 4.5Å; F123-Y175 AromaticContact CE2-CE1 3.97Å; F123-Y175 HydrophobicContact CE2-CE1 3.97Å; F123-Y175 AromaticContact CE2-CE2 3.69Å; F123-Y175 HydrophobicContact CE2-CE2 3.69Å; F123-Y175 AromaticContact CE2-CZ 3.39Å; F123-Y175 WeakPolarHBondContact CE2-OH 3.34Å; F123-Y175 HydrophobicContact CZ-CE2 4.41Å; F123-H179 PolarHBondContact O-CE1 3.34Å
124	T	91.5	Very high	75.4	Confident	72 Å²	72	63.6 Å²	63.6	44%	0.442	35%	0.351	S	S	.	.			trans	-81.3	158.3	161.8	65.9	0	0	0	0	109.8	E126 Q127 L128	T124-E126 PolarHBondContact O-N 3.4Å; T124-Q127 PolarHBondContact O-N 3.23Å; T124-Q127 VanDerWaalsContact O-N 3.08Å; T124-Q127 VanDerWaalsContact OG1-CG 3.25Å; T124-Q127 WeakPolarHBondContact OG1-CG 3.39Å; T124-Q127 PolarHBondContact OG1-N 2.94Å; T124-Q127 VanDerWaalsContact OG1-N 3.16Å; T124-L128 PolarHBondContact O-N 2.84Å
125	D	92.6	Very high	77.5	Confident	24 Å²	24	59.8 Å²	59.8	13%	0.128	31%	0.312	C	S	.	.	H	α-helix	trans	-53.2	-43.9	173.9	-64.4	8.2	0	0	0	110.3	L26 Q127 L128 H129 H179 W181 Q182 V186	L26-D125 HydrophobicContact CD2-CB 4.22Å; D125-Q127 PolarHBondContact O-N 3.41Å; D125-L128 PolarHBondContact O-N 3.35Å; D125-H129 PolarHBondContact O-CD2 3.32Å; D125-H129 PolarHBondContact O-N 2.94Å; D125-H179 IonicContact OD1-CD2 3.74Å; D125-H179 IonicContact OD1-CE1 3.45Å; D125-H179 IonicContact OD1-NE2 2.72Å; D125-H179 PolarHBondContact OD1-NE2 2.95Å; D125-W181 HydrophobicContact CB-CZ3 4.43Å; D125-Q182 PolarHBondContact OD2-N 3.05Å; D125-V186 HydrophobicContact CB-CG1 4.07Å
126	E	93.4	Very high	80.1	Confident	75 Å²	75	57.6 Å²	57.6	35%	0.35	30%	0.296	S	S	.	.	H	α-helix	trans	-59.1	-44.2	176.4	-174.8	179.4	-134.9	0	0	113	M60 Y100 T124 L128 H129 A130	M60-E126 HydrophobicContact CE-CG 3.52Å; Y100-E126 HydrophobicContact CD1-CG 4.38Å; T124-E126 PolarHBondContact O-N 3.4Å; E126-L128 VanDerWaalsContact C-N 3.34Å; E126-L128 PolarHBondContact O-N 2.93Å; E126-H129 PolarHBondContact O-N 3.5Å; E126-A130 WeakPolarHBondContact O-CB 3.4Å; E126-A130 PolarHBondContact O-N 3.13Å
127	Q	93.8	Very high	82.5	Confident	42 Å²	42	51.8 Å²	51.8	20%	0.196	26%	0.256	C	S	.	.	H	α-helix	trans	-66.1	-36.2	178.8	-74	170.1	-9.7	0	0	112.2	Y100 F123 T124 D125 A130 E131	Y100-Q127 WeakPolarHBondContact O-CG 3.49Å; F123-Q127 HydrophobicContact CD1-CB 3.95Å; T124-Q127 PolarHBondContact O-N 3.23Å; T124-Q127 VanDerWaalsContact O-N 3.08Å; T124-Q127 VanDerWaalsContact OG1-CG 3.25Å; T124-Q127 WeakPolarHBondContact OG1-CG 3.39Å; T124-Q127 PolarHBondContact OG1-N 2.94Å; T124-Q127 VanDerWaalsContact OG1-N 3.16Å; D125-Q127 PolarHBondContact O-N 3.41Å; Q127-A130 PolarHBondContact O-N 3.36Å; Q127-E131 WeakPolarHBondContact O-CG 3.34Å; Q127-E131 PolarHBondContact O-N 3.21Å; Q127-E131 VanDerWaalsContact O-N 3.09Å
128	L	94.6	Very high	85	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-66	-48	173.8	-69.4	179.3	0	0	0	110.7	F123 T124 D125 E126 A130 E131 L132 Y175 H179 W181 F190	F123-L128 HydrophobicContact CB-CD1 4.3Å; F123-L128 HydrophobicContact CB-CD2 3.68Å; F123-L128 HydrophobicContact CB-CG 3.7Å; F123-L128 HydrophobicContact CD1-CD2 3.84Å; F123-L128 HydrophobicContact CD1-CG 4.45Å; F123-L128 HydrophobicContact CD2-CD2 4.34Å; F123-L128 HydrophobicContact CG-CD2 3.67Å; F123-L128 HydrophobicContact CG-CG 4.23Å; T124-L128 PolarHBondContact O-N 2.84Å; D125-L128 PolarHBondContact O-N 3.35Å; E126-L128 VanDerWaalsContact C-N 3.34Å; E126-L128 PolarHBondContact O-N 2.93Å; L128-A130 PolarHBondContact O-N 3.43Å; L128-E131 WeakPolarHBondContact O-CB 3.34Å; L128-E131 PolarHBondContact O-N 3.25Å; L128-L132 PolarHBondContact O-N 3.29Å; L128-Y175 HydrophobicContact CD2-CD1 4.33Å; L128-Y175 HydrophobicContact CD2-CD2 4.05Å; L128-Y175 HydrophobicContact CD2-CG 3.72Å; L128-H179 HydrophobicContact CD1-CB 3.83Å; L128-H179 WeakPolarHBondContact CD1-CD2 3.22Å; L128-H179 VanDerWaalsContact CD1-CG 3.48Å; L128-W181 HydrophobicContact CB-CH2 4.29Å; L128-W181 HydrophobicContact CD1-CH2 3.79Å; L128-W181 HydrophobicContact CD1-CZ2 3.93Å; L128-W181 HydrophobicContact CD1-CZ3 4.49Å; L128-F190 HydrophobicContact CB-CD2 4.35Å; L128-F190 HydrophobicContact CB-CE2 3.76Å; L128-F190 HydrophobicContact CB-CZ 4.06Å; L128-F190 VanDerWaalsContact O-CE2 3.32Å; L128-F190 WeakPolarHBondContact O-CE2 3.21Å
129	H	96.2	Very high	87.2	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-58.6	-35.8	176	-82.3	-108.1	0	0	0	112.3	L26 M60 Y61 D125 E126 L132 C133 W181 V186 F190	L26-H129 HydrophobicContact CD1-CB 3.93Å; L26-H129 HydrophobicContact CD2-CB 4.48Å; M60-H129 HydrophobicContact SD-CB 4.08Å; Y61-H129 HydrophobicContact CE2-CB 4.05Å; Y61-H129 AromaticContact CE2-ND1 3.46Å; Y61-H129 WeakPolarHBondContact CE2-ND1 3.33Å; Y61-H129 AromaticContact CZ-ND1 3.46Å; Y61-H129 PolarHBondContact OH-CE1 3.2Å; Y61-H129 PolarHBondContact OH-ND1 2.92Å; D125-H129 PolarHBondContact O-CD2 3.32Å; D125-H129 PolarHBondContact O-N 2.94Å; E126-H129 PolarHBondContact O-N 3.5Å; H129-L132 PolarHBondContact O-N 2.96Å; H129-C133 WeakPolarHBondContact O-CB 3.42Å; H129-C133 PolarHBondContact O-N 2.97Å; H129-C133 PolarHBondContact O-SG 2.99Å; H129-W181 AromaticContact NE2-CZ3 3.78Å; H129-V186 PolarHBondContact CE1-O 3.38Å; H129-V186 WeakPolarHBondContact NE2-CG1 3.43Å; H129-V186 PolarHBondContact NE2-O 2.9Å; H129-F190 AromaticContact CD2-CD2 3.9Å
130	A	95.8	Very high	89.5	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.5	-41	173.2	0	0	0	0	0	112.8	M60 R101 E126 Q127 L128 L132 Y134	M60-A130 HydrophobicContact CE-CB 4.12Å; M60-A130 HydrophobicContact SD-CB 3.99Å; R101-A130 HydrophobicContact CG-CB 3.87Å; E126-A130 WeakPolarHBondContact O-CB 3.4Å; E126-A130 PolarHBondContact O-N 3.13Å; Q127-A130 PolarHBondContact O-N 3.36Å; L128-A130 PolarHBondContact O-N 3.43Å; A130-L132 VanDerWaalsContact C-N 3.33Å; A130-Y134 WeakPolarHBondContact O-CB 3.48Å; A130-Y134 PolarHBondContact O-N 3.11Å
131	E	94.6	Very high	91.2	Very high	3 Å²	3	27.5 Å²	27.5	1%	0.014	13%	0.134	C	C	.	.	H	α-helix	trans	-61	-41.9	173.5	-69.4	-74.5	179.5	0	0	112	R101 Q127 L128 A135 K171	R101-E131 HydrophobicContact CG-CG 4.43Å; R101-E131 IonicContact CZ-OE1 3.45Å; R101-E131 IonicContact CZ-OE2 2.62Å; R101-E131 IonicContact NE-OE1 3.37Å; R101-E131 PolarHBondContact NE-OE1 3.24Å; R101-E131 IonicContact NE-OE2 3.61Å; R101-E131 PolarHBondContact NE-OE2 2.93Å; R101-E131 IonicContact NH2-OE1 3.03Å; R101-E131 PolarHBondContact NH2-OE1 3.32Å; R101-E131 IonicContact NH2-OE2 3.06Å; R101-E131 PolarHBondContact NH2-OE2 2.86Å; Q127-E131 WeakPolarHBondContact O-CG 3.34Å; Q127-E131 PolarHBondContact O-N 3.21Å; Q127-E131 VanDerWaalsContact O-N 3.09Å; L128-E131 WeakPolarHBondContact O-CB 3.34Å; L128-E131 PolarHBondContact O-N 3.25Å; E131-A135 WeakPolarHBondContact O-CB 3.45Å; E131-A135 PolarHBondContact O-N 3.11Å; E131-K171 IonicContact OE1-NZ 3.68Å; E131-K171 PolarHBondContact OE1-NZ 3.25Å
132	L	96.7	Very high	92.2	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-66.9	-51.7	177.7	172.2	62.7	0	0	0	111.7	L128 H129 A130 Y134 A135 E136 Y169 F190 V194	L128-L132 PolarHBondContact O-N 3.29Å; H129-L132 PolarHBondContact O-N 2.96Å; A130-L132 VanDerWaalsContact C-N 3.33Å; L132-Y134 VanDerWaalsContact C-N 3.26Å; L132-Y134 PolarHBondContact O-N 3.08Å; L132-A135 WeakPolarHBondContact O-CA 3.38Å; L132-A135 WeakPolarHBondContact O-CB 3.41Å; L132-A135 PolarHBondContact O-N 3.06Å; L132-E136 HydrophobicContact CD1-CG 4.28Å; L132-E136 PolarHBondContact O-N 2.82Å; L132-Y169 HydrophobicContact CD1-CD1 4.44Å; L132-Y169 HydrophobicContact CD1-CE1 3.77Å; L132-F190 HydrophobicContact CB-CD2 4.04Å; L132-F190 HydrophobicContact CB-CE2 3.67Å; L132-F190 HydrophobicContact CD2-CD2 3.58Å; L132-F190 HydrophobicContact CD2-CE2 4.01Å; L132-F190 HydrophobicContact CD2-CG 4.2Å; L132-F190 HydrophobicContact CG-CD2 4.44Å; L132-F190 HydrophobicContact CG-CE2 4.43Å; L132-V194 HydrophobicContact CD1-CG2 4.18Å
133	C	96.9	Very high	92.5	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-60.4	-38	179.2	-71.6	0	0	0	0	111.8	L64 C97 H129 E136 A137	L64-C133 HydrophobicContact CD2-CB 3.76Å; L64-C133 VanDerWaalsContact CD2-SG 3.56Å; C97-C133 WeakPolarHBondContact SG-CB 3.35Å; H129-C133 WeakPolarHBondContact O-CB 3.42Å; H129-C133 PolarHBondContact O-N 2.97Å; H129-C133 PolarHBondContact O-SG 2.99Å; C133-E136 PolarHBondContact O-N 2.86Å; C133-A137 WeakPolarHBondContact O-CB 3.45Å; C133-A137 PolarHBondContact O-N 3.19Å
134	Y	95.2	Very high	92.4	Very high	46 Å²	46	18.4 Å²	18.4	18%	0.18	9%	0.091	C	C	.	.	H	α-helix	trans	-61.8	-45	171.8	-179.1	-96.4	0	0	0	112.2	S94 C97 E98 A130 L132 A137 L138	S94-Y134 WeakPolarHBondContact O-CD2 3.43Å; C97-Y134 HydrophobicContact CB-CD2 4.37Å; E98-Y134 WeakPolarHBondContact OE2-CE2 3.46Å; A130-Y134 WeakPolarHBondContact O-CB 3.48Å; A130-Y134 PolarHBondContact O-N 3.11Å; L132-Y134 VanDerWaalsContact C-N 3.26Å; L132-Y134 PolarHBondContact O-N 3.08Å; Y134-A137 PolarHBondContact O-N 3.32Å; Y134-L138 HydrophobicContact CD1-CD1 3.9Å; Y134-L138 HydrophobicContact CD1-CG 4.27Å; Y134-L138 HydrophobicContact CE1-CD1 3.3Å; Y134-L138 HydrophobicContact CE1-CG 3.92Å; Y134-L138 WeakPolarHBondContact O-CG 3.5Å; Y134-L138 PolarHBondContact O-N 3.45Å
135	A	93.7	Very high	91.7	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-62	-42.5	176.7	0	0	0	0	0	112.2	E131 L132 L138 L139 C165 Y169	E131-A135 WeakPolarHBondContact O-CB 3.45Å; E131-A135 PolarHBondContact O-N 3.11Å; L132-A135 WeakPolarHBondContact O-CA 3.38Å; L132-A135 WeakPolarHBondContact O-CB 3.41Å; L132-A135 PolarHBondContact O-N 3.06Å; A135-L138 PolarHBondContact O-N 3.35Å; A135-L139 WeakPolarHBondContact O-CB 3.41Å; A135-L139 PolarHBondContact O-N 2.78Å; A135-C165 PolarHBondContact O-SG 3.46Å; A135-Y169 HydrophobicContact CB-CD1 4.39Å; A135-Y169 HydrophobicContact CB-CD2 4.01Å; A135-Y169 HydrophobicContact CB-CE1 4.13Å; A135-Y169 HydrophobicContact CB-CE2 3.74Å; A135-Y169 HydrophobicContact CB-CG 4.31Å
136	E	95.2	Very high	90.5	Very high	6 Å²	6	18.1 Å²	18.1	3%	0.028	8%	0.083	C	C	.	.	H	α-helix	trans	-61.6	-46.9	175.7	-72.8	-178.4	-148.6	0	0	111.3	L64 L132 C133 L138 L139 Q140 Y169 R243	L64-E136 HydrophobicContact CD1-CB 3.96Å; L64-E136 HydrophobicContact CD2-CB 4.15Å; L64-E136 WeakPolarHBondContact CD2-OE2 3.38Å; L132-E136 HydrophobicContact CD1-CG 4.28Å; L132-E136 PolarHBondContact O-N 2.82Å; C133-E136 PolarHBondContact O-N 2.86Å; E136-L138 VanDerWaalsContact C-N 3.34Å; E136-L138 PolarHBondContact O-N 3.29Å; E136-L139 WeakPolarHBondContact O-CB 3.3Å; E136-L139 PolarHBondContact O-N 3.25Å; E136-L139 VanDerWaalsContact O-N 3.16Å; E136-Q140 WeakPolarHBondContact O-CG 3.3Å; E136-Q140 PolarHBondContact O-N 2.93Å; E136-Y169 WeakPolarHBondContact CA-OH 3.49Å; E136-Y169 WeakPolarHBondContact CG-OH 3.36Å; E136-Y169 PolarHBondContact N-OH 2.6Å; E136-R243 VanDerWaalsContact CD-NH2 3.25Å; E136-R243 IonicContact OE1-CZ 3.91Å; E136-R243 VanDerWaalsContact OE1-CZ 3.26Å; E136-R243 IonicContact OE1-NE 3.77Å; E136-R243 PolarHBondContact OE1-NE 3.27Å; E136-R243 IonicContact OE1-NH2 2.76Å; E136-R243 PolarHBondContact OE1-NH2 3.06Å; E136-R243 IonicContact OE2-CZ 3.78Å; E136-R243 IonicContact OE2-NE 3.56Å; E136-R243 IonicContact OE2-NH2 2.8Å; E136-R243 PolarHBondContact OE2-NH2 3.13Å
137	A	95.1	Very high	89.1	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-61	-41.1	175.7	0	0	0	0	0	112	L64 A93 C133 Y134 Q140 R141	L64-A137 HydrophobicContact CD1-CB 4.22Å; A93-A137 HydrophobicContact CB-CB 4.28Å; C133-A137 WeakPolarHBondContact O-CB 3.45Å; C133-A137 PolarHBondContact O-N 3.19Å; Y134-A137 PolarHBondContact O-N 3.32Å; A137-Q140 PolarHBondContact O-N 3.4Å; A137-R141 WeakPolarHBondContact O-CG 3.43Å; A137-R141 PolarHBondContact O-N 2.93Å
138	L	91.2	Very high	87.6	Confident	10 Å²	10	20.6 Å²	20.6	5%	0.052	10%	0.099	C	C	.	.	H	α-helix	trans	-64.5	-38.4	174.5	-73	-173.4	0	0	0	112.8	Y134 A135 E136 R141 A142 C165	Y134-L138 HydrophobicContact CD1-CD1 3.9Å; Y134-L138 HydrophobicContact CD1-CG 4.27Å; Y134-L138 HydrophobicContact CE1-CD1 3.3Å; Y134-L138 HydrophobicContact CE1-CG 3.92Å; Y134-L138 WeakPolarHBondContact O-CG 3.5Å; Y134-L138 PolarHBondContact O-N 3.45Å; A135-L138 PolarHBondContact O-N 3.35Å; E136-L138 VanDerWaalsContact C-N 3.34Å; E136-L138 PolarHBondContact O-N 3.29Å; L138-R141 PolarHBondContact O-N 3.45Å; L138-A142 WeakPolarHBondContact O-CB 3.44Å; L138-A142 PolarHBondContact O-N 2.89Å; L138-C165 HydrophobicContact CB-CB 3.99Å
139	L	89.3	Confident	85.5	Confident	16 Å²	16	22.4 Å²	22.4	8%	0.084	11%	0.108	C	C	.	.	H	α-helix	trans	-62.3	-49.3	176.3	-178.8	58.8	0	0	0	111	A135 E136 R141 A142 L143 Y169 T200	A135-L139 WeakPolarHBondContact O-CB 3.41Å; A135-L139 PolarHBondContact O-N 2.78Å; E136-L139 WeakPolarHBondContact O-CB 3.3Å; E136-L139 PolarHBondContact O-N 3.25Å; E136-L139 VanDerWaalsContact O-N 3.16Å; L139-R141 VanDerWaalsContact C-N 3.33Å; L139-R141 PolarHBondContact O-N 3.08Å; L139-A142 WeakPolarHBondContact O-CB 3.47Å; L139-A142 PolarHBondContact O-N 2.87Å; L139-L143 HydrophobicContact CD1-CD1 4.43Å; L139-L143 HydrophobicContact CG-CD1 4.31Å; L139-L143 WeakPolarHBondContact O-CG 3.21Å; L139-L143 PolarHBondContact O-N 3.25Å; L139-Y169 HydrophobicContact CD2-CE2 4.38Å; L139-T200 HydrophobicContact CD2-CG2 4.18Å
140	Q	92.3	Very high	83.1	Confident	17 Å²	17	29.6 Å²	29.6	8%	0.079	14%	0.142	C	C	.	.	H	α-helix	trans	-59.4	-43.5	177.7	-68.4	172.1	-0.6	0	0	111.3	T68 F71 T90 E136 A137 A142 L143 L144	T68-Q140 PolarHBondContact OG1-NE2 3.22Å; F71-Q140 HydrophobicContact CB-CB 4.5Å; F71-Q140 HydrophobicContact CB-CG 4.48Å; F71-Q140 HydrophobicContact CD1-CG 3.96Å; F71-Q140 HydrophobicContact CD2-CB 3.79Å; F71-Q140 HydrophobicContact CD2-CG 4.12Å; F71-Q140 HydrophobicContact CE1-CG 4.16Å; F71-Q140 HydrophobicContact CE2-CB 4.08Å; F71-Q140 HydrophobicContact CE2-CG 4.32Å; F71-Q140 HydrophobicContact CG-CB 4.03Å; F71-Q140 HydrophobicContact CG-CG 3.92Å; F71-Q140 HydrophobicContact CZ-CG 4.32Å; T90-Q140 HydrophobicContact CG2-CB 3.77Å; E136-Q140 WeakPolarHBondContact O-CG 3.3Å; E136-Q140 PolarHBondContact O-N 2.93Å; A137-Q140 PolarHBondContact O-N 3.4Å; Q140-A142 PolarHBondContact O-N 3.45Å; Q140-L143 PolarHBondContact O-N 3.29Å; Q140-L144 WeakPolarHBondContact O-CG 3.44Å; Q140-L144 PolarHBondContact O-N 3.49Å
141	R	89	Confident	81.1	Confident	34 Å²	34	32 Å²	32	13%	0.128	16%	0.155	C	C	.	.	H	α-helix	trans	-61.4	-41.9	174.4	-72.3	171.5	80.3	-174.6	-1.5	113.3	T90 S94 A137 L138 L139 L143 T145	T90-R141 VanDerWaalsContact CB-CG 3.4Å; T90-R141 HydrophobicContact CG2-CG 4.43Å; T90-R141 WeakPolarHBondContact OG1-CG 3.43Å; S94-R141 PolarHBondContact OG-NH1 3.33Å; A137-R141 WeakPolarHBondContact O-CG 3.43Å; A137-R141 PolarHBondContact O-N 2.93Å; L138-R141 PolarHBondContact O-N 3.45Å; L139-R141 VanDerWaalsContact C-N 3.33Å; L139-R141 PolarHBondContact O-N 3.08Å; R141-L143 VanDerWaalsContact C-N 3.32Å; R141-T145 PolarHBondContact O-N 3.12Å; R141-T145 VanDerWaalsContact O-N 3.15Å; R141-T145 PolarHBondContact O-OG1 2.99Å
142	A	83.8	Confident	78.4	Confident	2 Å²	2	38 Å²	38	2%	0.017	19%	0.187	C	C	.	.	H	α-helix	trans	-63.1	-43.9	177.7	0	0	0	0	0	110.2	L138 L139 Q140 T145 F146 R161 I162	L138-A142 WeakPolarHBondContact O-CB 3.44Å; L138-A142 PolarHBondContact O-N 2.89Å; L139-A142 WeakPolarHBondContact O-CB 3.47Å; L139-A142 PolarHBondContact O-N 2.87Å; Q140-A142 PolarHBondContact O-N 3.45Å; A142-T145 WeakPolarHBondContact O-CB 3.31Å; A142-T145 PolarHBondContact O-N 2.77Å; A142-F146 WeakPolarHBondContact O-CD2 3.43Å; A142-F146 WeakPolarHBondContact O-CE2 3.43Å; A142-R161 HydrophobicContact CB-CB 4.26Å; A142-I162 HydrophobicContact CB-CG1 4.02Å
143	L	83.4	Confident	76	Confident	40 Å²	40	43.2 Å²	43.2	21%	0.209	21%	0.213	C	C	.	.	H	α-helix	trans	-62.4	-47.2	176.6	-75.3	174.7	0	0	0	113	F71 L139 Q140 R141 T145 F146 V147 L204	F71-L143 HydrophobicContact CE2-CB 3.82Å; F71-L143 HydrophobicContact CE2-CD1 4.34Å; F71-L143 HydrophobicContact CZ-CB 4.1Å; F71-L143 HydrophobicContact CZ-CD1 3.78Å; L139-L143 HydrophobicContact CD1-CD1 4.43Å; L139-L143 HydrophobicContact CG-CD1 4.31Å; L139-L143 WeakPolarHBondContact O-CG 3.21Å; L139-L143 PolarHBondContact O-N 3.25Å; Q140-L143 PolarHBondContact O-N 3.29Å; R141-L143 VanDerWaalsContact C-N 3.32Å; L143-T145 PolarHBondContact O-N 3.45Å; L143-F146 WeakPolarHBondContact O-CB 3.32Å; L143-F146 PolarHBondContact O-N 3.03Å; L143-V147 PolarHBondContact O-N 3.16Å; L143-L204 HydrophobicContact CD1-CD1 4.42Å; L143-L204 HydrophobicContact CD2-CD1 3.63Å; L143-L204 HydrophobicContact CG-CD1 4.42Å
144	L	85.4	Confident	74.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.2	-31.3	176.2	-71.7	165.7	0	0	0	112.9	F71 A74 A86 M87 T90 Q140 F146 V147 Q148	F71-L144 HydrophobicContact CD2-CD1 3.97Å; F71-L144 HydrophobicContact CD2-CD2 3.91Å; F71-L144 HydrophobicContact CD2-CG 3.69Å; F71-L144 HydrophobicContact CE2-CD2 4.39Å; F71-L144 HydrophobicContact CE2-CG 4.07Å; A74-L144 HydrophobicContact CB-CD2 3.74Å; A86-L144 HydrophobicContact CB-CD1 3.62Å; A86-L144 HydrophobicContact CB-CD2 3.92Å; A86-L144 HydrophobicContact CB-CG 4.44Å; M87-L144 HydrophobicContact CG-CB 3.97Å; M87-L144 HydrophobicContact CG-CD1 4.09Å; M87-L144 HydrophobicContact SD-CB 3.42Å; M87-L144 WeakPolarHBondContact SD-CB 3.42Å; M87-L144 HydrophobicContact SD-CD1 3.98Å; M87-L144 HydrophobicContact SD-CG 4.35Å; T90-L144 HydrophobicContact CG2-CD1 4.13Å; Q140-L144 WeakPolarHBondContact O-CG 3.44Å; Q140-L144 PolarHBondContact O-N 3.49Å; L144-F146 PolarHBondContact O-N 3.48Å; L144-V147 PolarHBondContact O-N 3.31Å; L144-V147 VanDerWaalsContact O-N 3.08Å; L144-Q148 PolarHBondContact O-N 2.96Å
145	T	77.7	Confident	72.2	Confident	10 Å²	10	44 Å²	44	6%	0.061	22%	0.219	C	C	.	.	H	α-helix	trans	-62.5	-31.6	176.3	-53.9	0	0	0	0	111.5	R141 A142 L143 D149 S154 R161	R141-T145 PolarHBondContact O-N 3.12Å; R141-T145 VanDerWaalsContact O-N 3.15Å; R141-T145 PolarHBondContact O-OG1 2.99Å; A142-T145 WeakPolarHBondContact O-CB 3.31Å; A142-T145 PolarHBondContact O-N 2.77Å; L143-T145 PolarHBondContact O-N 3.45Å; T145-D149 PolarHBondContact O-N 3.35Å; T145-S154 VanDerWaalsContact CG2-O 3.32Å; T145-S154 WeakPolarHBondContact CG2-O 3.45Å; T145-R161 PolarHBondContact OG1-NH1 3.41Å
146	F	67.2	Low	70	Confident	79 Å²	79	48.5 Å²	48.5	35%	0.346	24%	0.243	S	C	.	.	H	α-helix	trans	-76.7	-25.3	175	-65.4	-74.3	0	0	0	113.4	A142 L143 L144 F155 I162	A142-F146 WeakPolarHBondContact O-CD2 3.43Å; A142-F146 WeakPolarHBondContact O-CE2 3.43Å; L143-F146 WeakPolarHBondContact O-CB 3.32Å; L143-F146 PolarHBondContact O-N 3.03Å; L144-F146 PolarHBondContact O-N 3.48Å; F146-F155 HydrophobicContact CD1-CD2 4.44Å; F146-F155 AromaticContact CE1-CD2 3.6Å; F146-F155 HydrophobicContact CE1-CD2 3.6Å; F146-F155 AromaticContact CE1-CE2 3.8Å; F146-F155 HydrophobicContact CE1-CE2 3.8Å; F146-F155 HydrophobicContact CE1-CG 4.49Å; F146-F155 HydrophobicContact CZ-CD2 4.48Å; F146-F155 HydrophobicContact CZ-CE2 4.41Å; F146-I162 HydrophobicContact CE2-CD1 3.95Å; F146-I162 HydrophobicContact CZ-CD1 3.89Å
147	V	63.7	Low	68.5	Low	61 Å²	61	53.9 Å²	53.9	37%	0.37	27%	0.266	S	S	.	.	H	α-helix	trans	-78.2	-40.1	176.4	179.5	0	0	0	0	111	L75 V83 L143 L144	L75-V147 HydrophobicContact CD2-CG2 3.58Å; V83-V147 HydrophobicContact CG2-CG1 3.94Å; L143-V147 PolarHBondContact O-N 3.16Å; L144-V147 PolarHBondContact O-N 3.31Å; L144-V147 VanDerWaalsContact O-N 3.08Å
148	Q	62.4	Low	67.1	Low	109 Å²	109	53.9 Å²	53.9	51%	0.509	27%	0.266	S	S	.	.	H	α-helix	trans	-73.6	-30	-178	-162.5	174.4	24.4	0	0	112.9	V83 L144	V83-Q148 HydrophobicContact CG1-CB 3.93Å; V83-Q148 HydrophobicContact CG1-CG 4.14Å; L144-Q148 PolarHBondContact O-N 2.96Å
149	D	50.6	Low	65.8	Low	37 Å²	37	54.2 Å²	54.2	20%	0.198	27%	0.271	C	S	.	.			trans	-157.5	118.8	-165.7	-160.8	-13.6	0	0	0	114.9	T145 N151 S154	T145-D149 PolarHBondContact O-N 3.35Å; D149-N151 VanDerWaalsContact C-N 3.26Å; D149-N151 PolarHBondContact O-N 3.46Å; D149-N151 WeakPolarHBondContact OD1-CB 3.3Å; D149-N151 PolarHBondContact OD1-N 3.34Å; D149-N151 PolarHBondContact OD1-ND2 3.27Å; D149-N151 VanDerWaalsContact OD1-ND2 3.16Å; D149-N151 PolarHBondContact OD2-ND2 2.87Å; D149-S154 VanDerWaalsContact CG-OG 3.26Å; D149-S154 WeakPolarHBondContact OD2-CB 3.4Å; D149-S154 PolarHBondContact OD2-OG 3.34Å
150	E	46.8	Very low	64.7	Low	151 Å²	151	59.2 Å²	59.2	71%	0.706	30%	0.296	S	S	*	.			trans	-81.9	7.1	173.3	-64.9	-170.6	167.9	0	0	113.7
151	N	53.5	Low	63.7	Low	50 Å²	50	61.5 Å²	61.5	27%	0.267	30%	0.304	S	S	.	.	S	Bend	trans	-76.1	153.4	-177.6	95.2	47.9	0	0	0	113.4	D149 I153 S154 F155	D149-N151 VanDerWaalsContact C-N 3.26Å; D149-N151 PolarHBondContact O-N 3.46Å; D149-N151 WeakPolarHBondContact OD1-CB 3.3Å; D149-N151 PolarHBondContact OD1-N 3.34Å; D149-N151 PolarHBondContact OD1-ND2 3.27Å; D149-N151 VanDerWaalsContact OD1-ND2 3.16Å; D149-N151 PolarHBondContact OD2-ND2 2.87Å; N151-I153 VanDerWaalsContact C-N 3.34Å; N151-I153 PolarHBondContact O-N 3.02Å; N151-I153 VanDerWaalsContact OD1-CA 3.23Å; N151-I153 WeakPolarHBondContact OD1-CA 3.43Å; N151-I153 VanDerWaalsContact OD1-CB 3.27Å; N151-I153 WeakPolarHBondContact OD1-CB 3.37Å; N151-I153 PolarHBondContact OD1-N 2.89Å; N151-S154 PolarHBondContact ND2-OG 2.99Å; N151-S154 VanDerWaalsContact ND2-OG 3.12Å; N151-S154 PolarHBondContact O-N 3.19Å; N151-S154 PolarHBondContact OD1-N 3.44Å; N151-S154 PolarHBondContact OD1-OG 3.09Å; N151-F155 WeakPolarHBondContact O-CB 3.19Å; N151-F155 PolarHBondContact O-N 3.25Å
152	L	38.4	Very low	62.9	Low	130 Å²	130	61 Å²	61	68%	0.681	30%	0.304	S	S	*	.	H	α-helix	trans	-65.5	-30.7	-177.8	-172.3	66	0	0	0	113.8	F155 L156	L152-F155 WeakPolarHBondContact O-CB 3.44Å; L152-L156 WeakPolarHBondContact O-CB 3.46Å; L152-L156 WeakPolarHBondContact O-CG 3.4Å; L152-L156 PolarHBondContact O-N 3.5Å
153	I	46.2	Very low	62.5	Low	109 Å²	109	66.8 Å²	66.8	56%	0.559	33%	0.325	S	S	*	.	H	α-helix	trans	-72.3	-39	176.6	-60.6	173.1	0	0	0	110.8	N151 L156 K157	N151-I153 VanDerWaalsContact C-N 3.34Å; N151-I153 PolarHBondContact O-N 3.02Å; N151-I153 VanDerWaalsContact OD1-CA 3.23Å; N151-I153 WeakPolarHBondContact OD1-CA 3.43Å; N151-I153 VanDerWaalsContact OD1-CB 3.27Å; N151-I153 WeakPolarHBondContact OD1-CB 3.37Å; N151-I153 PolarHBondContact OD1-N 2.89Å; I153-L156 PolarHBondContact O-N 3.12Å; I153-K157 WeakPolarHBondContact O-CB 3.35Å; I153-K157 WeakPolarHBondContact O-CG 3.49Å; I153-K157 PolarHBondContact O-N 2.89Å
154	S	58.1	Low	62.3	Low	14 Å²	14	67.3 Å²	67.3	10%	0.098	33%	0.332	C	S	.	.	H	α-helix	trans	-69.6	-38.1	174.3	-64	0	0	0	0	110.4	T145 D149 N151 L156 K157 G158	T145-S154 VanDerWaalsContact CG2-O 3.32Å; T145-S154 WeakPolarHBondContact CG2-O 3.45Å; D149-S154 VanDerWaalsContact CG-OG 3.26Å; D149-S154 WeakPolarHBondContact OD2-CB 3.4Å; D149-S154 PolarHBondContact OD2-OG 3.34Å; N151-S154 PolarHBondContact ND2-OG 2.99Å; N151-S154 VanDerWaalsContact ND2-OG 3.12Å; N151-S154 PolarHBondContact O-N 3.19Å; N151-S154 PolarHBondContact OD1-N 3.44Å; N151-S154 PolarHBondContact OD1-OG 3.09Å; S154-L156 PolarHBondContact O-N 3.29Å; S154-K157 PolarHBondContact O-N 3.07Å; S154-G158 PolarHBondContact O-N 3.35Å
155	F	53.2	Low	62.3	Low	48 Å²	48	67.3 Å²	67.3	21%	0.211	33%	0.332	C	S	.	.	H	α-helix	trans	-56.9	-46.5	166.1	-176.1	-85.2	0	0	0	112	F146 N151 L152 G158 A159 V212	F146-F155 HydrophobicContact CD1-CD2 4.44Å; F146-F155 AromaticContact CE1-CD2 3.6Å; F146-F155 HydrophobicContact CE1-CD2 3.6Å; F146-F155 AromaticContact CE1-CE2 3.8Å; F146-F155 HydrophobicContact CE1-CE2 3.8Å; F146-F155 HydrophobicContact CE1-CG 4.49Å; F146-F155 HydrophobicContact CZ-CD2 4.48Å; F146-F155 HydrophobicContact CZ-CE2 4.41Å; N151-F155 WeakPolarHBondContact O-CB 3.19Å; N151-F155 PolarHBondContact O-N 3.25Å; L152-F155 WeakPolarHBondContact O-CB 3.44Å; F155-G158 CarbonylContact O-C 3.58Å; F155-G158 PolarHBondContact O-N 2.85Å; F155-A159 WeakPolarHBondContact O-CB 3.36Å; F155-A159 PolarHBondContact O-N 2.91Å; F155-V212 HydrophobicContact CE1-CG1 4.08Å; F155-V212 HydrophobicContact CE2-CG1 4.04Å; F155-V212 HydrophobicContact CZ-CG1 3.29Å; F155-V212 HydrophobicContact CZ-CG2 4.48Å
156	L	48	Very low	62.4	Low	95 Å²	95	68.7 Å²	68.7	50%	0.497	34%	0.336	S	S	.	.	H	α-helix	trans	-67.6	-42.8	178	-75.2	167.7	0	0	0	113	L152 I153 S154 G158 A159 I160	L152-L156 WeakPolarHBondContact O-CB 3.46Å; L152-L156 WeakPolarHBondContact O-CG 3.4Å; L152-L156 PolarHBondContact O-N 3.5Å; I153-L156 PolarHBondContact O-N 3.12Å; S154-L156 PolarHBondContact O-N 3.29Å; L156-G158 VanDerWaalsContact C-N 3.29Å; L156-G158 PolarHBondContact O-N 2.85Å; L156-A159 WeakPolarHBondContact O-CB 3.48Å; L156-A159 PolarHBondContact O-N 3.42Å; L156-A159 VanDerWaalsContact O-N 3.14Å; L156-I160 WeakPolarHBondContact O-CG1 3.25Å; L156-I160 PolarHBondContact O-N 3.41Å
157	K	63.3	Low	63.2	Low	119 Å²	119	70 Å²	70	52%	0.517	34%	0.344	S	S	.	.	H	α-helix	trans	-60.6	-42	172.6	-76.3	177.6	179.6	176.6	0	110.6	I153 S154 I160 R161	I153-K157 WeakPolarHBondContact O-CB 3.35Å; I153-K157 WeakPolarHBondContact O-CG 3.49Å; I153-K157 PolarHBondContact O-N 2.89Å; S154-K157 PolarHBondContact O-N 3.07Å; K157-I160 PolarHBondContact O-N 2.96Å; K157-R161 WeakPolarHBondContact O-CG 3.06Å; K157-R161 PolarHBondContact O-N 3.05Å; K157-R161 VanDerWaalsContact O-N 3.12Å
158	G	65.2	Low	64.4	Low	0 Å²	0	67.5 Å²	67.5	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-56.5	-48.7	170	0	0	0	0	0	111.4	S154 F155 L156 I160 R161 I162	S154-G158 PolarHBondContact O-N 3.35Å; F155-G158 CarbonylContact O-C 3.58Å; F155-G158 PolarHBondContact O-N 2.85Å; L156-G158 VanDerWaalsContact C-N 3.29Å; L156-G158 PolarHBondContact O-N 2.85Å; G158-I160 PolarHBondContact O-N 3.28Å; G158-R161 PolarHBondContact O-N 3.44Å; G158-I162 WeakPolarHBondContact O-CB 3.5Å; G158-I162 WeakPolarHBondContact O-CG1 3.26Å; G158-I162 PolarHBondContact O-N 3.34Å
159	A	63.6	Low	65.6	Low	18 Å²	18	62.4 Å²	62.4	15%	0.149	31%	0.305	C	S	.	.	H	α-helix	trans	-62.1	-39.9	179.4	0	0	0	0	0	113.6	F155 L156 I162 R163	F155-A159 WeakPolarHBondContact O-CB 3.36Å; F155-A159 PolarHBondContact O-N 2.91Å; L156-A159 WeakPolarHBondContact O-CB 3.48Å; L156-A159 PolarHBondContact O-N 3.42Å; L156-A159 VanDerWaalsContact O-N 3.14Å; A159-I162 WeakPolarHBondContact O-CB 3.33Å; A159-I162 PolarHBondContact O-N 3.31Å; A159-R163 PolarHBondContact O-N 3.21Å
160	I	67.4	Low	67.3	Low	120 Å²	120	65 Å²	65	62%	0.615	32%	0.315	S	S	*	.	H	α-helix	trans	-63.8	-44.7	174.5	-67.3	169.5	0	0	0	110.3	L156 K157 G158 R163 S164	L156-I160 WeakPolarHBondContact O-CG1 3.25Å; L156-I160 PolarHBondContact O-N 3.41Å; K157-I160 PolarHBondContact O-N 2.96Å; G158-I160 PolarHBondContact O-N 3.28Å; I160-R163 WeakPolarHBondContact O-CB 3.32Å; I160-R163 PolarHBondContact O-N 3.42Å; I160-R163 VanDerWaalsContact O-N 3.14Å; I160-S164 PolarHBondContact O-N 3.16Å
161	R	71.1	Confident	69.3	Low	65 Å²	65	60.2 Å²	60.2	25%	0.245	29%	0.292	C	S	.	.	H	α-helix	trans	-64.4	-39.9	177	-69.7	173.8	-179.4	175.4	0.2	112.1	A142 T145 K157 G158 R163 S164 C165	A142-R161 HydrophobicContact CB-CB 4.26Å; T145-R161 PolarHBondContact OG1-NH1 3.41Å; K157-R161 WeakPolarHBondContact O-CG 3.06Å; K157-R161 PolarHBondContact O-N 3.05Å; K157-R161 VanDerWaalsContact O-N 3.12Å; G158-R161 PolarHBondContact O-N 3.44Å; R161-R163 PolarHBondContact O-N 3.07Å; R161-S164 PolarHBondContact O-N 2.86Å; R161-C165 WeakPolarHBondContact O-CB 3.49Å; R161-C165 PolarHBondContact O-N 2.9Å
162	I	71.9	Confident	71.2	Confident	24 Å²	24	57.9 Å²	57.9	12%	0.123	28%	0.279	C	S	.	.	H	α-helix	trans	-54.3	-41.3	171.8	-79.7	169.3	0	0	0	110.3	A142 F146 G158 A159 Y166 F201 F221	A142-I162 HydrophobicContact CB-CG1 4.02Å; F146-I162 HydrophobicContact CE2-CD1 3.95Å; F146-I162 HydrophobicContact CZ-CD1 3.89Å; G158-I162 WeakPolarHBondContact O-CB 3.5Å; G158-I162 WeakPolarHBondContact O-CG1 3.26Å; G158-I162 PolarHBondContact O-N 3.34Å; A159-I162 WeakPolarHBondContact O-CB 3.33Å; A159-I162 PolarHBondContact O-N 3.31Å; I162-Y166 VanDerWaalsContact O-CB 3.32Å; I162-Y166 WeakPolarHBondContact O-CB 3.07Å; I162-Y166 PolarHBondContact O-N 3.49Å; I162-F201 HydrophobicContact CB-CE2 4.13Å; I162-F201 HydrophobicContact CG1-CE2 4.44Å; I162-F201 HydrophobicContact CG2-CE2 3.37Å; I162-F201 HydrophobicContact CG2-CZ 3.47Å; I162-F201 VanDerWaalsContact CG2-CZ 3.47Å; I162-F201 WeakPolarHBondContact O-CE2 3.47Å; I162-F221 HydrophobicContact CG2-CZ 4.42Å
163	R	75.8	Confident	73.7	Confident	123 Å²	123	54.8 Å²	54.8	46%	0.464	26%	0.261	S	S	.	.	H	α-helix	trans	-65.6	-49.5	176.6	-174.8	176.7	178.1	146	0.9	113.3	A159 I160 R161 C165 Y166 Q167 F221	A159-R163 PolarHBondContact O-N 3.21Å; I160-R163 WeakPolarHBondContact O-CB 3.32Å; I160-R163 PolarHBondContact O-N 3.42Å; I160-R163 VanDerWaalsContact O-N 3.14Å; R161-R163 PolarHBondContact O-N 3.07Å; R163-C165 VanDerWaalsContact C-N 3.32Å; R163-C165 PolarHBondContact O-N 3.42Å; R163-Y166 PolarHBondContact O-N 3.04Å; R163-Q167 WeakPolarHBondContact O-CG 3.23Å; R163-Q167 PolarHBondContact O-N 3.43Å; R163-F221 HydrophobicContact CB-CZ 3.8Å; R163-F221 HydrophobicContact CG-CZ 4Å
164	S	79.8	Confident	75.8	Confident	51 Å²	51	55.8 Å²	55.8	36%	0.357	26%	0.264	S	S	.	.	H	α-helix	trans	-61.8	-43.9	178.2	-58.9	0	0	0	0	111.2	I160 R161 Y166 Q167 S168	I160-S164 PolarHBondContact O-N 3.16Å; R161-S164 PolarHBondContact O-N 2.86Å; S164-Y166 PolarHBondContact O-N 2.92Å; S164-Q167 PolarHBondContact O-N 3.43Å; S164-S168 PolarHBondContact O-N 3.32Å; S164-S168 PolarHBondContact O-OG 3.43Å
165	C	83.6	Confident	77.5	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-55.5	-50.1	174.6	175.4	0	0	0	0	111.9	A135 L138 R161 R163 Q167 S168 Y169	A135-C165 PolarHBondContact O-SG 3.46Å; L138-C165 HydrophobicContact CB-CB 3.99Å; R161-C165 WeakPolarHBondContact O-CB 3.49Å; R161-C165 PolarHBondContact O-N 2.9Å; R163-C165 VanDerWaalsContact C-N 3.32Å; R163-C165 PolarHBondContact O-N 3.42Å; C165-Q167 PolarHBondContact O-N 3.14Å; C165-S168 PolarHBondContact O-N 3.28Å; C165-Y169 VanDerWaalsContact O-CD2 3.31Å; C165-Y169 WeakPolarHBondContact O-CD2 3.37Å; C165-Y169 PolarHBondContact O-N 3.5Å; C165-Y169 WeakPolarHBondContact SG-CE2 3.27Å
166	Y	81.6	Confident	79.3	Confident	39 Å²	39	55.3 Å²	55.3	15%	0.153	26%	0.259	C	S	.	.	H	α-helix	trans	-62	-40.3	177.9	-178.5	-112.4	0	0	0	113.5	I162 R163 S164 S168 Y169 K170 F201 F221	I162-Y166 VanDerWaalsContact O-CB 3.32Å; I162-Y166 WeakPolarHBondContact O-CB 3.07Å; I162-Y166 PolarHBondContact O-N 3.49Å; R163-Y166 PolarHBondContact O-N 3.04Å; S164-Y166 PolarHBondContact O-N 2.92Å; Y166-S168 VanDerWaalsContact C-N 3.32Å; Y166-S168 PolarHBondContact O-N 3.35Å; Y166-Y169 PolarHBondContact O-N 3.28Å; Y166-K170 HydrophobicContact CD1-CD 4.22Å; Y166-K170 HydrophobicContact CE1-CD 3.65Å; Y166-K170 VanDerWaalsContact CE1-CE 3.41Å; Y166-K170 HydrophobicContact CE1-CG 4.21Å; Y166-K170 HydrophobicContact CE2-CG 4.46Å; Y166-K170 PolarHBondContact O-N 2.84Å; Y166-K170 WeakPolarHBondContact OH-CE 3.17Å; Y166-K170 PolarHBondContact OH-NZ 2.8Å; Y166-F201 AromaticContact CD2-CD1 3.55Å; Y166-F201 HydrophobicContact CD2-CD1 3.55Å; Y166-F201 AromaticContact CD2-CE1 3.19Å; Y166-F201 HydrophobicContact CD2-CE1 3.19Å; Y166-F201 HydrophobicContact CD2-CG 4.4Å; Y166-F201 AromaticContact CD2-CZ 3.82Å; Y166-F201 HydrophobicContact CD2-CZ 3.82Å; Y166-F201 HydrophobicContact CE2-CD1 4.03Å; Y166-F201 AromaticContact CE2-CE1 3.78Å; Y166-F201 HydrophobicContact CE2-CE1 3.78Å; Y166-F201 HydrophobicContact CG-CD1 4.46Å; Y166-F201 AromaticContact CG-CE1 3.74Å; Y166-F201 HydrophobicContact CG-CE1 3.74Å; Y166-F201 AromaticContact CG-CZ 3.92Å; Y166-F201 HydrophobicContact CG-CZ 3.92Å; Y166-F221 AromaticContact CD1-CD1 3.8Å; Y166-F221 HydrophobicContact CD1-CD1 3.8Å; Y166-F221 AromaticContact CD1-CE1 3.46Å; Y166-F221 HydrophobicContact CD1-CE1 3.46Å; Y166-F221 VanDerWaalsContact CD1-CE1 3.46Å; Y166-F221 HydrophobicContact CD2-CD1 4.43Å; Y166-F221 HydrophobicContact CD2-CE1 4.46Å; Y166-F221 AromaticContact CE1-CD1 3.97Å; Y166-F221 HydrophobicContact CE1-CD1 3.97Å; Y166-F221 HydrophobicContact CE1-CE1 4.09Å; Y166-F221 HydrophobicContact CG-CD1 4Å; Y166-F221 AromaticContact CG-CE1 3.65Å; Y166-F221 HydrophobicContact CG-CE1 3.65Å
167	Q	84.1	Confident	81.3	Confident	106 Å²	106	58 Å²	58	50%	0.495	27%	0.267	S	S	.	.	H	α-helix	trans	-62.7	-41.2	176.3	-73.8	177.7	-22.6	0	0	111.4	R163 S164 C165 K170 K171	R163-Q167 WeakPolarHBondContact O-CG 3.23Å; R163-Q167 PolarHBondContact O-N 3.43Å; S164-Q167 PolarHBondContact O-N 3.43Å; C165-Q167 PolarHBondContact O-N 3.14Å; Q167-K170 PolarHBondContact O-N 3.05Å; Q167-K171 PolarHBondContact O-N 3.31Å
168	S	87.1	Confident	82.6	Confident	10 Å²	10	56.1 Å²	56.1	7%	0.07	27%	0.273	C	S	.	.	H	α-helix	trans	-63.4	-43.6	173.6	-66.8	0	0	0	0	112	S164 C165 Y166 K170 K171 C172	S164-S168 PolarHBondContact O-N 3.32Å; S164-S168 PolarHBondContact O-OG 3.43Å; C165-S168 PolarHBondContact O-N 3.28Å; Y166-S168 VanDerWaalsContact C-N 3.32Å; Y166-S168 PolarHBondContact O-N 3.35Å; S168-K170 PolarHBondContact O-N 2.94Å; S168-K171 WeakPolarHBondContact O-CB 3.28Å; S168-K171 PolarHBondContact O-N 2.98Å; S168-C172 PolarHBondContact O-N 2.91Å; S168-C172 PolarHBondContact O-SG 3.14Å
169	Y	88.9	Confident	83.8	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.008	28%	0.28	C	S	.	.	H	α-helix	trans	-64.4	-39.8	175.8	-81.7	-64.4	0	0	0	113.4	L132 A135 E136 L139 C165 Y166 K171 C172 Q173 G197	L132-Y169 HydrophobicContact CD1-CD1 4.44Å; L132-Y169 HydrophobicContact CD1-CE1 3.77Å; A135-Y169 HydrophobicContact CB-CD1 4.39Å; A135-Y169 HydrophobicContact CB-CD2 4.01Å; A135-Y169 HydrophobicContact CB-CE1 4.13Å; A135-Y169 HydrophobicContact CB-CE2 3.74Å; A135-Y169 HydrophobicContact CB-CG 4.31Å; E136-Y169 WeakPolarHBondContact CA-OH 3.49Å; E136-Y169 WeakPolarHBondContact CG-OH 3.36Å; E136-Y169 PolarHBondContact N-OH 2.6Å; L139-Y169 HydrophobicContact CD2-CE2 4.38Å; C165-Y169 VanDerWaalsContact O-CD2 3.31Å; C165-Y169 WeakPolarHBondContact O-CD2 3.37Å; C165-Y169 PolarHBondContact O-N 3.5Å; C165-Y169 WeakPolarHBondContact SG-CE2 3.27Å; Y166-Y169 PolarHBondContact O-N 3.28Å; Y169-K171 VanDerWaalsContact C-N 3.31Å; Y169-K171 PolarHBondContact O-N 2.74Å; Y169-C172 PolarHBondContact O-N 3.14Å; Y169-Q173 WeakPolarHBondContact O-CB 3.38Å; Y169-Q173 PolarHBondContact O-N 3.12Å; Y169-G197 WeakPolarHBondContact OH-CA 3.48Å
170	K	86.8	Confident	85	Confident	90 Å²	90	61.1 Å²	61.1	39%	0.391	30%	0.304	S	S	.	.	H	α-helix	trans	-59.3	-43.4	173.6	-87.3	-168.8	160.9	167.8	0	112.2	Y166 Q167 S168 Q173 Q174	Y166-K170 HydrophobicContact CD1-CD 4.22Å; Y166-K170 HydrophobicContact CE1-CD 3.65Å; Y166-K170 VanDerWaalsContact CE1-CE 3.41Å; Y166-K170 HydrophobicContact CE1-CG 4.21Å; Y166-K170 HydrophobicContact CE2-CG 4.46Å; Y166-K170 PolarHBondContact O-N 2.84Å; Y166-K170 WeakPolarHBondContact OH-CE 3.17Å; Y166-K170 PolarHBondContact OH-NZ 2.8Å; Q167-K170 PolarHBondContact O-N 3.05Å; S168-K170 PolarHBondContact O-N 2.94Å; K170-Q173 PolarHBondContact O-N 3.35Å; K170-Q174 WeakPolarHBondContact O-CG 3.22Å; K170-Q174 PolarHBondContact O-N 3.38Å
171	K	88.6	Confident	86.2	Confident	51 Å²	51	57 Å²	57	22%	0.222	28%	0.281	C	S	.	.	H	α-helix	trans	-59.3	-49.4	173.9	-176.2	-179.2	176.8	-177.8	0	110.1	F123 E131 Q167 S168 Y169 Q173 Q174 Y175	F123-K171 VanDerWaalsContact CE1-NZ 3.3Å; E131-K171 IonicContact OE1-NZ 3.68Å; E131-K171 PolarHBondContact OE1-NZ 3.25Å; Q167-K171 PolarHBondContact O-N 3.31Å; S168-K171 WeakPolarHBondContact O-CB 3.28Å; S168-K171 PolarHBondContact O-N 2.98Å; Y169-K171 VanDerWaalsContact C-N 3.31Å; Y169-K171 PolarHBondContact O-N 2.74Å; K171-Q173 VanDerWaalsContact C-N 3.33Å; K171-Q173 PolarHBondContact O-N 3.1Å; K171-Q174 PolarHBondContact O-N 3.33Å; K171-Y175 HydrophobicContact CG-CD2 3.8Å; K171-Y175 HydrophobicContact CG-CE2 3.8Å; K171-Y175 VanDerWaalsContact O-CD2 3.26Å; K171-Y175 WeakPolarHBondContact O-CD2 3.34Å; K171-Y175 PolarHBondContact O-N 3.15Å
172	C	93.1	Very high	86.9	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.007	31%	0.305	C	S	.	.	H	α-helix	trans	-60.4	-41.3	178.9	-62	0	0	0	0	112.5	S168 Y169 Q174 Y175 L176 F190 V194	S168-C172 PolarHBondContact O-N 2.91Å; S168-C172 PolarHBondContact O-SG 3.14Å; Y169-C172 PolarHBondContact O-N 3.14Å; C172-Q174 PolarHBondContact O-N 2.86Å; C172-Y175 PolarHBondContact O-N 3.18Å; C172-L176 WeakPolarHBondContact O-CB 3.5Å; C172-L176 PolarHBondContact O-N 2.76Å; C172-F190 HydrophobicContact CB-CE1 4.19Å; C172-F190 HydrophobicContact CB-CE2 4.34Å; C172-F190 HydrophobicContact CB-CZ 3.56Å; C172-F190 WeakPolarHBondContact O-CE1 3.32Å; C172-V194 HydrophobicContact CB-CG2 3.59Å
173	Q	91.2	Very high	87.7	Confident	65 Å²	65	63.7 Å²	63.7	30%	0.304	32%	0.316	S	S	.	.	H	α-helix	trans	-63.6	-38.7	177.2	-173	179.5	19.7	0	0	112.6	Y169 K170 K171 F177 V194 Y227	Y169-Q173 WeakPolarHBondContact O-CB 3.38Å; Y169-Q173 PolarHBondContact O-N 3.12Å; K170-Q173 PolarHBondContact O-N 3.35Å; K171-Q173 VanDerWaalsContact C-N 3.33Å; K171-Q173 PolarHBondContact O-N 3.1Å; Q173-F177 WeakPolarHBondContact O-CD2 3.3Å; Q173-V194 HydrophobicContact CB-CG1 4.14Å; Q173-Y227 PolarHBondContact NE2-OH 2.9Å
174	Q	90.1	Very high	88.5	Confident	131 Å²	131	62.9 Å²	62.9	61%	0.612	32%	0.317	S	S	*	.	H	α-helix	trans	-64.2	-48.8	175.2	-72.4	172.1	-14.2	0	0	111.1	K170 K171 C172 L176 F177 A178	K170-Q174 WeakPolarHBondContact O-CG 3.22Å; K170-Q174 PolarHBondContact O-N 3.38Å; K171-Q174 PolarHBondContact O-N 3.33Å; C172-Q174 PolarHBondContact O-N 2.86Å; Q174-L176 VanDerWaalsContact C-N 3.33Å; Q174-L176 PolarHBondContact O-N 3.18Å; Q174-F177 PolarHBondContact O-N 3.44Å; Q174-A178 WeakPolarHBondContact O-CB 3.48Å; Q174-A178 PolarHBondContact O-N 2.96Å; Q174-A178 VanDerWaalsContact O-N 3.13Å
175	Y	92.3	Very high	89.1	Confident	44 Å²	44	62.6 Å²	62.6	17%	0.173	32%	0.319	C	S	.	.	H	α-helix	trans	-72.9	-22.4	-178.7	-76.4	-72.9	0	0	0	113.8	D121 F123 L128 K171 C172 F177 A178 H179	D121-Y175 WeakPolarHBondContact CB-OH 3.41Å; D121-Y175 PolarHBondContact OD2-OH 3.35Å; F123-Y175 HydrophobicContact CD2-CD1 4.09Å; F123-Y175 HydrophobicContact CD2-CD2 4.43Å; F123-Y175 AromaticContact CD2-CE1 3.56Å; F123-Y175 HydrophobicContact CD2-CE1 3.56Å; F123-Y175 AromaticContact CD2-CE2 3.95Å; F123-Y175 HydrophobicContact CD2-CE2 3.95Å; F123-Y175 AromaticContact CD2-CZ 3.49Å; F123-Y175 VanDerWaalsContact CD2-CZ 3.49Å; F123-Y175 HydrophobicContact CE2-CD2 4.5Å; F123-Y175 AromaticContact CE2-CE1 3.97Å; F123-Y175 HydrophobicContact CE2-CE1 3.97Å; F123-Y175 AromaticContact CE2-CE2 3.69Å; F123-Y175 HydrophobicContact CE2-CE2 3.69Å; F123-Y175 AromaticContact CE2-CZ 3.39Å; F123-Y175 WeakPolarHBondContact CE2-OH 3.34Å; F123-Y175 HydrophobicContact CZ-CE2 4.41Å; L128-Y175 HydrophobicContact CD2-CD1 4.33Å; L128-Y175 HydrophobicContact CD2-CD2 4.05Å; L128-Y175 HydrophobicContact CD2-CG 3.72Å; K171-Y175 HydrophobicContact CG-CD2 3.8Å; K171-Y175 HydrophobicContact CG-CE2 3.8Å; K171-Y175 VanDerWaalsContact O-CD2 3.26Å; K171-Y175 WeakPolarHBondContact O-CD2 3.34Å; K171-Y175 PolarHBondContact O-N 3.15Å; C172-Y175 PolarHBondContact O-N 3.18Å; Y175-F177 PolarHBondContact O-N 3.26Å; Y175-F177 VanDerWaalsContact O-N 3.16Å; Y175-A178 PolarHBondContact O-N 3.35Å; Y175-H179 WeakPolarHBondContact O-CB 3.42Å; Y175-H179 PolarHBondContact O-N 3.01Å
176	L	92.3	Very high	89.6	Confident	7 Å²	7	62.8 Å²	62.8	4%	0.037	32%	0.319	C	S	.	.	H	α-helix	trans	-52.7	-38.6	173	174.8	61.3	0	0	0	112.4	C172 Q174 W181 F190 E191	C172-L176 WeakPolarHBondContact O-CB 3.5Å; C172-L176 PolarHBondContact O-N 2.76Å; Q174-L176 VanDerWaalsContact C-N 3.33Å; Q174-L176 PolarHBondContact O-N 3.18Å; L176-W181 PolarHBondContact O-NE1 3.22Å; L176-F190 HydrophobicContact CB-CD1 4.39Å; L176-F190 HydrophobicContact CB-CE1 4.11Å; L176-F190 HydrophobicContact CD1-CD1 4Å; L176-E191 HydrophobicContact CD1-CB 3.68Å; L176-E191 HydrophobicContact CD1-CG 4.11Å; L176-E191 HydrophobicContact CD2-CB 4.33Å; L176-E191 HydrophobicContact CD2-CG 3.95Å
177	F	90	Very high	90.3	Very high	153 Å²	153	64.3 Å²	64.3	67%	0.671	33%	0.325	S	S	*	.	H	α-helix	trans	-100.2	-30.6	-179.5	-58.2	-72.6	0	0	0	113.9	Q173 Q174 Y175	Q173-F177 WeakPolarHBondContact O-CD2 3.3Å; Q174-F177 PolarHBondContact O-N 3.44Å; Y175-F177 PolarHBondContact O-N 3.26Å; Y175-F177 VanDerWaalsContact O-N 3.16Å
178	A	89.8	Confident	90.9	Very high	78 Å²	78	59.4 Å²	59.4	65%	0.645	30%	0.303	S	S	*	.	H	α-helix	trans	-84.6	-21.5	-177	0	0	0	0	0	113.6	Q174 Y175	Q174-A178 WeakPolarHBondContact O-CB 3.48Å; Q174-A178 PolarHBondContact O-N 2.96Å; Q174-A178 VanDerWaalsContact O-N 3.13Å; Y175-A178 PolarHBondContact O-N 3.35Å
179	H	89.8	Confident	91.4	Very high	32 Å²	32	59.5 Å²	59.5	15%	0.148	30%	0.302	C	S	.	.	S	Bend	trans	-82.8	143	-176.5	-173.1	53.8	0	0	0	112.7	F123 D125 L128 Y175 W181	F123-H179 PolarHBondContact O-CE1 3.34Å; D125-H179 IonicContact OD1-CD2 3.74Å; D125-H179 IonicContact OD1-CE1 3.45Å; D125-H179 IonicContact OD1-NE2 2.72Å; D125-H179 PolarHBondContact OD1-NE2 2.95Å; L128-H179 HydrophobicContact CD1-CB 3.83Å; L128-H179 WeakPolarHBondContact CD1-CD2 3.22Å; L128-H179 VanDerWaalsContact CD1-CG 3.48Å; Y175-H179 WeakPolarHBondContact O-CB 3.42Å; Y175-H179 PolarHBondContact O-N 3.01Å; H179-W181 AromaticContact CD2-CD2 3.71Å; H179-W181 AromaticContact CD2-CE2 3.77Å; H179-W181 VanDerWaalsContact O-CD1 3.24Å; H179-W181 PolarHBondContact O-N 2.94Å
180	S	90.3	Very high	91.8	Very high	91 Å²	91	59.4 Å²	59.4	64%	0.636	30%	0.301	S	S	*	.			trans	-91.5	89.5	174.8	-64.2	0	0	0	0	110.3	Q182	S180-Q182 PolarHBondContact O-NE2 3.06Å; S180-Q182 VanDerWaalsContact O-NE2 3.15Å
181	W	91.5	Very high	92.3	Very high	35 Å²	35	56.9 Å²	56.9	13%	0.133	29%	0.291	C	S	.	.			trans	-65.8	136	-179.3	-62	89.8	0	0	0	112.3	D125 L128 H129 L176 H179 V186 R187 F190	D125-W181 HydrophobicContact CB-CZ3 4.43Å; L128-W181 HydrophobicContact CB-CH2 4.29Å; L128-W181 HydrophobicContact CD1-CH2 3.79Å; L128-W181 HydrophobicContact CD1-CZ2 3.93Å; L128-W181 HydrophobicContact CD1-CZ3 4.49Å; H129-W181 AromaticContact NE2-CZ3 3.78Å; L176-W181 PolarHBondContact O-NE1 3.22Å; H179-W181 AromaticContact CD2-CD2 3.71Å; H179-W181 AromaticContact CD2-CE2 3.77Å; H179-W181 VanDerWaalsContact O-CD1 3.24Å; H179-W181 PolarHBondContact O-N 2.94Å; W181-V186 HydrophobicContact CE3-CG1 4.28Å; W181-V186 HydrophobicContact CZ3-CG1 4.15Å; W181-R187 HydrophobicContact CB-CB 3.93Å; W181-R187 HydrophobicContact CB-CG 4.28Å; W181-R187 HydrophobicContact CD2-CB 3.52Å; W181-R187 HydrophobicContact CD2-CG 3.63Å; W181-R187 HydrophobicContact CE3-CB 3.78Å; W181-R187 HydrophobicContact CE3-CG 4.33Å; W181-R187 HydrophobicContact CG-CB 3.58Å; W181-R187 HydrophobicContact CG-CG 3.57Å; W181-F190 HydrophobicContact CH2-CB 3.51Å; W181-F190 AromaticContact CH2-CD1 3.36Å; W181-F190 HydrophobicContact CH2-CD1 3.36Å; W181-F190 AromaticContact CH2-CD2 3.82Å; W181-F190 HydrophobicContact CH2-CD2 3.82Å; W181-F190 AromaticContact CH2-CE1 3.93Å; W181-F190 HydrophobicContact CH2-CE1 3.93Å; W181-F190 HydrophobicContact CH2-CE2 4.35Å; W181-F190 AromaticContact CH2-CG 3.28Å; W181-F190 HydrophobicContact CH2-CG 3.28Å; W181-F190 HydrophobicContact CH2-CZ 4.39Å; W181-F190 HydrophobicContact CZ2-CB 4.17Å; W181-F190 AromaticContact CZ2-CD1 3.37Å; W181-F190 HydrophobicContact CZ2-CD1 3.37Å; W181-F190 AromaticContact CZ2-CE1 3.81Å; W181-F190 HydrophobicContact CZ2-CE1 3.81Å; W181-F190 AromaticContact CZ2-CG 3.83Å; W181-F190 HydrophobicContact CZ2-CG 3.83Å; W181-F190 HydrophobicContact CZ3-CB 4Å; W181-F190 HydrophobicContact CZ3-CG 4.2Å
182	Q	86.5	Confident	92.8	Very high	162 Å²	162	54.5 Å²	54.5	76%	0.757	28%	0.281	S	S	*	.	S	Bend	trans	-87	-26.3	179.8	-56.9	-57.2	-45.5	0	0	112.6	D125 S180	D125-Q182 PolarHBondContact OD2-N 3.05Å; S180-Q182 PolarHBondContact O-NE2 3.06Å; S180-Q182 VanDerWaalsContact O-NE2 3.15Å
183	D	89.6	Confident	93	Very high	66 Å²	66	54.4 Å²	54.4	35%	0.353	28%	0.28	S	S	.	.			trans	-134.9	125.6	179.5	-179.1	-9.5	0	0	0	109.9	A185 V186 R187	D183-A185 VanDerWaalsContact C-N 3.29Å; D183-A185 PolarHBondContact O-N 3.39Å; D183-A185 WeakPolarHBondContact OD1-CB 3.36Å; D183-A185 PolarHBondContact OD1-N 3.45Å; D183-V186 HydrophobicContact CB-CB 4.04Å; D183-V186 HydrophobicContact CB-CG2 3.8Å; D183-V186 PolarHBondContact O-N 3.12Å; D183-R187 PolarHBondContact O-N 2.77Å
184	E	91.8	Very high	93.3	Very high	106 Å²	106	51.6 Å²	51.6	50%	0.495	27%	0.267	S	S	.	.	H	α-helix	trans	-67.8	-28.6	-179.9	-172.4	62.6	-159.8	0	0	112.3	R187 S188	E184-R187 IonicContact OE1-CZ 2.82Å; E184-R187 IonicContact OE1-NH1 2.87Å; E184-R187 PolarHBondContact OE1-NH1 3.42Å; E184-R187 WeakPolarHBondContact OE2-CD 3.25Å; E184-R187 IonicContact OE2-CZ 2.78Å; E184-R187 IonicContact OE2-NH1 2.77Å; E184-R187 PolarHBondContact OE2-NH1 3.13Å; E184-S188 WeakPolarHBondContact O-CB 3.34Å; E184-S188 PolarHBondContact O-N 3.18Å; E184-S188 PolarHBondContact O-OG 3.1Å
185	A	91.8	Very high	93.6	Very high	46 Å²	46	46.5 Å²	46.5	38%	0.38	24%	0.243	S	C	.	.	H	α-helix	trans	-66.5	-47.4	174.2	0	0	0	0	0	110.4	D183 R187 S188 H189	D183-A185 VanDerWaalsContact C-N 3.29Å; D183-A185 PolarHBondContact O-N 3.39Å; D183-A185 WeakPolarHBondContact OD1-CB 3.36Å; D183-A185 PolarHBondContact OD1-N 3.45Å; A185-R187 VanDerWaalsContact C-N 3.35Å; A185-R187 PolarHBondContact O-N 3.03Å; A185-S188 WeakPolarHBondContact O-CB 3.25Å; A185-S188 PolarHBondContact O-N 3.27Å; A185-S188 VanDerWaalsContact O-N 3.13Å; A185-H189 PolarHBondContact O-CD2 3.32Å; A185-H189 PolarHBondContact O-N 2.88Å
186	V	94.4	Very high	93.9	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.018	24%	0.239	C	C	.	.	H	α-helix	trans	-56.8	-49.3	175	174.2	0	0	0	0	110.4	L26 V27 D125 H129 W181 D183 S188 H189 F190	L26-V186 HydrophobicContact CD2-CG1 3.74Å; V27-V186 HydrophobicContact CG2-CG2 3.47Å; V27-V186 VanDerWaalsContact CG2-CG2 3.47Å; D125-V186 HydrophobicContact CB-CG1 4.07Å; H129-V186 PolarHBondContact CE1-O 3.38Å; H129-V186 WeakPolarHBondContact NE2-CG1 3.43Å; H129-V186 PolarHBondContact NE2-O 2.9Å; W181-V186 HydrophobicContact CE3-CG1 4.28Å; W181-V186 HydrophobicContact CZ3-CG1 4.15Å; D183-V186 HydrophobicContact CB-CB 4.04Å; D183-V186 HydrophobicContact CB-CG2 3.8Å; D183-V186 PolarHBondContact O-N 3.12Å; V186-S188 VanDerWaalsContact C-N 3.31Å; V186-S188 PolarHBondContact O-N 2.87Å; V186-H189 PolarHBondContact O-N 3.08Å; V186-F190 PolarHBondContact O-N 3.17Å
187	R	96	Very high	93.9	Very high	71 Å²	71	44.8 Å²	44.8	27%	0.268	24%	0.237	S	C	.	.	H	α-helix	trans	-55.6	-43.6	174.5	-178.7	-179.2	176.9	-140	-6.2	112.9	W181 D183 E184 A185 F190 E191	W181-R187 HydrophobicContact CB-CB 3.93Å; W181-R187 HydrophobicContact CB-CG 4.28Å; W181-R187 HydrophobicContact CD2-CB 3.52Å; W181-R187 HydrophobicContact CD2-CG 3.63Å; W181-R187 HydrophobicContact CE3-CB 3.78Å; W181-R187 HydrophobicContact CE3-CG 4.33Å; W181-R187 HydrophobicContact CG-CB 3.58Å; W181-R187 HydrophobicContact CG-CG 3.57Å; D183-R187 PolarHBondContact O-N 2.77Å; E184-R187 IonicContact OE1-CZ 2.82Å; E184-R187 IonicContact OE1-NH1 2.87Å; E184-R187 PolarHBondContact OE1-NH1 3.42Å; E184-R187 WeakPolarHBondContact OE2-CD 3.25Å; E184-R187 IonicContact OE2-CZ 2.78Å; E184-R187 IonicContact OE2-NH1 2.77Å; E184-R187 PolarHBondContact OE2-NH1 3.13Å; A185-R187 VanDerWaalsContact C-N 3.35Å; A185-R187 PolarHBondContact O-N 3.03Å; R187-F190 WeakPolarHBondContact O-CB 3.26Å; R187-F190 PolarHBondContact O-N 2.83Å; R187-E191 WeakPolarHBondContact O-CB 3.34Å; R187-E191 PolarHBondContact O-N 3.16Å
188	S	97	Very high	93.9	Very high	4 Å²	4	38 Å²	38	3%	0.028	21%	0.208	C	C	.	.	H	α-helix	trans	-67.7	-38.1	-178.9	-61.5	0	0	0	0	112.4	E184 A185 V186 F190 E191 S192 Y240 T241	E184-S188 WeakPolarHBondContact O-CB 3.34Å; E184-S188 PolarHBondContact O-N 3.18Å; E184-S188 PolarHBondContact O-OG 3.1Å; A185-S188 WeakPolarHBondContact O-CB 3.25Å; A185-S188 PolarHBondContact O-N 3.27Å; A185-S188 VanDerWaalsContact O-N 3.13Å; V186-S188 VanDerWaalsContact C-N 3.31Å; V186-S188 PolarHBondContact O-N 2.87Å; S188-F190 VanDerWaalsContact C-N 3.32Å; S188-E191 PolarHBondContact O-N 3.26Å; S188-S192 WeakPolarHBondContact O-CB 3.48Å; S188-S192 PolarHBondContact O-N 2.86Å; S188-S192 PolarHBondContact O-OG 3.4Å; S188-Y240 VanDerWaalsContact CB-CE2 3.43Å; S188-Y240 PolarHBondContact OG-OH 3.45Å; S188-T241 WeakPolarHBondContact O-CG2 3.47Å
189	H	97.2	Very high	94	Very high	11 Å²	11	34.3 Å²	34.3	5%	0.051	18%	0.177	C	C	.	.	H	α-helix	trans	-61.2	-42.9	171.5	-78.4	-74.1	0	0	0	111.3	I30 A185 V186 S192 G193 L242	I30-H189 HydrophobicContact CD1-CB 4.16Å; I30-H189 VanDerWaalsContact CG2-CE1 3.4Å; I30-H189 WeakPolarHBondContact CG2-CE1 3.49Å; I30-H189 WeakPolarHBondContact CG2-ND1 3.38Å; A185-H189 PolarHBondContact O-CD2 3.32Å; A185-H189 PolarHBondContact O-N 2.88Å; V186-H189 PolarHBondContact O-N 3.08Å; H189-S192 PolarHBondContact O-OG 3.4Å; H189-G193 PolarHBondContact O-N 2.64Å; H189-L242 PolarHBondContact CE1-N 3.2Å; H189-L242 VanDerWaalsContact CE1-N 3.3Å; H189-L242 PolarHBondContact ND1-N 2.84Å; H189-L242 VanDerWaalsContact ND1-N 3.14Å
190	F	97.7	Very high	94.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61.5	-51.2	174.2	-171.3	-102.8	0	0	0	112.3	L128 H129 L132 C172 L176 W181 V186 R187 S188 S192 G193 V194	L128-F190 HydrophobicContact CB-CD2 4.35Å; L128-F190 HydrophobicContact CB-CE2 3.76Å; L128-F190 HydrophobicContact CB-CZ 4.06Å; L128-F190 VanDerWaalsContact O-CE2 3.32Å; L128-F190 WeakPolarHBondContact O-CE2 3.21Å; H129-F190 AromaticContact CD2-CD2 3.9Å; L132-F190 HydrophobicContact CB-CD2 4.04Å; L132-F190 HydrophobicContact CB-CE2 3.67Å; L132-F190 HydrophobicContact CD2-CD2 3.58Å; L132-F190 HydrophobicContact CD2-CE2 4.01Å; L132-F190 HydrophobicContact CD2-CG 4.2Å; L132-F190 HydrophobicContact CG-CD2 4.44Å; L132-F190 HydrophobicContact CG-CE2 4.43Å; C172-F190 HydrophobicContact CB-CE1 4.19Å; C172-F190 HydrophobicContact CB-CE2 4.34Å; C172-F190 HydrophobicContact CB-CZ 3.56Å; C172-F190 WeakPolarHBondContact O-CE1 3.32Å; L176-F190 HydrophobicContact CB-CD1 4.39Å; L176-F190 HydrophobicContact CB-CE1 4.11Å; L176-F190 HydrophobicContact CD1-CD1 4Å; W181-F190 HydrophobicContact CH2-CB 3.51Å; W181-F190 AromaticContact CH2-CD1 3.36Å; W181-F190 HydrophobicContact CH2-CD1 3.36Å; W181-F190 AromaticContact CH2-CD2 3.82Å; W181-F190 HydrophobicContact CH2-CD2 3.82Å; W181-F190 AromaticContact CH2-CE1 3.93Å; W181-F190 HydrophobicContact CH2-CE1 3.93Å; W181-F190 HydrophobicContact CH2-CE2 4.35Å; W181-F190 AromaticContact CH2-CG 3.28Å; W181-F190 HydrophobicContact CH2-CG 3.28Å; W181-F190 HydrophobicContact CH2-CZ 4.39Å; W181-F190 HydrophobicContact CZ2-CB 4.17Å; W181-F190 AromaticContact CZ2-CD1 3.37Å; W181-F190 HydrophobicContact CZ2-CD1 3.37Å; W181-F190 AromaticContact CZ2-CE1 3.81Å; W181-F190 HydrophobicContact CZ2-CE1 3.81Å; W181-F190 AromaticContact CZ2-CG 3.83Å; W181-F190 HydrophobicContact CZ2-CG 3.83Å; W181-F190 HydrophobicContact CZ3-CB 4Å; W181-F190 HydrophobicContact CZ3-CG 4.2Å; V186-F190 PolarHBondContact O-N 3.17Å; R187-F190 WeakPolarHBondContact O-CB 3.26Å; R187-F190 PolarHBondContact O-N 2.83Å; S188-F190 VanDerWaalsContact C-N 3.32Å; F190-S192 VanDerWaalsContact C-N 3.33Å; F190-S192 PolarHBondContact O-N 3.33Å; F190-G193 PolarHBondContact O-N 3.3Å; F190-G193 VanDerWaalsContact O-N 3.1Å; F190-V194 HydrophobicContact CD1-CG2 3.93Å; F190-V194 HydrophobicContact CE1-CG2 3.65Å; F190-V194 HydrophobicContact CZ-CG2 3.97Å; F190-V194 WeakPolarHBondContact O-CG2 3.5Å; F190-V194 PolarHBondContact O-N 2.87Å
191	E	98.1	Very high	93.9	Very high	38 Å²	38	29.3 Å²	29.3	18%	0.178	15%	0.145	C	C	.	.	H	α-helix	trans	-55.2	-47.5	179.2	-178.7	174.2	-168.9	0	0	111.6	L176 R187 S188 G193 V194 K195 M238	L176-E191 HydrophobicContact CD1-CB 3.68Å; L176-E191 HydrophobicContact CD1-CG 4.11Å; L176-E191 HydrophobicContact CD2-CB 4.33Å; L176-E191 HydrophobicContact CD2-CG 3.95Å; R187-E191 WeakPolarHBondContact O-CB 3.34Å; R187-E191 PolarHBondContact O-N 3.16Å; S188-E191 PolarHBondContact O-N 3.26Å; E191-G193 VanDerWaalsContact C-N 3.28Å; E191-G193 PolarHBondContact O-N 3.01Å; E191-V194 PolarHBondContact O-N 3.48Å; E191-K195 VanDerWaalsContact CD-NZ 3.34Å; E191-K195 HydrophobicContact CG-CD 4.01Å; E191-K195 HydrophobicContact CG-CG 4.4Å; E191-K195 WeakPolarHBondContact O-CB 3.49Å; E191-K195 VanDerWaalsContact O-CG 3.26Å; E191-K195 WeakPolarHBondContact O-CG 3.45Å; E191-K195 PolarHBondContact O-N 3.14Å; E191-K195 WeakPolarHBondContact OE1-CE 3.46Å; E191-K195 IonicContact OE1-NZ 3.79Å; E191-K195 PolarHBondContact OE1-NZ 3.23Å; E191-M238 HydrophobicContact CB-CE 4.25Å; E191-M238 HydrophobicContact CG-CE 4.25Å; E191-M238 HydrophobicContact CG-SD 4.47Å
192	S	98.1	Very high	93.7	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-59.8	-37.7	178.9	71.8	0	0	0	0	112.5	S188 H189 F190 L196 T241	S188-S192 WeakPolarHBondContact O-CB 3.48Å; S188-S192 PolarHBondContact O-N 2.86Å; S188-S192 PolarHBondContact O-OG 3.4Å; H189-S192 PolarHBondContact O-OG 3.4Å; F190-S192 VanDerWaalsContact C-N 3.33Å; F190-S192 PolarHBondContact O-N 3.33Å; S192-L196 WeakPolarHBondContact O-CB 3.28Å; S192-L196 PolarHBondContact O-N 2.92Å; S192-T241 VanDerWaalsContact CB-OG1 3.22Å; S192-T241 WeakPolarHBondContact CB-OG1 3.45Å; S192-T241 WeakPolarHBondContact OG-CB 3.26Å; S192-T241 PolarHBondContact OG-OG1 3.02Å
193	G	97.7	Very high	93.6	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-73.4	-40.6	177.2	0	0	0	0	0	113.3	H189 F190 E191 K195 L196 G197	H189-G193 PolarHBondContact O-N 2.64Å; F190-G193 PolarHBondContact O-N 3.3Å; F190-G193 VanDerWaalsContact O-N 3.1Å; E191-G193 VanDerWaalsContact C-N 3.28Å; E191-G193 PolarHBondContact O-N 3.01Å; G193-K195 VanDerWaalsContact C-N 3.31Å; G193-K195 PolarHBondContact O-N 3.09Å; G193-L196 PolarHBondContact O-N 3.28Å; G193-G197 PolarHBondContact O-N 3.43Å
194	V	96.9	Very high	93.3	Very high	5 Å²	5	20.4 Å²	20.4	3%	0.03	11%	0.105	C	C	.	.	H	α-helix	trans	-58.3	-46.8	173.4	174.9	0	0	0	0	110.3	L132 C172 Q173 F190 E191 G197 D198	L132-V194 HydrophobicContact CD1-CG2 4.18Å; C172-V194 HydrophobicContact CB-CG2 3.59Å; Q173-V194 HydrophobicContact CB-CG1 4.14Å; F190-V194 HydrophobicContact CD1-CG2 3.93Å; F190-V194 HydrophobicContact CE1-CG2 3.65Å; F190-V194 HydrophobicContact CZ-CG2 3.97Å; F190-V194 WeakPolarHBondContact O-CG2 3.5Å; F190-V194 PolarHBondContact O-N 2.87Å; E191-V194 PolarHBondContact O-N 3.48Å; V194-G197 PolarHBondContact O-N 3.31Å; V194-D198 VanDerWaalsContact O-CB 3.23Å; V194-D198 WeakPolarHBondContact O-CB 3.44Å; V194-D198 PolarHBondContact O-N 2.96Å
195	K	97.5	Very high	92.6	Very high	24 Å²	24	15.7 Å²	15.7	10%	0.104	8%	0.083	C	C	.	.	H	α-helix	trans	-64.8	-41.6	178.3	-71.5	-179	176	169.9	0	113	E191 G193 G199 Q231 S234 A235 M238	E191-K195 VanDerWaalsContact CD-NZ 3.34Å; E191-K195 HydrophobicContact CG-CD 4.01Å; E191-K195 HydrophobicContact CG-CG 4.4Å; E191-K195 WeakPolarHBondContact O-CB 3.49Å; E191-K195 VanDerWaalsContact O-CG 3.26Å; E191-K195 WeakPolarHBondContact O-CG 3.45Å; E191-K195 PolarHBondContact O-N 3.14Å; E191-K195 WeakPolarHBondContact OE1-CE 3.46Å; E191-K195 IonicContact OE1-NZ 3.79Å; E191-K195 PolarHBondContact OE1-NZ 3.23Å; G193-K195 VanDerWaalsContact C-N 3.31Å; G193-K195 PolarHBondContact O-N 3.09Å; K195-G199 WeakPolarHBondContact O-CA 3.47Å; K195-G199 PolarHBondContact O-N 2.79Å; K195-Q231 HydrophobicContact CB-CB 4.44Å; K195-S234 PolarHBondContact NZ-OG 3.5Å; K195-A235 HydrophobicContact CB-CB 3.75Å; K195-M238 HydrophobicContact CD-SD 4.43Å
196	L	96.9	Very high	92	Very high	16 Å²	16	14 Å²	14	8%	0.084	7%	0.068	C	C	.	.	H	α-helix	trans	-56.6	-54	174.4	168.6	62	0	0	0	110.7	S192 G193 T200 L232 R243 L246 V250	S192-L196 WeakPolarHBondContact O-CB 3.28Å; S192-L196 PolarHBondContact O-N 2.92Å; G193-L196 PolarHBondContact O-N 3.28Å; L196-T200 VanDerWaalsContact O-CB 3.25Å; L196-T200 WeakPolarHBondContact O-CB 3.38Å; L196-T200 PolarHBondContact O-N 3.04Å; L196-T200 PolarHBondContact O-OG1 2.8Å; L196-L232 HydrophobicContact CD1-CD2 3.95Å; L196-R243 HydrophobicContact CB-CB 4.38Å; L196-R243 HydrophobicContact CD2-CB 3.96Å; L196-R243 HydrophobicContact CD2-CG 3.71Å; L196-L246 HydrophobicContact CD2-CB 4.12Å; L196-L246 HydrophobicContact CD2-CD1 4.48Å; L196-V250 HydrophobicContact CD1-CG2 4.1Å
197	G	92.7	Very high	91	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-70.7	-50.2	-173.5	0	0	0	0	0	114.2	Y169 G193 V194 G199 T200 F201	Y169-G197 WeakPolarHBondContact OH-CA 3.48Å; G193-G197 PolarHBondContact O-N 3.43Å; V194-G197 PolarHBondContact O-N 3.31Å; G197-G199 VanDerWaalsContact C-N 3.3Å; G197-G199 PolarHBondContact O-N 3.21Å; G197-T200 PolarHBondContact O-N 3.25Å; G197-F201 WeakPolarHBondContact O-CB 3.42Å; G197-F201 PolarHBondContact O-N 2.93Å
198	D	90.5	Very high	89.9	Confident	10 Å²	10	13.4 Å²	13.4	5%	0.053	7%	0.073	C	C	.	.	H	α-helix	trans	-64	-38.5	178.3	-174.5	36.4	0	0	0	111.5	V194 F201 S202 Y227	V194-D198 VanDerWaalsContact O-CB 3.23Å; V194-D198 WeakPolarHBondContact O-CB 3.44Å; V194-D198 PolarHBondContact O-N 2.96Å; D198-F201 PolarHBondContact O-N 3.07Å; D198-S202 VanDerWaalsContact O-CB 3.3Å; D198-S202 WeakPolarHBondContact O-CB 3.33Å; D198-S202 PolarHBondContact O-N 2.89Å; D198-S202 PolarHBondContact O-OG 3.25Å; D198-Y227 WeakPolarHBondContact OD2-CE1 3.43Å; D198-Y227 VanDerWaalsContact OD2-CZ 3.23Å; D198-Y227 PolarHBondContact OD2-OH 3.35Å
199	G	92.9	Very high	88.4	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-62.9	-48.9	174.2	0	0	0	0	0	112.8	K195 G197 F201 S202 L203 G228	K195-G199 WeakPolarHBondContact O-CA 3.47Å; K195-G199 PolarHBondContact O-N 2.79Å; G197-G199 VanDerWaalsContact C-N 3.3Å; G197-G199 PolarHBondContact O-N 3.21Å; G199-F201 VanDerWaalsContact C-N 3.35Å; G199-F201 PolarHBondContact O-N 3.3Å; G199-S202 PolarHBondContact O-N 3.03Å; G199-L203 VanDerWaalsContact O-CB 3.28Å; G199-L203 WeakPolarHBondContact O-CB 3.47Å; G199-L203 PolarHBondContact O-N 2.94Å; G199-G228 WeakPolarHBondContact CA-O 3.43Å; G199-G228 WeakPolarHBondContact O-CA 3.36Å
200	T	91.8	Very high	86.9	Confident	11 Å²	11	17.9 Å²	17.9	7%	0.067	10%	0.104	C	C	.	.	H	α-helix	trans	-59.6	-45.4	176.1	-60.2	0	0	0	0	111.2	L139 L196 G197 L203 L204 V250	L139-T200 HydrophobicContact CD2-CG2 4.18Å; L196-T200 VanDerWaalsContact O-CB 3.25Å; L196-T200 WeakPolarHBondContact O-CB 3.38Å; L196-T200 PolarHBondContact O-N 3.04Å; L196-T200 PolarHBondContact O-OG1 2.8Å; G197-T200 PolarHBondContact O-N 3.25Å; T200-L203 PolarHBondContact O-N 3.43Å; T200-L204 HydrophobicContact CG2-CD1 3.73Å; T200-L204 HydrophobicContact CG2-CG 4.27Å; T200-L204 WeakPolarHBondContact O-CB 3.47Å; T200-L204 VanDerWaalsContact O-CG 3.25Å; T200-L204 WeakPolarHBondContact O-CG 3.45Å; T200-L204 PolarHBondContact O-N 2.9Å; T200-V250 HydrophobicContact CG2-CG1 4.5Å
201	F	85.9	Confident	85.2	Confident	8 Å²	8	28 Å²	28	4%	0.035	14%	0.143	C	C	.	.	H	α-helix	trans	-63.1	-49.5	-179.1	-169.2	-95.6	0	0	0	112.2	I162 Y166 G197 D198 G199 L203 L204 I205 F221	I162-F201 HydrophobicContact CB-CE2 4.13Å; I162-F201 HydrophobicContact CG1-CE2 4.44Å; I162-F201 HydrophobicContact CG2-CE2 3.37Å; I162-F201 HydrophobicContact CG2-CZ 3.47Å; I162-F201 VanDerWaalsContact CG2-CZ 3.47Å; I162-F201 WeakPolarHBondContact O-CE2 3.47Å; Y166-F201 AromaticContact CD2-CD1 3.55Å; Y166-F201 HydrophobicContact CD2-CD1 3.55Å; Y166-F201 AromaticContact CD2-CE1 3.19Å; Y166-F201 HydrophobicContact CD2-CE1 3.19Å; Y166-F201 HydrophobicContact CD2-CG 4.4Å; Y166-F201 AromaticContact CD2-CZ 3.82Å; Y166-F201 HydrophobicContact CD2-CZ 3.82Å; Y166-F201 HydrophobicContact CE2-CD1 4.03Å; Y166-F201 AromaticContact CE2-CE1 3.78Å; Y166-F201 HydrophobicContact CE2-CE1 3.78Å; Y166-F201 HydrophobicContact CG-CD1 4.46Å; Y166-F201 AromaticContact CG-CE1 3.74Å; Y166-F201 HydrophobicContact CG-CE1 3.74Å; Y166-F201 AromaticContact CG-CZ 3.92Å; Y166-F201 HydrophobicContact CG-CZ 3.92Å; G197-F201 WeakPolarHBondContact O-CB 3.42Å; G197-F201 PolarHBondContact O-N 2.93Å; D198-F201 PolarHBondContact O-N 3.07Å; G199-F201 VanDerWaalsContact C-N 3.35Å; G199-F201 PolarHBondContact O-N 3.3Å; F201-L203 PolarHBondContact O-N 2.94Å; F201-L204 PolarHBondContact O-N 2.88Å; F201-I205 HydrophobicContact CD1-CD1 3.6Å; F201-I205 HydrophobicContact CD1-CG1 4.38Å; F201-I205 HydrophobicContact CE1-CD1 3.06Å; F201-I205 HydrophobicContact CE1-CG1 4.2Å; F201-I205 HydrophobicContact CE2-CD1 4.29Å; F201-I205 HydrophobicContact CG-CD1 4.39Å; F201-I205 HydrophobicContact CZ-CD1 3.47Å; F201-I205 VanDerWaalsContact CZ-CD1 3.47Å; F201-I205 HydrophobicContact CZ-CG1 4.48Å; F201-I205 WeakPolarHBondContact O-CG1 3.32Å; F201-I205 PolarHBondContact O-N 3.35Å; F201-F221 AromaticContact CE1-CD1 3.76Å; F201-F221 HydrophobicContact CE1-CD1 3.76Å; F201-F221 HydrophobicContact CE1-CE1 4.11Å; F201-F221 AromaticContact CZ-CD1 3.78Å; F201-F221 HydrophobicContact CZ-CD1 3.78Å; F201-F221 AromaticContact CZ-CE1 3.73Å; F201-F221 HydrophobicContact CZ-CE1 3.73Å
202	S	86.1	Confident	83.5	Confident	8 Å²	8	27.8 Å²	27.8	6%	0.056	14%	0.143	C	C	.	.	H	α-helix	trans	-58.4	-39.5	177.6	-66.3	0	0	0	0	111.9	D198 G199 S206 Y227	D198-S202 VanDerWaalsContact O-CB 3.3Å; D198-S202 WeakPolarHBondContact O-CB 3.33Å; D198-S202 PolarHBondContact O-N 2.89Å; D198-S202 PolarHBondContact O-OG 3.25Å; G199-S202 PolarHBondContact O-N 3.03Å; S202-S206 WeakPolarHBondContact O-CB 3.42Å; S202-S206 PolarHBondContact O-N 3.49Å; S202-S206 VanDerWaalsContact O-N 3.16Å; S202-Y227 WeakPolarHBondContact OG-CD1 3.39Å
203	L	85.7	Confident	81.9	Confident	4 Å²	4	28.9 Å²	28.9	2%	0.021	15%	0.149	C	C	.	.	H	α-helix	trans	-67.7	-50.6	178.7	-171.4	60.7	0	0	0	112.1	G199 T200 F201 I205 S206 A207 R225 L229 L232 W254	G199-L203 VanDerWaalsContact O-CB 3.28Å; G199-L203 WeakPolarHBondContact O-CB 3.47Å; G199-L203 PolarHBondContact O-N 2.94Å; T200-L203 PolarHBondContact O-N 3.43Å; F201-L203 PolarHBondContact O-N 2.94Å; L203-I205 PolarHBondContact O-N 2.84Å; L203-S206 WeakPolarHBondContact O-CB 3.44Å; L203-S206 PolarHBondContact O-N 3.03Å; L203-S206 PolarHBondContact O-OG 3.29Å; L203-A207 PolarHBondContact O-N 3.13Å; L203-R225 HydrophobicContact CD1-CG 3.96Å; L203-L229 HydrophobicContact CD1-CD2 3.93Å; L203-L229 HydrophobicContact CD1-CG 4.03Å; L203-L229 HydrophobicContact CD2-CD2 4.21Å; L203-L232 HydrophobicContact CD2-CD1 3.72Å; L203-W254 HydrophobicContact CD1-CD2 3.7Å; L203-W254 HydrophobicContact CD1-CE3 3.81Å; L203-W254 HydrophobicContact CD1-CG 4.41Å; L203-W254 HydrophobicContact CD1-CH2 3.61Å; L203-W254 HydrophobicContact CD1-CZ2 3.52Å; L203-W254 HydrophobicContact CD1-CZ3 3.76Å; L203-W254 HydrophobicContact CD2-CB 4.05Å; L203-W254 HydrophobicContact CD2-CD2 3.62Å; L203-W254 HydrophobicContact CD2-CE3 3.59Å; L203-W254 HydrophobicContact CD2-CG 3.81Å; L203-W254 HydrophobicContact CD2-CZ3 4.23Å; L203-W254 HydrophobicContact CG-CD2 3.79Å; L203-W254 HydrophobicContact CG-CE3 3.5Å; L203-W254 VanDerWaalsContact CG-CE3 3.5Å; L203-W254 HydrophobicContact CG-CG 4.47Å; L203-W254 HydrophobicContact CG-CH2 4.01Å; L203-W254 HydrophobicContact CG-CZ2 4.29Å; L203-W254 HydrophobicContact CG-CZ3 3.6Å
204	L	82.1	Confident	80.5	Confident	64 Å²	64	35.9 Å²	35.9	34%	0.335	18%	0.18	S	C	.	.	H	α-helix	trans	-61.7	-42.6	-179.9	-69.8	169.8	0	0	0	112.1	L143 T200 F201 S206 A207	L143-L204 HydrophobicContact CD1-CD1 4.42Å; L143-L204 HydrophobicContact CD2-CD1 3.63Å; L143-L204 HydrophobicContact CG-CD1 4.42Å; T200-L204 HydrophobicContact CG2-CD1 3.73Å; T200-L204 HydrophobicContact CG2-CG 4.27Å; T200-L204 WeakPolarHBondContact O-CB 3.47Å; T200-L204 VanDerWaalsContact O-CG 3.25Å; T200-L204 WeakPolarHBondContact O-CG 3.45Å; T200-L204 PolarHBondContact O-N 2.9Å; F201-L204 PolarHBondContact O-N 2.88Å; L204-S206 VanDerWaalsContact C-N 3.32Å; L204-S206 PolarHBondContact O-N 3.12Å; L204-A207 PolarHBondContact O-N 2.92Å
205	I	78.2	Confident	78.9	Confident	7 Å²	7	41.6 Å²	41.6	4%	0.036	21%	0.21	C	C	.	.	H	α-helix	trans	-62.8	-42.5	176.4	-68	-176.6	0	0	0	110.4	F201 L203 A207 L208 L213 F221	F201-I205 HydrophobicContact CD1-CD1 3.6Å; F201-I205 HydrophobicContact CD1-CG1 4.38Å; F201-I205 HydrophobicContact CE1-CD1 3.06Å; F201-I205 HydrophobicContact CE1-CG1 4.2Å; F201-I205 HydrophobicContact CE2-CD1 4.29Å; F201-I205 HydrophobicContact CG-CD1 4.39Å; F201-I205 HydrophobicContact CZ-CD1 3.47Å; F201-I205 VanDerWaalsContact CZ-CD1 3.47Å; F201-I205 HydrophobicContact CZ-CG1 4.48Å; F201-I205 WeakPolarHBondContact O-CG1 3.32Å; F201-I205 PolarHBondContact O-N 3.35Å; L203-I205 PolarHBondContact O-N 2.84Å; I205-A207 PolarHBondContact O-N 3.32Å; I205-L208 WeakPolarHBondContact O-CB 3.4Å; I205-L208 PolarHBondContact O-N 3.5Å; I205-L213 HydrophobicContact CG2-CD2 3.6Å; I205-L213 VanDerWaalsContact O-CD2 3.25Å; I205-L213 WeakPolarHBondContact O-CD2 3.29Å; I205-F221 HydrophobicContact CD1-CB 3.99Å; I205-F221 HydrophobicContact CD1-CD1 4.31Å; I205-F221 HydrophobicContact CD1-CG 4.27Å
206	S	78	Confident	77.3	Confident	10 Å²	10	41 Å²	41	7%	0.07	21%	0.208	C	C	.	.	H	α-helix	trans	-61.6	-15.6	179.5	82.8	0	0	0	0	114.7	S202 L203 L204 R225	S202-S206 WeakPolarHBondContact O-CB 3.42Å; S202-S206 PolarHBondContact O-N 3.49Å; S202-S206 VanDerWaalsContact O-N 3.16Å; L203-S206 WeakPolarHBondContact O-CB 3.44Å; L203-S206 PolarHBondContact O-N 3.03Å; L203-S206 PolarHBondContact O-OG 3.29Å; L204-S206 VanDerWaalsContact C-N 3.32Å; L204-S206 PolarHBondContact O-N 3.12Å; S206-R225 PolarHBondContact O-NH2 2.67Å; S206-R225 WeakPolarHBondContact OG-CB 3.16Å
207	A	74.3	Confident	76	Confident	20 Å²	20	44.8 Å²	44.8	17%	0.165	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-11.6	178.3	0	0	0	0	0	113.9	L203 L204 I205 W254 F258	L203-A207 PolarHBondContact O-N 3.13Å; L204-A207 PolarHBondContact O-N 2.92Å; I205-A207 PolarHBondContact O-N 3.32Å; A207-W254 HydrophobicContact CB-CH2 4.07Å; A207-W254 HydrophobicContact CB-CZ3 4.1Å; A207-F258 HydrophobicContact CB-CE1 3.52Å; A207-F258 HydrophobicContact CB-CZ 3.74Å
208	L	72	Confident	74.5	Confident	42 Å²	42	54 Å²	54	22%	0.22	27%	0.265	C	S	.	.	S	Bend	trans	-71.4	144.2	-176.7	-68.3	172.7	0	0	0	111.3	I205 V212 L213 L216	I205-L208 WeakPolarHBondContact O-CB 3.4Å; I205-L208 PolarHBondContact O-N 3.5Å; L208-V212 HydrophobicContact CB-CB 4.34Å; L208-V212 HydrophobicContact CB-CG1 4.26Å; L208-V212 HydrophobicContact CD1-CG1 3.95Å; L208-V212 HydrophobicContact CD2-CG1 4.32Å; L208-V212 HydrophobicContact CG-CG1 4.41Å; L208-L213 HydrophobicContact CB-CD2 4.21Å; L208-L213 HydrophobicContact CB-CG 4.11Å; L208-L213 VanDerWaalsContact O-CD1 3.26Å; L208-L213 WeakPolarHBondContact O-CD1 3.18Å; L208-L213 WeakPolarHBondContact O-CG 3.47Å; L208-L216 HydrophobicContact CD1-CD1 3.43Å; L208-L216 VanDerWaalsContact CD1-CD1 3.43Å
209	P	65.6	Low	73	Confident	49 Å²	49	55.3 Å²	55.3	32%	0.318	28%	0.277	S	S	.	.			trans	-58.4	147	173.4	-23.6	33	0	0	0	112.3	R211 V212 L213 F583	P209-R211 PolarHBondContact O-N 2.93Å; P209-V212 WeakPolarHBondContact O-CA 3.35Å; P209-V212 WeakPolarHBondContact O-CB 3.3Å; P209-V212 PolarHBondContact O-N 3.1Å; P209-L213 PolarHBondContact O-N 2.88Å; P209-F583 HydrophobicContact CG-CE1 3.85Å; P209-F583 HydrophobicContact CG-CZ 4.29Å
210	S	65.6	Low	71.6	Confident	59 Å²	59	57.6 Å²	57.6	41%	0.413	30%	0.301	S	S	.	.	H	α-helix	trans	-50.8	-32.1	-178.2	60.8	0	0	0	0	115.3	V212 K214	S210-V212 VanDerWaalsContact C-N 3.33Å; S210-V212 PolarHBondContact O-N 3.46Å; S210-K214 WeakPolarHBondContact O-CG 3.29Å; S210-K214 PolarHBondContact O-N 3.32Å; S210-K214 VanDerWaalsContact O-N 3.12Å
211	R	61.8	Low	70.4	Confident	214 Å²	214	57.3 Å²	57.3	81%	0.808	30%	0.299	S	S	*	.	H	α-helix	trans	-65.4	-36.2	176	-66	-177	-176.5	166.9	2	112.9	P209	P209-R211 PolarHBondContact O-N 2.93Å
212	V	63	Low	69.5	Low	32 Å²	32	63 Å²	63	19%	0.194	33%	0.329	C	S	.	.	H	α-helix	trans	-79.5	-41.3	177.8	178.4	0	0	0	0	110	F155 L208 P209 S210 K214 L215 L216	F155-V212 HydrophobicContact CE1-CG1 4.08Å; F155-V212 HydrophobicContact CE2-CG1 4.04Å; F155-V212 HydrophobicContact CZ-CG1 3.29Å; F155-V212 HydrophobicContact CZ-CG2 4.48Å; L208-V212 HydrophobicContact CB-CB 4.34Å; L208-V212 HydrophobicContact CB-CG1 4.26Å; L208-V212 HydrophobicContact CD1-CG1 3.95Å; L208-V212 HydrophobicContact CD2-CG1 4.32Å; L208-V212 HydrophobicContact CG-CG1 4.41Å; P209-V212 WeakPolarHBondContact O-CA 3.35Å; P209-V212 WeakPolarHBondContact O-CB 3.3Å; P209-V212 PolarHBondContact O-N 3.1Å; S210-V212 VanDerWaalsContact C-N 3.33Å; S210-V212 PolarHBondContact O-N 3.46Å; V212-K214 VanDerWaalsContact C-N 3.34Å; V212-K214 PolarHBondContact O-N 3.3Å; V212-L215 WeakPolarHBondContact O-CB 3.38Å; V212-L215 PolarHBondContact O-N 3.02Å; V212-L215 VanDerWaalsContact O-N 3.14Å; V212-L216 HydrophobicContact CG1-CD1 4.37Å; V212-L216 PolarHBondContact O-N 3.03Å
213	L	65.5	Low	68.9	Low	24 Å²	24	64 Å²	64	13%	0.126	34%	0.341	C	S	.	.	H	α-helix	trans	-54.2	-47	175.7	-78.4	173.6	0	0	0	112.2	I205 L208 P209 L215 L216 E217	I205-L213 HydrophobicContact CG2-CD2 3.6Å; I205-L213 VanDerWaalsContact O-CD2 3.25Å; I205-L213 WeakPolarHBondContact O-CD2 3.29Å; L208-L213 HydrophobicContact CB-CD2 4.21Å; L208-L213 HydrophobicContact CB-CG 4.11Å; L208-L213 VanDerWaalsContact O-CD1 3.26Å; L208-L213 WeakPolarHBondContact O-CD1 3.18Å; L208-L213 WeakPolarHBondContact O-CG 3.47Å; P209-L213 PolarHBondContact O-N 2.88Å; L213-L215 PolarHBondContact O-N 3.21Å; L213-L215 VanDerWaalsContact O-N 3.17Å; L213-L216 CarbonylContact O-C 3.55Å; L213-L216 WeakPolarHBondContact O-CA 3.49Å; L213-L216 WeakPolarHBondContact O-CB 2.89Å; L213-L216 PolarHBondContact O-N 2.91Å; L213-E217 WeakPolarHBondContact O-CG 3.39Å; L213-E217 PolarHBondContact O-N 3.08Å
214	K	66.9	Low	68.8	Low	146 Å²	146	67.6 Å²	67.6	64%	0.635	36%	0.36	S	S	*	.	H	α-helix	trans	-56.7	-34.3	178.7	-74.3	178.8	-178.8	-170.8	0	114.1	S210 V212 L216 F218	S210-K214 WeakPolarHBondContact O-CG 3.29Å; S210-K214 PolarHBondContact O-N 3.32Å; S210-K214 VanDerWaalsContact O-N 3.12Å; V212-K214 VanDerWaalsContact C-N 3.34Å; V212-K214 PolarHBondContact O-N 3.3Å; K214-L216 VanDerWaalsContact C-N 3.33Å; K214-F218 PolarHBondContact O-N 2.68Å
215	L	63.4	Low	69	Low	126 Å²	126	66.5 Å²	66.5	66%	0.66	35%	0.352	S	S	*	.	H	α-helix	trans	-71.1	-32	176.4	-65.9	172.5	0	0	0	111.7	V212 L213	V212-L215 WeakPolarHBondContact O-CB 3.38Å; V212-L215 PolarHBondContact O-N 3.02Å; V212-L215 VanDerWaalsContact O-N 3.14Å; L213-L215 PolarHBondContact O-N 3.21Å; L213-L215 VanDerWaalsContact O-N 3.17Å
216	L	65.2	Low	69.5	Low	12 Å²	12	72.4 Å²	72.4	6%	0.063	38%	0.379	C	S	.	.	H	α-helix	trans	-82.6	-40	178.4	-68	178.3	0	0	0	112.1	L208 V212 L213 K214 F218 A219 G220 F221	L208-L216 HydrophobicContact CD1-CD1 3.43Å; L208-L216 VanDerWaalsContact CD1-CD1 3.43Å; V212-L216 HydrophobicContact CG1-CD1 4.37Å; V212-L216 PolarHBondContact O-N 3.03Å; L213-L216 CarbonylContact O-C 3.55Å; L213-L216 WeakPolarHBondContact O-CA 3.49Å; L213-L216 WeakPolarHBondContact O-CB 2.89Å; L213-L216 PolarHBondContact O-N 2.91Å; K214-L216 VanDerWaalsContact C-N 3.33Å; L216-F218 VanDerWaalsContact C-N 3.26Å; L216-F218 PolarHBondContact O-N 2.93Å; L216-A219 CarbonylContact O-C 3.59Å; L216-A219 VanDerWaalsContact O-CA 3.31Å; L216-A219 WeakPolarHBondContact O-CA 2.98Å; L216-A219 WeakPolarHBondContact O-CB 3.36Å; L216-A219 PolarHBondContact O-N 3.21Å; L216-G220 PolarHBondContact O-N 3.11Å; L216-G220 VanDerWaalsContact O-N 3.14Å; L216-F221 HydrophobicContact CB-CB 4.09Å; L216-F221 HydrophobicContact CB-CD2 3.74Å; L216-F221 HydrophobicContact CB-CG 4.35Å; L216-F221 HydrophobicContact CD2-CD2 3.79Å; L216-F221 HydrophobicContact CD2-CE2 3.97Å; L216-F221 HydrophobicContact CG-CD2 4.33Å; L216-F221 WeakPolarHBondContact O-CD2 3.47Å; L216-F221 PolarHBondContact O-N 3.33Å; L216-F221 VanDerWaalsContact O-N 3.09Å
217	E	68.8	Low	70.2	Confident	94 Å²	94	74.1 Å²	74.1	44%	0.439	38%	0.384	S	S	.	.	H	α-helix	trans	-56.4	-42.2	173.2	-74	170.6	-173.8	0	0	111.1	L213 A219 G220 F221	L213-E217 WeakPolarHBondContact O-CG 3.39Å; L213-E217 PolarHBondContact O-N 3.08Å; E217-A219 PolarHBondContact O-N 2.9Å; E217-G220 WeakPolarHBondContact O-CA 3.47Å; E217-G220 PolarHBondContact O-N 3.44Å; E217-F221 WeakPolarHBondContact CA-O 3.4Å; E217-F221 WeakPolarHBondContact CG-O 3.43Å
218	F	61	Low	71.1	Confident	195 Å²	195	73.2 Å²	73.2	86%	0.855	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-31.9	172.3	180	-99	0	0	0	112.9	K214 L216 G220	K214-F218 PolarHBondContact O-N 2.68Å; L216-F218 VanDerWaalsContact C-N 3.26Å; L216-F218 PolarHBondContact O-N 2.93Å; F218-G220 VanDerWaalsContact C-N 3.31Å
219	A	59.4	Low	72.2	Confident	37 Å²	37	73.2 Å²	73.2	31%	0.306	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-0.5	174.7	0	0	0	0	0	113.9	L216 E217 F221	L216-A219 CarbonylContact O-C 3.59Å; L216-A219 VanDerWaalsContact O-CA 3.31Å; L216-A219 WeakPolarHBondContact O-CA 2.98Å; L216-A219 WeakPolarHBondContact O-CB 3.36Å; L216-A219 PolarHBondContact O-N 3.21Å; E217-A219 PolarHBondContact O-N 2.9Å; A219-F221 HydrophobicContact CB-CD2 3.82Å; A219-F221 HydrophobicContact CB-CE2 3.55Å
220	G	63.4	Low	73.7	Confident	48 Å²	48	77.6 Å²	77.6	50%	0.495	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	97	17.4	176.7	0	0	0	0	0	115.4	L216 E217 F218	L216-G220 PolarHBondContact O-N 3.11Å; L216-G220 VanDerWaalsContact O-N 3.14Å; E217-G220 WeakPolarHBondContact O-CA 3.47Å; E217-G220 PolarHBondContact O-N 3.44Å; F218-G220 VanDerWaalsContact C-N 3.31Å
221	F	66.2	Low	75.2	Confident	5 Å²	5	76.8 Å²	76.8	2%	0.022	38%	0.376	C	S	.	.			trans	-98.2	122.8	-180	-54.9	-70.8	0	0	0	112.3	I162 R163 Y166 F201 I205 L216 E217 A219	I162-F221 HydrophobicContact CG2-CZ 4.42Å; R163-F221 HydrophobicContact CB-CZ 3.8Å; R163-F221 HydrophobicContact CG-CZ 4Å; Y166-F221 AromaticContact CD1-CD1 3.8Å; Y166-F221 HydrophobicContact CD1-CD1 3.8Å; Y166-F221 AromaticContact CD1-CE1 3.46Å; Y166-F221 HydrophobicContact CD1-CE1 3.46Å; Y166-F221 VanDerWaalsContact CD1-CE1 3.46Å; Y166-F221 HydrophobicContact CD2-CD1 4.43Å; Y166-F221 HydrophobicContact CD2-CE1 4.46Å; Y166-F221 AromaticContact CE1-CD1 3.97Å; Y166-F221 HydrophobicContact CE1-CD1 3.97Å; Y166-F221 HydrophobicContact CE1-CE1 4.09Å; Y166-F221 HydrophobicContact CG-CD1 4Å; Y166-F221 AromaticContact CG-CE1 3.65Å; Y166-F221 HydrophobicContact CG-CE1 3.65Å; F201-F221 AromaticContact CE1-CD1 3.76Å; F201-F221 HydrophobicContact CE1-CD1 3.76Å; F201-F221 HydrophobicContact CE1-CE1 4.11Å; F201-F221 AromaticContact CZ-CD1 3.78Å; F201-F221 HydrophobicContact CZ-CD1 3.78Å; F201-F221 AromaticContact CZ-CE1 3.73Å; F201-F221 HydrophobicContact CZ-CE1 3.73Å; I205-F221 HydrophobicContact CD1-CB 3.99Å; I205-F221 HydrophobicContact CD1-CD1 4.31Å; I205-F221 HydrophobicContact CD1-CG 4.27Å; L216-F221 HydrophobicContact CB-CB 4.09Å; L216-F221 HydrophobicContact CB-CD2 3.74Å; L216-F221 HydrophobicContact CB-CG 4.35Å; L216-F221 HydrophobicContact CD2-CD2 3.79Å; L216-F221 HydrophobicContact CD2-CE2 3.97Å; L216-F221 HydrophobicContact CG-CD2 4.33Å; L216-F221 WeakPolarHBondContact O-CD2 3.47Å; L216-F221 PolarHBondContact O-N 3.33Å; L216-F221 VanDerWaalsContact O-N 3.09Å; E217-F221 WeakPolarHBondContact CA-O 3.4Å; E217-F221 WeakPolarHBondContact CG-O 3.43Å; A219-F221 HydrophobicContact CB-CD2 3.82Å; A219-F221 HydrophobicContact CB-CE2 3.55Å
222	N	68	Low	76.9	Confident	127 Å²	127	66.6 Å²	66.6	68%	0.679	34%	0.338	S	S	*	.			trans	-116.7	111.8	165.6	-74.6	-11.5	0	0	0	108.8
223	G	72.4	Confident	78.6	Confident	29 Å²	29	69.2 Å²	69.2	30%	0.299	35%	0.347	S	S	.	.			trans	-80.1	121.7	173.3	0	0	0	0	0	110.6
224	N	83.3	Confident	80.1	Confident	79 Å²	79	70.2 Å²	70.2	42%	0.422	36%	0.355	S	S	.	.			trans	-115.6	111.4	172.3	-179.1	-35	0	0	0	109.4	E226 Y227 G228	N224-E226 PolarHBondContact OD1-N 2.92Å; N224-Y227 PolarHBondContact O-N 2.9Å; N224-Y227 PolarHBondContact OD1-N 3.43Å; N224-G228 PolarHBondContact O-N 3.03Å
225	R	86.4	Confident	81.6	Confident	42 Å²	42	63.2 Å²	63.2	16%	0.158	33%	0.325	C	S	.	.	H	α-helix	trans	-58.4	-49.6	-178.7	-173.7	180	-61	147.6	10.4	111.9	L203 S206 Y227 G228 L229 W254 E266	L203-R225 HydrophobicContact CD1-CG 3.96Å; S206-R225 PolarHBondContact O-NH2 2.67Å; S206-R225 WeakPolarHBondContact OG-CB 3.16Å; R225-Y227 PolarHBondContact O-N 2.96Å; R225-G228 PolarHBondContact O-N 3.06Å; R225-L229 HydrophobicContact CG-CD1 4.03Å; R225-L229 HydrophobicContact CG-CG 4.49Å; R225-L229 WeakPolarHBondContact O-CG 3.49Å; R225-L229 PolarHBondContact O-N 3.24Å; R225-W254 HydrophobicContact CG-CZ2 4.23Å; R225-E266 IonicContact CZ-OE2 3.37Å; R225-E266 IonicContact NH1-OE2 3.26Å; R225-E266 PolarHBondContact NH1-OE2 2.73Å
226	E	90.3	Very high	83.3	Confident	130 Å²	130	57.2 Å²	57.2	61%	0.607	29%	0.294	S	S	*	.	H	α-helix	trans	-65.2	-40.7	-177.3	-173.5	-175.8	178.4	0	0	111.7	N224 R230	N224-E226 PolarHBondContact OD1-N 2.92Å; E226-R230 WeakPolarHBondContact O-CB 3.38Å; E226-R230 VanDerWaalsContact O-CG 3.29Å; E226-R230 WeakPolarHBondContact O-CG 3.45Å; E226-R230 PolarHBondContact O-N 3.45Å; E226-R230 PolarHBondContact O-NE 3.36Å
227	Y	92.4	Very high	84.8	Confident	47 Å²	47	59.9 Å²	59.9	18%	0.184	31%	0.308	C	S	.	.	H	α-helix	trans	-60.5	-48.8	171.8	175.6	-98.8	0	0	0	111.3	Q173 D198 S202 N224 R225 L229 R230 Q231	Q173-Y227 PolarHBondContact NE2-OH 2.9Å; D198-Y227 WeakPolarHBondContact OD2-CE1 3.43Å; D198-Y227 VanDerWaalsContact OD2-CZ 3.23Å; D198-Y227 PolarHBondContact OD2-OH 3.35Å; S202-Y227 WeakPolarHBondContact OG-CD1 3.39Å; N224-Y227 PolarHBondContact O-N 2.9Å; N224-Y227 PolarHBondContact OD1-N 3.43Å; R225-Y227 PolarHBondContact O-N 2.96Å; Y227-L229 PolarHBondContact O-N 3.37Å; Y227-R230 PolarHBondContact O-N 2.98Å; Y227-R230 VanDerWaalsContact O-N 3.15Å; Y227-Q231 HydrophobicContact CD1-CG 4.28Å; Y227-Q231 HydrophobicContact CD2-CG 4.4Å; Y227-Q231 HydrophobicContact CE1-CG 3.8Å; Y227-Q231 HydrophobicContact CE2-CG 3.95Å; Y227-Q231 VanDerWaalsContact CE2-NE2 3.25Å; Y227-Q231 WeakPolarHBondContact O-CG 3.09Å; Y227-Q231 PolarHBondContact O-N 2.95Å
228	G	93	Very high	86.2	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-57.9	-47	179.9	0	0	0	0	0	112.9	G199 N224 R225 R230 Q231 L232	G199-G228 WeakPolarHBondContact CA-O 3.43Å; G199-G228 WeakPolarHBondContact O-CA 3.36Å; N224-G228 PolarHBondContact O-N 3.03Å; R225-G228 PolarHBondContact O-N 3.06Å; G228-R230 PolarHBondContact O-N 3.18Å; G228-Q231 PolarHBondContact O-N 3.27Å; G228-L232 WeakPolarHBondContact O-CB 3.46Å; G228-L232 WeakPolarHBondContact O-CG 3.39Å; G228-L232 PolarHBondContact O-N 2.9Å
229	L	94.8	Very high	87.8	Confident	43 Å²	43	50.6 Å²	50.6	23%	0.225	27%	0.267	C	S	.	.	H	α-helix	trans	-62.5	-38.9	176.2	-68.8	173.2	0	0	0	112.5	L203 R225 Y227 K233 L251 W254	L203-L229 HydrophobicContact CD1-CD2 3.93Å; L203-L229 HydrophobicContact CD1-CG 4.03Å; L203-L229 HydrophobicContact CD2-CD2 4.21Å; R225-L229 HydrophobicContact CG-CD1 4.03Å; R225-L229 HydrophobicContact CG-CG 4.49Å; R225-L229 WeakPolarHBondContact O-CG 3.49Å; R225-L229 PolarHBondContact O-N 3.24Å; Y227-L229 PolarHBondContact O-N 3.37Å; L229-K233 WeakPolarHBondContact O-CB 3.48Å; L229-K233 PolarHBondContact O-N 3.44Å; L229-L251 HydrophobicContact CD2-CD2 3.91Å; L229-W254 HydrophobicContact CD2-CG 4.43Å
230	R	96.8	Very high	89.5	Confident	141 Å²	141	54.8 Å²	54.8	53%	0.532	28%	0.276	S	S	.	.	H	α-helix	trans	-66	-43.7	176.9	-76.9	-174.9	-62.3	160.8	-1.3	112.6	E226 Y227 G228 K233 S234	E226-R230 WeakPolarHBondContact O-CB 3.38Å; E226-R230 VanDerWaalsContact O-CG 3.29Å; E226-R230 WeakPolarHBondContact O-CG 3.45Å; E226-R230 PolarHBondContact O-N 3.45Å; E226-R230 PolarHBondContact O-NE 3.36Å; Y227-R230 PolarHBondContact O-N 2.98Å; Y227-R230 VanDerWaalsContact O-N 3.15Å; G228-R230 PolarHBondContact O-N 3.18Å; R230-K233 PolarHBondContact O-N 3.29Å; R230-S234 WeakPolarHBondContact O-CB 3.31Å; R230-S234 PolarHBondContact O-N 2.87Å
231	Q	97.2	Very high	91.1	Very high	42 Å²	42	52.5 Å²	52.5	20%	0.196	25%	0.252	C	S	.	.	H	α-helix	trans	-63.3	-49.7	177.9	-65.4	-53.7	-35.1	0	0	111	K195 Y227 G228 K233 S234 A235	K195-Q231 HydrophobicContact CB-CB 4.44Å; Y227-Q231 HydrophobicContact CD1-CG 4.28Å; Y227-Q231 HydrophobicContact CD2-CG 4.4Å; Y227-Q231 HydrophobicContact CE1-CG 3.8Å; Y227-Q231 HydrophobicContact CE2-CG 3.95Å; Y227-Q231 VanDerWaalsContact CE2-NE2 3.25Å; Y227-Q231 WeakPolarHBondContact O-CG 3.09Å; Y227-Q231 PolarHBondContact O-N 2.95Å; G228-Q231 PolarHBondContact O-N 3.27Å; Q231-K233 VanDerWaalsContact C-N 3.33Å; Q231-K233 PolarHBondContact O-N 3.36Å; Q231-S234 PolarHBondContact O-N 3.41Å; Q231-S234 VanDerWaalsContact O-N 3.13Å; Q231-A235 PolarHBondContact O-N 2.9Å
232	L	98	Very high	92.5	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-58.2	-44.7	176.5	-76.9	166.8	0	0	0	112.1	L196 L203 G228 S234 A235 A236 V250 L251	L196-L232 HydrophobicContact CD1-CD2 3.95Å; L203-L232 HydrophobicContact CD2-CD1 3.72Å; G228-L232 WeakPolarHBondContact O-CB 3.46Å; G228-L232 WeakPolarHBondContact O-CG 3.39Å; G228-L232 PolarHBondContact O-N 2.9Å; L232-S234 VanDerWaalsContact C-N 3.31Å; L232-S234 PolarHBondContact O-N 3.16Å; L232-A235 PolarHBondContact O-N 3.05Å; L232-A236 WeakPolarHBondContact O-CB 3.48Å; L232-A236 PolarHBondContact O-N 2.93Å; L232-V250 HydrophobicContact CD1-CG1 3.72Å; L232-V250 HydrophobicContact CD2-CB 4.09Å; L232-V250 HydrophobicContact CD2-CG1 3.88Å; L232-V250 HydrophobicContact CG-CG1 4.47Å; L232-L251 HydrophobicContact CB-CD1 4.07Å; L232-L251 HydrophobicContact CB-CD2 3.71Å; L232-L251 HydrophobicContact CB-CG 3.81Å; L232-L251 HydrophobicContact CD1-CD2 4.16Å
233	K	98.1	Very high	93.9	Very high	87 Å²	87	46.7 Å²	46.7	38%	0.378	22%	0.221	S	C	.	.	H	α-helix	trans	-60.5	-43.6	176.7	179.9	176.9	-177.9	168.8	0	111	L229 R230 Q231 A235 A236 L237 L251 L271	L229-K233 WeakPolarHBondContact O-CB 3.48Å; L229-K233 PolarHBondContact O-N 3.44Å; R230-K233 PolarHBondContact O-N 3.29Å; Q231-K233 VanDerWaalsContact C-N 3.33Å; Q231-K233 PolarHBondContact O-N 3.36Å; K233-A235 VanDerWaalsContact C-N 3.35Å; K233-A235 PolarHBondContact O-N 3.38Å; K233-A236 PolarHBondContact O-N 3.49Å; K233-L237 HydrophobicContact CG-CD1 4.15Å; K233-L237 VanDerWaalsContact O-CG 3.25Å; K233-L237 WeakPolarHBondContact O-CG 3.42Å; K233-L237 PolarHBondContact O-N 3.19Å; K233-L251 HydrophobicContact CB-CD1 4.43Å; K233-L271 HydrophobicContact CB-CD2 4.27Å; K233-L271 HydrophobicContact CD-CD1 4.25Å; K233-L271 HydrophobicContact CD-CD2 3.95Å; K233-L271 HydrophobicContact CG-CD1 4.12Å; K233-L271 HydrophobicContact CG-CD2 4.05Å
234	S	98.1	Very high	95.1	Very high	44 Å²	44	45.9 Å²	45.9	31%	0.308	21%	0.209	S	C	.	.	H	α-helix	trans	-63	-41.1	177.5	-178	0	0	0	0	112	K195 R230 Q231 L232 L237 M238	K195-S234 PolarHBondContact NZ-OG 3.5Å; R230-S234 WeakPolarHBondContact O-CB 3.31Å; R230-S234 PolarHBondContact O-N 2.87Å; Q231-S234 PolarHBondContact O-N 3.41Å; Q231-S234 VanDerWaalsContact O-N 3.13Å; L232-S234 VanDerWaalsContact C-N 3.31Å; L232-S234 PolarHBondContact O-N 3.16Å; S234-L237 PolarHBondContact O-N 3.41Å; S234-M238 WeakPolarHBondContact O-CG 3.45Å
235	A	98.4	Very high	95.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-66.8	-41.8	176.4	0	0	0	0	0	112.5	K195 Q231 L232 K233 L237 M238 S247	K195-A235 HydrophobicContact CB-CB 3.75Å; Q231-A235 PolarHBondContact O-N 2.9Å; L232-A235 PolarHBondContact O-N 3.05Å; K233-A235 VanDerWaalsContact C-N 3.35Å; K233-A235 PolarHBondContact O-N 3.38Å; A235-L237 PolarHBondContact O-N 3.04Å; A235-M238 PolarHBondContact O-N 3.22Å; A235-M238 VanDerWaalsContact O-N 3.11Å; A235-S247 WeakPolarHBondContact CB-OG 3.45Å
236	A	98.3	Very high	96.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.6	-24.5	179.7	0	0	0	0	0	113.2	L232 K233 H239 A248 L251 L275	L232-A236 WeakPolarHBondContact O-CB 3.48Å; L232-A236 PolarHBondContact O-N 2.93Å; K233-A236 PolarHBondContact O-N 3.49Å; A236-H239 PolarHBondContact O-CD2 3.17Å; A236-A248 HydrophobicContact CB-CB 4.32Å; A236-L251 HydrophobicContact CB-CD1 3.93Å; A236-L275 HydrophobicContact CB-CD2 3.79Å
237	L	97.3	Very high	96.7	Very high	68 Å²	68	35.1 Å²	35.1	36%	0.356	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-3.6	177.8	-65	177.3	0	0	0	114	K233 S234 A235 H239	K233-L237 HydrophobicContact CG-CD1 4.15Å; K233-L237 VanDerWaalsContact O-CG 3.25Å; K233-L237 WeakPolarHBondContact O-CG 3.42Å; K233-L237 PolarHBondContact O-N 3.19Å; S234-L237 PolarHBondContact O-N 3.41Å; A235-L237 PolarHBondContact O-N 3.04Å; L237-H239 VanDerWaalsContact C-N 3.35Å; L237-H239 PolarHBondContact O-N 3.03Å
238	M	97.3	Very high	97	Very high	18 Å²	18	32.9 Å²	32.9	9%	0.089	15%	0.15	C	C	.	.			trans	-89	64.8	177.4	-64.8	172.5	78.6	0	0	110.9	E191 K195 S234 A235 Y240 T241 W244	E191-M238 HydrophobicContact CB-CE 4.25Å; E191-M238 HydrophobicContact CG-CE 4.25Å; E191-M238 HydrophobicContact CG-SD 4.47Å; K195-M238 HydrophobicContact CD-SD 4.43Å; S234-M238 WeakPolarHBondContact O-CG 3.45Å; A235-M238 PolarHBondContact O-N 3.22Å; A235-M238 VanDerWaalsContact O-N 3.11Å; M238-Y240 PolarHBondContact O-N 3.37Å; M238-T241 HydrophobicContact CB-CG2 3.81Å; M238-T241 WeakPolarHBondContact CB-OG1 3.27Å; M238-T241 HydrophobicContact CE-CG2 4.01Å; M238-T241 WeakPolarHBondContact O-CB 3.46Å; M238-T241 PolarHBondContact O-N 3.46Å; M238-T241 PolarHBondContact O-OG1 2.87Å; M238-W244 WeakPolarHBondContact O-CB 3.32Å
239	H	95.7	Very high	97.2	Very high	75 Å²	75	33.6 Å²	33.6	35%	0.347	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-18.6	-167.5	-64.6	-178.9	0	0	0	116.2	A236 L237 T241 W244 D278	A236-H239 PolarHBondContact O-CD2 3.17Å; L237-H239 VanDerWaalsContact C-N 3.35Å; L237-H239 PolarHBondContact O-N 3.03Å; H239-T241 VanDerWaalsContact C-N 3.32Å; H239-W244 VanDerWaalsContact CA-CD1 3.49Å; H239-W244 AromaticContact CD2-CE3 3.9Å; H239-W244 PolarHBondContact O-NE1 2.89Å; H239-D278 IonicContact CE1-OD2 3.56Å; H239-D278 IonicContact NE2-OD2 3.75Å
240	Y	93.7	Very high	97.2	Very high	126 Å²	126	33.5 Å²	33.5	49%	0.494	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-10.1	176	56.1	-86.2	0	0	0	113	R34 S188 M238	R34-Y240 PolarHBondContact NH1-O 3.16Å; S188-Y240 VanDerWaalsContact CB-CE2 3.43Å; S188-Y240 PolarHBondContact OG-OH 3.45Å; M238-Y240 PolarHBondContact O-N 3.37Å
241	T	97.1	Very high	97.2	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	-96.3	143.4	-174	67.4	0	0	0	0	113.6	S188 S192 M238 H239 R243 W244	S188-T241 WeakPolarHBondContact O-CG2 3.47Å; S192-T241 VanDerWaalsContact CB-OG1 3.22Å; S192-T241 WeakPolarHBondContact CB-OG1 3.45Å; S192-T241 WeakPolarHBondContact OG-CB 3.26Å; S192-T241 PolarHBondContact OG-OG1 3.02Å; M238-T241 HydrophobicContact CB-CG2 3.81Å; M238-T241 WeakPolarHBondContact CB-OG1 3.27Å; M238-T241 HydrophobicContact CE-CG2 4.01Å; M238-T241 WeakPolarHBondContact O-CB 3.46Å; M238-T241 PolarHBondContact O-N 3.46Å; M238-T241 PolarHBondContact O-OG1 2.87Å; H239-T241 VanDerWaalsContact C-N 3.32Å; T241-R243 PolarHBondContact O-N 3.26Å; T241-W244 PolarHBondContact O-N 2.99Å; T241-W244 VanDerWaalsContact O-N 3.16Å
242	L	96.3	Very high	97.3	Very high	4 Å²	4	24.8 Å²	24.8	2%	0.021	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-29.5	179.4	179	56.4	0	0	0	114.7	I30 T33 R34 M37 Y61 H189	I30-L242 HydrophobicContact CG2-CB 4.4Å; I30-L242 HydrophobicContact CG2-CD2 4.33Å; T33-L242 HydrophobicContact CG2-CD1 4.25Å; T33-L242 HydrophobicContact CG2-CD2 3.81Å; R34-L242 HydrophobicContact CB-CD1 3.9Å; R34-L242 HydrophobicContact CG-CD1 4.35Å; M37-L242 HydrophobicContact CB-CD1 4.42Å; M37-L242 HydrophobicContact CG-CD1 3.96Å; Y61-L242 HydrophobicContact CD1-CD2 3.68Å; Y61-L242 HydrophobicContact CE1-CD2 3.8Å; H189-L242 PolarHBondContact CE1-N 3.2Å; H189-L242 VanDerWaalsContact CE1-N 3.3Å; H189-L242 PolarHBondContact ND1-N 2.84Å; H189-L242 VanDerWaalsContact ND1-N 3.14Å
243	R	97.3	Very high	97.1	Very high	6 Å²	6	28 Å²	28	2%	0.023	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-5.4	-175.9	-73.7	89.1	170.5	98.4	-2.9	115	Y61 E136 L196 T241 P245 L246 S247	Y61-R243 VanDerWaalsContact CE1-NH2 3.28Å; E136-R243 VanDerWaalsContact CD-NH2 3.25Å; E136-R243 IonicContact OE1-CZ 3.91Å; E136-R243 VanDerWaalsContact OE1-CZ 3.26Å; E136-R243 IonicContact OE1-NE 3.77Å; E136-R243 PolarHBondContact OE1-NE 3.27Å; E136-R243 IonicContact OE1-NH2 2.76Å; E136-R243 PolarHBondContact OE1-NH2 3.06Å; E136-R243 IonicContact OE2-CZ 3.78Å; E136-R243 IonicContact OE2-NE 3.56Å; E136-R243 IonicContact OE2-NH2 2.8Å; E136-R243 PolarHBondContact OE2-NH2 3.13Å; L196-R243 HydrophobicContact CB-CB 4.38Å; L196-R243 HydrophobicContact CD2-CB 3.96Å; L196-R243 HydrophobicContact CD2-CG 3.71Å; T241-R243 PolarHBondContact O-N 3.26Å; R243-P245 VanDerWaalsContact C-CD 3.48Å; R243-L246 PolarHBondContact O-N 2.98Å; R243-S247 WeakPolarHBondContact O-CB 3.46Å; R243-S247 PolarHBondContact O-N 2.95Å; R243-S247 PolarHBondContact O-OG 3.38Å
244	W	97.7	Very high	96.8	Very high	12 Å²	12	24.7 Å²	24.7	5%	0.045	13%	0.125	C	C	.	.	H	α-helix	trans	-58.9	-46.3	-178	87.5	-102.4	0	0	0	113.5	M238 H239 T241 L246 S247 A248 M279 I282 Y283	M238-W244 WeakPolarHBondContact O-CB 3.32Å; H239-W244 VanDerWaalsContact CA-CD1 3.49Å; H239-W244 AromaticContact CD2-CE3 3.9Å; H239-W244 PolarHBondContact O-NE1 2.89Å; T241-W244 PolarHBondContact O-N 2.99Å; T241-W244 VanDerWaalsContact O-N 3.16Å; W244-L246 VanDerWaalsContact C-N 3.34Å; W244-L246 PolarHBondContact O-N 3.42Å; W244-S247 WeakPolarHBondContact O-CB 3.34Å; W244-S247 PolarHBondContact O-N 3.47Å; W244-A248 PolarHBondContact O-N 3.49Å; W244-M279 HydrophobicContact CH2-CG 3.83Å; W244-M279 HydrophobicContact CZ3-CG 3.74Å; W244-I282 HydrophobicContact CH2-CD1 3.74Å; W244-I282 HydrophobicContact CZ2-CD1 3.44Å; W244-I282 VanDerWaalsContact CZ2-CD1 3.44Å; W244-Y283 HydrophobicContact CH2-CE2 4.25Å; W244-Y283 AromaticContact CZ2-CE2 3.92Å; W244-Y283 HydrophobicContact CZ2-CE2 3.92Å
245	P	97.2	Very high	96.6	Very high	4 Å²	4	22.7 Å²	22.7	3%	0.026	11%	0.111	C	C	.	.	H	α-helix	trans	-73.9	-31.7	-175.2	31.6	-31.8	0	0	0	110.5	F41 R243 A248 L249 M279 Y283	F41-P245 HydrophobicContact CD2-CB 4.35Å; F41-P245 HydrophobicContact CD2-CG 4.43Å; F41-P245 HydrophobicContact CE2-CB 3.63Å; F41-P245 HydrophobicContact CE2-CG 3.67Å; F41-P245 HydrophobicContact CZ-CB 3.75Å; F41-P245 HydrophobicContact CZ-CG 4.21Å; R243-P245 VanDerWaalsContact C-CD 3.48Å; P245-A248 WeakPolarHBondContact O-CB 3.42Å; P245-A248 PolarHBondContact O-N 3Å; P245-L249 WeakPolarHBondContact O-CG 3.48Å; P245-L249 PolarHBondContact O-N 3.46Å; P245-M279 HydrophobicContact CB-CE 4.06Å; P245-Y283 HydrophobicContact CB-CE2 4.49Å
246	L	97.6	Very high	96.4	Very high	21 Å²	21	22.7 Å²	22.7	11%	0.11	11%	0.111	C	C	.	.	H	α-helix	trans	-65.1	-40.4	172.9	-60.4	178.8	0	0	0	111.7	M37 F41 T68 I72 L196 R243 W244 A248 L249 V250	M37-L246 HydrophobicContact CE-CD2 4.17Å; F41-L246 HydrophobicContact CZ-CD2 4.41Å; T68-L246 HydrophobicContact CG2-CD1 4Å; T68-L246 HydrophobicContact CG2-CD2 4.16Å; I72-L246 HydrophobicContact CD1-CD2 3.85Å; L196-L246 HydrophobicContact CD2-CB 4.12Å; L196-L246 HydrophobicContact CD2-CD1 4.48Å; R243-L246 PolarHBondContact O-N 2.98Å; W244-L246 VanDerWaalsContact C-N 3.34Å; W244-L246 PolarHBondContact O-N 3.42Å; L246-A248 VanDerWaalsContact C-N 3.33Å; L246-L249 HydrophobicContact CD2-CD1 4.44Å; L246-L249 WeakPolarHBondContact O-CB 3.32Å; L246-L249 PolarHBondContact O-N 3.43Å; L246-V250 WeakPolarHBondContact O-CG2 3.25Å; L246-V250 PolarHBondContact O-N 3.25Å
247	S	98.3	Very high	96	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.3	-39.6	175.5	-55.9	0	0	0	0	111.4	A235 R243 W244 V250 L251	A235-S247 WeakPolarHBondContact CB-OG 3.45Å; R243-S247 WeakPolarHBondContact O-CB 3.46Å; R243-S247 PolarHBondContact O-N 2.95Å; R243-S247 PolarHBondContact O-OG 3.38Å; W244-S247 WeakPolarHBondContact O-CB 3.34Å; W244-S247 PolarHBondContact O-N 3.47Å; S247-V250 PolarHBondContact O-N 3.4Å; S247-L251 WeakPolarHBondContact O-CG 3.35Å; S247-L251 PolarHBondContact O-N 3.09Å; S247-L251 VanDerWaalsContact O-N 3.13Å
248	A	98.3	Very high	95.4	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-61	-46.7	172.5	0	0	0	0	0	111.2	A236 W244 P245 L246 V250 L251 L252 L275 M279	A236-A248 HydrophobicContact CB-CB 4.32Å; W244-A248 PolarHBondContact O-N 3.49Å; P245-A248 WeakPolarHBondContact O-CB 3.42Å; P245-A248 PolarHBondContact O-N 3Å; L246-A248 VanDerWaalsContact C-N 3.33Å; A248-V250 PolarHBondContact O-N 3.29Å; A248-L251 PolarHBondContact O-N 2.99Å; A248-L252 VanDerWaalsContact O-CG 3.3Å; A248-L252 WeakPolarHBondContact O-CG 3.49Å; A248-L252 PolarHBondContact O-N 2.64Å; A248-L275 HydrophobicContact CB-CB 4.42Å; A248-L275 HydrophobicContact CB-CD1 4.41Å; A248-L275 HydrophobicContact CB-CD2 4.05Å; A248-M279 HydrophobicContact CB-CG 4.41Å; A248-M279 HydrophobicContact CB-SD 3.79Å
249	L	97.1	Very high	94.8	Very high	15 Å²	15	22.9 Å²	22.9	8%	0.079	11%	0.11	C	C	.	.	H	α-helix	trans	-57.2	-46.2	175.9	-72.4	-176.8	0	0	0	112.7	F41 P245 L246 L251 L252 V253 M279 L288 F292	F41-L249 HydrophobicContact CE1-CD1 3.73Å; F41-L249 HydrophobicContact CE1-CD2 4.31Å; F41-L249 HydrophobicContact CE1-CG 4.13Å; F41-L249 HydrophobicContact CZ-CD1 3.7Å; F41-L249 HydrophobicContact CZ-CG 4.24Å; P245-L249 WeakPolarHBondContact O-CG 3.48Å; P245-L249 PolarHBondContact O-N 3.46Å; L246-L249 HydrophobicContact CD2-CD1 4.44Å; L246-L249 WeakPolarHBondContact O-CB 3.32Å; L246-L249 PolarHBondContact O-N 3.43Å; L249-L251 VanDerWaalsContact C-N 3.3Å; L249-L251 PolarHBondContact O-N 2.7Å; L249-L252 PolarHBondContact O-N 3.14Å; L249-V253 WeakPolarHBondContact O-CG2 3.49Å; L249-V253 PolarHBondContact O-N 3.07Å; L249-M279 HydrophobicContact CD2-CE 4.2Å; L249-M279 HydrophobicContact CG-CE 4.41Å; L249-L288 HydrophobicContact CD1-CD2 3.66Å; L249-L288 HydrophobicContact CD2-CD2 3.54Å; L249-L288 HydrophobicContact CD2-CG 3.93Å; L249-L288 HydrophobicContact CG-CD2 4.25Å; L249-F292 HydrophobicContact CD2-CD2 4.17Å; L249-F292 HydrophobicContact CD2-CE2 3.68Å
250	V	95.9	Very high	94.4	Very high	41 Å²	41	20.6 Å²	20.6	25%	0.248	10%	0.098	C	C	.	.	H	α-helix	trans	-59.3	-43.7	177.9	173.8	0	0	0	0	110.8	L196 T200 L232 L246 S247 A248 W254	L196-V250 HydrophobicContact CD1-CG2 4.1Å; T200-V250 HydrophobicContact CG2-CG1 4.5Å; L232-V250 HydrophobicContact CD1-CG1 3.72Å; L232-V250 HydrophobicContact CD2-CB 4.09Å; L232-V250 HydrophobicContact CD2-CG1 3.88Å; L232-V250 HydrophobicContact CG-CG1 4.47Å; L246-V250 WeakPolarHBondContact O-CG2 3.25Å; L246-V250 PolarHBondContact O-N 3.25Å; S247-V250 PolarHBondContact O-N 3.4Å; A248-V250 PolarHBondContact O-N 3.29Å; V250-W254 WeakPolarHBondContact O-CB 3.49Å; V250-W254 PolarHBondContact O-N 3Å
251	L	97.4	Very high	93.7	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-65.1	-39.5	176.4	-72.9	168.6	0	0	0	112.6	L229 L232 K233 A236 S247 A248 L249 W254 N255 L271 L275	L229-L251 HydrophobicContact CD2-CD2 3.91Å; L232-L251 HydrophobicContact CB-CD1 4.07Å; L232-L251 HydrophobicContact CB-CD2 3.71Å; L232-L251 HydrophobicContact CB-CG 3.81Å; L232-L251 HydrophobicContact CD1-CD2 4.16Å; K233-L251 HydrophobicContact CB-CD1 4.43Å; A236-L251 HydrophobicContact CB-CD1 3.93Å; S247-L251 WeakPolarHBondContact O-CG 3.35Å; S247-L251 PolarHBondContact O-N 3.09Å; S247-L251 VanDerWaalsContact O-N 3.13Å; A248-L251 PolarHBondContact O-N 2.99Å; L249-L251 VanDerWaalsContact C-N 3.3Å; L249-L251 PolarHBondContact O-N 2.7Å; L251-W254 PolarHBondContact O-N 2.92Å; L251-N255 VanDerWaalsContact O-CB 3.29Å; L251-N255 WeakPolarHBondContact O-CB 3.39Å; L251-N255 PolarHBondContact O-N 2.87Å; L251-N255 PolarHBondContact O-ND2 2.93Å; L251-L271 HydrophobicContact CD1-CD2 4.21Å; L251-L275 HydrophobicContact CB-CD1 3.81Å; L251-L275 HydrophobicContact CD1-CD1 3.75Å; L251-L275 HydrophobicContact CG-CD1 4.46Å
252	L	97.3	Very high	92.6	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-68.5	-43.7	178	-68.9	173.6	0	0	0	111.4	A248 L249 W254 N255 L256 L275 I276 M279 F292	A248-L252 VanDerWaalsContact O-CG 3.3Å; A248-L252 WeakPolarHBondContact O-CG 3.49Å; A248-L252 PolarHBondContact O-N 2.64Å; L249-L252 PolarHBondContact O-N 3.14Å; L252-W254 VanDerWaalsContact C-N 3.31Å; L252-W254 PolarHBondContact O-N 3.47Å; L252-N255 PolarHBondContact O-N 3.14Å; L252-L256 HydrophobicContact CB-CD1 4.47Å; L252-L256 HydrophobicContact CD2-CD1 3.86Å; L252-L256 WeakPolarHBondContact O-CB 3.24Å; L252-L256 WeakPolarHBondContact O-CG 3.5Å; L252-L256 PolarHBondContact O-N 3.39Å; L252-L275 HydrophobicContact CD2-CB 4.34Å; L252-I276 HydrophobicContact CD1-CG1 4.15Å; L252-I276 HydrophobicContact CD2-CD1 4.04Å; L252-I276 HydrophobicContact CD2-CG1 3.79Å; L252-M279 HydrophobicContact CD1-SD 4.19Å; L252-F292 HydrophobicContact CB-CD1 3.76Å; L252-F292 HydrophobicContact CB-CD2 4.4Å; L252-F292 HydrophobicContact CB-CE1 3.94Å; L252-F292 HydrophobicContact CB-CG 4Å; L252-F292 HydrophobicContact CB-CZ 4.38Å; L252-F292 HydrophobicContact CD1-CB 4.13Å; L252-F292 HydrophobicContact CD1-CD2 4.14Å; L252-F292 HydrophobicContact CD1-CG 4.07Å
253	V	93.9	Very high	91.3	Very high	68 Å²	68	21.2 Å²	21.2	41%	0.412	11%	0.112	S	C	.	.	I	π-helix	trans	-58.1	-46.4	173.2	171.3	0	0	0	0	110.4	L249 N257 F258 F292	L249-V253 WeakPolarHBondContact O-CG2 3.49Å; L249-V253 PolarHBondContact O-N 3.07Å; V253-N257 WeakPolarHBondContact O-CA 3.29Å; V253-N257 VanDerWaalsContact O-CB 3.29Å; V253-N257 WeakPolarHBondContact O-CB 3.43Å; V253-N257 PolarHBondContact O-N 2.9Å; V253-F258 PolarHBondContact O-N 2.71Å; V253-F292 HydrophobicContact CG2-CE1 3.97Å; V253-F292 HydrophobicContact CG2-CZ 3.61Å
254	W	92.2	Very high	90	Very high	16 Å²	16	21.5 Å²	21.5	6%	0.061	12%	0.115	C	C	.	.	I	π-helix	trans	-60.9	-58.2	178	178.6	-94.6	0	0	0	112.2	L203 A207 R225 L229 V250 L251 L252 F258 V259	L203-W254 HydrophobicContact CD1-CD2 3.7Å; L203-W254 HydrophobicContact CD1-CE3 3.81Å; L203-W254 HydrophobicContact CD1-CG 4.41Å; L203-W254 HydrophobicContact CD1-CH2 3.61Å; L203-W254 HydrophobicContact CD1-CZ2 3.52Å; L203-W254 HydrophobicContact CD1-CZ3 3.76Å; L203-W254 HydrophobicContact CD2-CB 4.05Å; L203-W254 HydrophobicContact CD2-CD2 3.62Å; L203-W254 HydrophobicContact CD2-CE3 3.59Å; L203-W254 HydrophobicContact CD2-CG 3.81Å; L203-W254 HydrophobicContact CD2-CZ3 4.23Å; L203-W254 HydrophobicContact CG-CD2 3.79Å; L203-W254 HydrophobicContact CG-CE3 3.5Å; L203-W254 VanDerWaalsContact CG-CE3 3.5Å; L203-W254 HydrophobicContact CG-CG 4.47Å; L203-W254 HydrophobicContact CG-CH2 4.01Å; L203-W254 HydrophobicContact CG-CZ2 4.29Å; L203-W254 HydrophobicContact CG-CZ3 3.6Å; A207-W254 HydrophobicContact CB-CH2 4.07Å; A207-W254 HydrophobicContact CB-CZ3 4.1Å; R225-W254 HydrophobicContact CG-CZ2 4.23Å; L229-W254 HydrophobicContact CD2-CG 4.43Å; V250-W254 WeakPolarHBondContact O-CB 3.49Å; V250-W254 PolarHBondContact O-N 3Å; L251-W254 PolarHBondContact O-N 2.92Å; L252-W254 VanDerWaalsContact C-N 3.31Å; L252-W254 PolarHBondContact O-N 3.47Å; W254-F258 HydrophobicContact CD2-CD1 4.24Å; W254-F258 HydrophobicContact CE3-CB 4.28Å; W254-F258 AromaticContact CE3-CD1 3.45Å; W254-F258 HydrophobicContact CE3-CD1 3.45Å; W254-F258 VanDerWaalsContact CE3-CD1 3.45Å; W254-F258 AromaticContact CE3-CE1 3.99Å; W254-F258 HydrophobicContact CE3-CE1 3.99Å; W254-F258 HydrophobicContact CE3-CG 4.09Å; W254-F258 AromaticContact CH2-CD1 3.83Å; W254-F258 HydrophobicContact CH2-CD1 3.83Å; W254-F258 AromaticContact CH2-CE1 3.81Å; W254-F258 HydrophobicContact CH2-CE1 3.81Å; W254-F258 AromaticContact CZ3-CD1 3.22Å; W254-F258 HydrophobicContact CZ3-CD1 3.22Å; W254-F258 AromaticContact CZ3-CE1 3.3Å; W254-F258 HydrophobicContact CZ3-CE1 3.3Å; W254-F258 HydrophobicContact CZ3-CG 4.23Å; W254-F258 HydrophobicContact CZ3-CZ 4.36Å; W254-F258 PolarHBondContact O-N 3.1Å; W254-V259 WeakPolarHBondContact O-CG2 3.43Å; W254-V259 PolarHBondContact O-N 3.49Å
255	N	94.4	Very high	88.2	Confident	2 Å²	2	23.8 Å²	23.8	1%	0.011	14%	0.142	C	C	.	.	I	π-helix	trans	-71.3	-35	-170.7	-74.7	-58.2	0	0	0	112.9	L251 L252 Y260 S267 D268 S272	L251-N255 VanDerWaalsContact O-CB 3.29Å; L251-N255 WeakPolarHBondContact O-CB 3.39Å; L251-N255 PolarHBondContact O-N 2.87Å; L251-N255 PolarHBondContact O-ND2 2.93Å; L252-N255 PolarHBondContact O-N 3.14Å; N255-Y260 WeakPolarHBondContact O-CE2 3.49Å; N255-S267 WeakPolarHBondContact O-CB 3.12Å; N255-S267 PolarHBondContact O-OG 3.08Å; N255-D268 PolarHBondContact OD1-N 3.47Å; N255-S272 VanDerWaalsContact CB-OG 3.31Å; N255-S272 WeakPolarHBondContact CB-OG 3.42Å
256	L	94.8	Very high	87	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.16	C	C	.	.	I	π-helix	trans	-101.4	-19.1	-172.2	-53.9	-178.7	0	0	0	113.4	L252 L269 I276 F292 R295 Y296 I299	L252-L256 HydrophobicContact CB-CD1 4.47Å; L252-L256 HydrophobicContact CD2-CD1 3.86Å; L252-L256 WeakPolarHBondContact O-CB 3.24Å; L252-L256 WeakPolarHBondContact O-CG 3.5Å; L252-L256 PolarHBondContact O-N 3.39Å; L256-L269 HydrophobicContact CD2-CD2 3.84Å; L256-I276 HydrophobicContact CD1-CD1 4.1Å; L256-F292 HydrophobicContact CD1-CB 4.29Å; L256-F292 HydrophobicContact CD1-CD1 4.15Å; L256-R295 HydrophobicContact CB-CG 3.81Å; L256-R295 PolarHBondContact O-NE 3.03Å; L256-R295 PolarHBondContact O-NH2 3.49Å; L256-Y296 HydrophobicContact CD2-CD2 4.35Å; L256-I299 HydrophobicContact CB-CD1 4Å; L256-I299 HydrophobicContact CD2-CD1 3.83Å; L256-I299 WeakPolarHBondContact O-CD1 3.32Å
257	N	89.4	Confident	86.5	Confident	25 Å²	25	28 Å²	28	13%	0.134	16%	0.164	C	C	.	.	I	π-helix	trans	-119	-63.3	-179.1	-61.7	-90.2	0	0	0	111.3	V253 V259 Y260 I261 F292	V253-N257 WeakPolarHBondContact O-CA 3.29Å; V253-N257 VanDerWaalsContact O-CB 3.29Å; V253-N257 WeakPolarHBondContact O-CB 3.43Å; V253-N257 PolarHBondContact O-N 2.9Å; N257-V259 PolarHBondContact O-N 3.26Å; N257-Y260 PolarHBondContact O-N 3.38Å; N257-Y260 VanDerWaalsContact O-N 3.08Å; N257-I261 HydrophobicContact CB-CD1 4.31Å; N257-I261 WeakPolarHBondContact O-CG1 3.42Å; N257-I261 PolarHBondContact O-N 3.4Å; N257-F292 WeakPolarHBondContact ND2-CE1 3.39Å
258	F	85	Confident	86.3	Confident	65 Å²	65	31.1 Å²	31.1	29%	0.285	18%	0.18	S	C	.	.	I	π-helix	trans	-61.6	-45	-168.7	-165.1	-102.9	0	0	0	113	A207 V253 W254 Y260 I261 L262	A207-F258 HydrophobicContact CB-CE1 3.52Å; A207-F258 HydrophobicContact CB-CZ 3.74Å; V253-F258 PolarHBondContact O-N 2.71Å; W254-F258 HydrophobicContact CD2-CD1 4.24Å; W254-F258 HydrophobicContact CE3-CB 4.28Å; W254-F258 AromaticContact CE3-CD1 3.45Å; W254-F258 HydrophobicContact CE3-CD1 3.45Å; W254-F258 VanDerWaalsContact CE3-CD1 3.45Å; W254-F258 AromaticContact CE3-CE1 3.99Å; W254-F258 HydrophobicContact CE3-CE1 3.99Å; W254-F258 HydrophobicContact CE3-CG 4.09Å; W254-F258 AromaticContact CH2-CD1 3.83Å; W254-F258 HydrophobicContact CH2-CD1 3.83Å; W254-F258 AromaticContact CH2-CE1 3.81Å; W254-F258 HydrophobicContact CH2-CE1 3.81Å; W254-F258 AromaticContact CZ3-CD1 3.22Å; W254-F258 HydrophobicContact CZ3-CD1 3.22Å; W254-F258 AromaticContact CZ3-CE1 3.3Å; W254-F258 HydrophobicContact CZ3-CE1 3.3Å; W254-F258 HydrophobicContact CZ3-CG 4.23Å; W254-F258 HydrophobicContact CZ3-CZ 4.36Å; W254-F258 PolarHBondContact O-N 3.1Å; F258-Y260 VanDerWaalsContact C-N 3.26Å; F258-Y260 PolarHBondContact O-N 2.92Å; F258-I261 PolarHBondContact O-N 3.1Å; F258-L262 HydrophobicContact CD1-CD1 3.75Å; F258-L262 HydrophobicContact CD1-CG 4.25Å; F258-L262 HydrophobicContact CE1-CD1 3.14Å; F258-L262 HydrophobicContact CE1-CG 4.02Å; F258-L262 HydrophobicContact CE2-CD1 4.09Å; F258-L262 HydrophobicContact CE2-CG 4.34Å; F258-L262 HydrophobicContact CG-CD1 4.45Å; F258-L262 HydrophobicContact CZ-CD1 3.36Å; F258-L262 HydrophobicContact CZ-CG 4.09Å; F258-L262 WeakPolarHBondContact O-CB 3.34Å; F258-L262 WeakPolarHBondContact O-CG 3.37Å; F258-L262 PolarHBondContact O-N 2.77Å
259	V	85.2	Confident	86.1	Confident	1 Å²	1	33 Å²	33	1%	0.006	19%	0.191	C	C	.	.	H	α-helix	trans	-58.5	-36.9	176.6	166.9	0	0	0	0	112.4	W254 N257 G263 T264	W254-V259 WeakPolarHBondContact O-CG2 3.43Å; W254-V259 PolarHBondContact O-N 3.49Å; N257-V259 PolarHBondContact O-N 3.26Å; V259-G263 WeakPolarHBondContact O-CA 3.3Å; V259-G263 PolarHBondContact O-N 2.9Å; V259-T264 WeakPolarHBondContact CA-OG1 3.34Å; V259-T264 PolarHBondContact O-N 2.88Å; V259-T264 PolarHBondContact O-OG1 3.29Å
260	Y	85.5	Confident	86.1	Confident	27 Å²	27	42.5 Å²	42.5	11%	0.106	23%	0.225	C	C	.	.	H	α-helix	trans	-79.2	-41.5	-179.1	-75.4	-92.3	0	0	0	112.2	N255 N257 F258 G263 I299 N444	N255-Y260 WeakPolarHBondContact O-CE2 3.49Å; N257-Y260 PolarHBondContact O-N 3.38Å; N257-Y260 VanDerWaalsContact O-N 3.08Å; F258-Y260 VanDerWaalsContact C-N 3.26Å; F258-Y260 PolarHBondContact O-N 2.92Å; Y260-G263 PolarHBondContact O-N 2.7Å; Y260-I299 HydrophobicContact CD1-CG1 4.35Å; Y260-I299 HydrophobicContact CD2-CD1 3.71Å; Y260-I299 HydrophobicContact CD2-CG1 4.29Å; Y260-I299 HydrophobicContact CE1-CD1 4.37Å; Y260-I299 HydrophobicContact CE1-CG1 3.95Å; Y260-I299 HydrophobicContact CE1-CG2 4.1Å; Y260-I299 HydrophobicContact CE2-CD1 3.43Å; Y260-I299 VanDerWaalsContact CE2-CD1 3.43Å; Y260-I299 HydrophobicContact CE2-CG1 3.92Å; Y260-I299 HydrophobicContact CE2-CG2 4.09Å; Y260-I299 HydrophobicContact CG-CD1 4.33Å; Y260-I299 VanDerWaalsContact CZ-CG2 3.47Å; Y260-I299 WeakPolarHBondContact OH-CG2 3.17Å; Y260-N444 PolarHBondContact O-ND2 2.96Å
261	I	78.9	Confident	86.1	Confident	100 Å²	100	41.1 Å²	41.1	51%	0.513	22%	0.217	S	C	.	.	H	α-helix	trans	-63.8	-42.7	177.7	-68.7	167.3	0	0	0	111	N257 F258	N257-I261 HydrophobicContact CB-CD1 4.31Å; N257-I261 WeakPolarHBondContact O-CG1 3.42Å; N257-I261 PolarHBondContact O-N 3.4Å; F258-I261 PolarHBondContact O-N 3.1Å
262	L	74.2	Confident	86.2	Confident	27 Å²	27	41.1 Å²	41.1	14%	0.141	22%	0.217	C	C	.	.	H	α-helix	trans	-80	-18.6	177	-65.5	-166	0	0	0	113.4	F258 T264 F583 R584	F258-L262 HydrophobicContact CD1-CD1 3.75Å; F258-L262 HydrophobicContact CD1-CG 4.25Å; F258-L262 HydrophobicContact CE1-CD1 3.14Å; F258-L262 HydrophobicContact CE1-CG 4.02Å; F258-L262 HydrophobicContact CE2-CD1 4.09Å; F258-L262 HydrophobicContact CE2-CG 4.34Å; F258-L262 HydrophobicContact CG-CD1 4.45Å; F258-L262 HydrophobicContact CZ-CD1 3.36Å; F258-L262 HydrophobicContact CZ-CG 4.09Å; F258-L262 WeakPolarHBondContact O-CB 3.34Å; F258-L262 WeakPolarHBondContact O-CG 3.37Å; F258-L262 PolarHBondContact O-N 2.77Å; L262-T264 HydrophobicContact CB-CG2 3.81Å; L262-T264 HydrophobicContact CD1-CG2 4.4Å; L262-F583 HydrophobicContact CD2-CD1 4.36Å; L262-F583 HydrophobicContact CD2-CG 4.34Å; L262-R584 WeakPolarHBondContact O-CG 3.11Å
263	G	70.6	Confident	86.2	Confident	15 Å²	15	45.3 Å²	45.3	16%	0.155	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	34.4	-177.5	0	0	0	0	0	113.8	V259 Y260	V259-G263 WeakPolarHBondContact O-CA 3.3Å; V259-G263 PolarHBondContact O-N 2.9Å; Y260-G263 PolarHBondContact O-N 2.7Å
264	T	68.9	Low	86.4	Confident	13 Å²	13	46.6 Å²	46.6	8%	0.08	24%	0.236	C	C	.	.			trans	-81.9	-26.6	-178.2	57.8	0	0	0	0	112.8	V259 L262 E266 S587	V259-T264 WeakPolarHBondContact CA-OG1 3.34Å; V259-T264 PolarHBondContact O-N 2.88Å; V259-T264 PolarHBondContact O-OG1 3.29Å; L262-T264 HydrophobicContact CB-CG2 3.81Å; L262-T264 HydrophobicContact CD1-CG2 4.4Å; T264-E266 VanDerWaalsContact C-N 3.31Å; T264-E266 PolarHBondContact O-N 3.43Å; T264-S587 VanDerWaalsContact CA-OG 3.25Å; T264-S587 WeakPolarHBondContact CA-OG 3.48Å; T264-S587 VanDerWaalsContact CB-OG 3.25Å; T264-S587 WeakPolarHBondContact CB-OG 3.34Å; T264-S587 WeakPolarHBondContact CG2-OG 3.44Å
265	G	61	Low	86.7	Confident	60 Å²	60	45.9 Å²	45.9	62%	0.619	23%	0.233	S	C	*	.			trans	76.2	-0.1	170.4	0	0	0	0	0	117.1	S267	G265-S267 PolarHBondContact O-N 3.33Å
266	E	72.2	Confident	86.9	Confident	84 Å²	84	46.2 Å²	46.2	39%	0.393	24%	0.235	S	C	.	.			trans	-97.2	70.1	-179.4	-66.5	173.1	-178.5	0	0	111.4	R225 T264 R591	R225-E266 IonicContact CZ-OE2 3.37Å; R225-E266 IonicContact NH1-OE2 3.26Å; R225-E266 PolarHBondContact NH1-OE2 2.73Å; T264-E266 VanDerWaalsContact C-N 3.31Å; T264-E266 PolarHBondContact O-N 3.43Å; E266-R591 WeakPolarHBondContact OE1-CG 3.41Å
267	S	85.8	Confident	87.1	Confident	28 Å²	28	51.3 Å²	51.3	20%	0.196	26%	0.262	C	S	.	.			trans	-102.5	130.2	178.5	-176.5	0	0	0	0	111.7	N255 G265 L269	N255-S267 WeakPolarHBondContact O-CB 3.12Å; N255-S267 PolarHBondContact O-OG 3.08Å; G265-S267 PolarHBondContact O-N 3.33Å; S267-L269 PolarHBondContact O-N 3.41Å; S267-L269 WeakPolarHBondContact OG-CD2 3.37Å
268	D	93.4	Very high	87.5	Confident	66 Å²	66	51.7 Å²	51.7	35%	0.353	26%	0.264	S	S	.	.			trans	-87.8	78	171.9	-170.8	-10.5	0	0	0	110.8	N255 R270 L271 S272	N255-D268 PolarHBondContact OD1-N 3.47Å; D268-R270 VanDerWaalsContact C-N 3.26Å; D268-R270 PolarHBondContact O-N 3.49Å; D268-R270 PolarHBondContact OD1-N 2.95Å; D268-L271 HydrophobicContact CB-CB 4.11Å; D268-L271 PolarHBondContact O-N 3.04Å; D268-L271 WeakPolarHBondContact OD1-CB 3.31Å; D268-L271 PolarHBondContact OD1-N 3.25Å; D268-L271 WeakPolarHBondContact OD2-CB 3.49Å; D268-S272 PolarHBondContact O-N 2.87Å; D268-S272 PolarHBondContact O-OG 3.13Å
269	L	94.8	Very high	88.2	Confident	41 Å²	41	48.6 Å²	48.6	22%	0.215	25%	0.25	C	S	.	.	H	α-helix	trans	-63.8	-29.3	-178.5	-63.6	-179.3	0	0	0	113.3	L256 S267 S272 E273 Y296 I299	L256-L269 HydrophobicContact CD2-CD2 3.84Å; S267-L269 PolarHBondContact O-N 3.41Å; S267-L269 WeakPolarHBondContact OG-CD2 3.37Å; L269-S272 PolarHBondContact O-N 2.97Å; L269-E273 PolarHBondContact O-N 3.32Å; L269-Y296 HydrophobicContact CB-CE2 4.18Å; L269-Y296 WeakPolarHBondContact O-CE2 3.42Å; L269-I299 HydrophobicContact CD1-CG2 3.9Å; L269-I299 HydrophobicContact CD2-CG2 3.74Å; L269-I299 HydrophobicContact CG-CG2 4.5Å
270	R	96.8	Very high	88.8	Confident	213 Å²	213	50.5 Å²	50.5	80%	0.804	26%	0.26	S	S	*	.	H	α-helix	trans	-67.7	-43.2	177.5	-70	-178.2	179.1	174.6	-0.5	110.9	D268 K274	D268-R270 VanDerWaalsContact C-N 3.26Å; D268-R270 PolarHBondContact O-N 3.49Å; D268-R270 PolarHBondContact OD1-N 2.95Å; R270-K274 PolarHBondContact O-N 2.9Å
271	L	97.4	Very high	89.4	Confident	13 Å²	13	53.8 Å²	53.8	7%	0.068	29%	0.287	C	S	.	.	H	α-helix	trans	-64.9	-43.3	173.2	179.7	60.3	0	0	0	111.1	K233 L251 D268 E273 K274 L275	K233-L271 HydrophobicContact CB-CD2 4.27Å; K233-L271 HydrophobicContact CD-CD1 4.25Å; K233-L271 HydrophobicContact CD-CD2 3.95Å; K233-L271 HydrophobicContact CG-CD1 4.12Å; K233-L271 HydrophobicContact CG-CD2 4.05Å; L251-L271 HydrophobicContact CD1-CD2 4.21Å; D268-L271 HydrophobicContact CB-CB 4.11Å; D268-L271 PolarHBondContact O-N 3.04Å; D268-L271 WeakPolarHBondContact OD1-CB 3.31Å; D268-L271 PolarHBondContact OD1-N 3.25Å; D268-L271 WeakPolarHBondContact OD2-CB 3.49Å; L271-E273 PolarHBondContact O-N 3.21Å; L271-K274 PolarHBondContact O-N 3.29Å; L271-L275 HydrophobicContact CD1-CD1 4.12Å; L271-L275 HydrophobicContact CD1-CD2 4.41Å; L271-L275 HydrophobicContact CD1-CG 4.01Å; L271-L275 HydrophobicContact CG-CD1 3.89Å; L271-L275 HydrophobicContact CG-CG 4.24Å; L271-L275 VanDerWaalsContact O-CG 3.29Å; L271-L275 WeakPolarHBondContact O-CG 3.35Å; L271-L275 PolarHBondContact O-N 3.23Å
272	S	98.1	Very high	90.2	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-58.5	-45.8	178.1	-61.9	0	0	0	0	112.6	N255 D268 L269 K274 L275 I276	N255-S272 VanDerWaalsContact CB-OG 3.31Å; N255-S272 WeakPolarHBondContact CB-OG 3.42Å; D268-S272 PolarHBondContact O-N 2.87Å; D268-S272 PolarHBondContact O-OG 3.13Å; L269-S272 PolarHBondContact O-N 2.97Å; S272-K274 PolarHBondContact O-N 3.01Å; S272-L275 PolarHBondContact O-N 3.22Å; S272-I276 WeakPolarHBondContact O-CB 3.47Å; S272-I276 WeakPolarHBondContact O-CD1 3.42Å; S272-I276 VanDerWaalsContact O-CG1 3.29Å; S272-I276 WeakPolarHBondContact O-CG1 3.44Å; S272-I276 PolarHBondContact O-N 3.31Å
273	E	98.2	Very high	91.3	Very high	88 Å²	88	51.5 Å²	51.5	41%	0.411	28%	0.275	S	S	.	.	H	α-helix	trans	-58.6	-48.2	176	-176	171.3	-117.6	0	0	111.6	L269 L271 L275 I276 L277 Y296	L269-E273 PolarHBondContact O-N 3.32Å; L271-E273 PolarHBondContact O-N 3.21Å; E273-L275 PolarHBondContact O-N 3.01Å; E273-I276 PolarHBondContact O-N 3.19Å; E273-L277 HydrophobicContact CG-CD1 4.14Å; E273-L277 WeakPolarHBondContact O-CG 3.45Å; E273-L277 PolarHBondContact O-N 3.01Å; E273-Y296 HydrophobicContact CB-CE1 4.33Å; E273-Y296 HydrophobicContact CB-CE2 3.86Å; E273-Y296 HydrophobicContact CG-CE1 4.24Å; E273-Y296 PolarHBondContact OE1-OH 3.05Å
274	K	98.4	Very high	92.6	Very high	95 Å²	95	54.6 Å²	54.6	41%	0.413	29%	0.292	S	S	.	.	H	α-helix	trans	-57.2	-50.6	177.4	-173.9	-169.8	174.5	-162.8	0	111.4	R270 L271 S272 I276 L277 D278	R270-K274 PolarHBondContact O-N 2.9Å; L271-K274 PolarHBondContact O-N 3.29Å; S272-K274 PolarHBondContact O-N 3.01Å; K274-I276 VanDerWaalsContact C-N 3.31Å; K274-I276 PolarHBondContact O-N 2.96Å; K274-L277 PolarHBondContact O-N 3.31Å; K274-D278 VanDerWaalsContact CE-OD2 3.27Å; K274-D278 WeakPolarHBondContact CE-OD2 3.45Å; K274-D278 IonicContact NZ-OD2 2.96Å; K274-D278 WeakPolarHBondContact O-CB 3.21Å; K274-D278 VanDerWaalsContact O-CG 3.27Å; K274-D278 PolarHBondContact O-N 2.67Å
275	L	98.6	Very high	93.9	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.5	-39.8	-178.8	-68.9	174.2	0	0	0	112	A236 A248 L251 L252 L271 S272 E273 M279	A236-L275 HydrophobicContact CB-CD2 3.79Å; A248-L275 HydrophobicContact CB-CB 4.42Å; A248-L275 HydrophobicContact CB-CD1 4.41Å; A248-L275 HydrophobicContact CB-CD2 4.05Å; L251-L275 HydrophobicContact CB-CD1 3.81Å; L251-L275 HydrophobicContact CD1-CD1 3.75Å; L251-L275 HydrophobicContact CG-CD1 4.46Å; L252-L275 HydrophobicContact CD2-CB 4.34Å; L271-L275 HydrophobicContact CD1-CD1 4.12Å; L271-L275 HydrophobicContact CD1-CD2 4.41Å; L271-L275 HydrophobicContact CD1-CG 4.01Å; L271-L275 HydrophobicContact CG-CD1 3.89Å; L271-L275 HydrophobicContact CG-CG 4.24Å; L271-L275 VanDerWaalsContact O-CG 3.29Å; L271-L275 WeakPolarHBondContact O-CG 3.35Å; L271-L275 PolarHBondContact O-N 3.23Å; S272-L275 PolarHBondContact O-N 3.22Å; E273-L275 PolarHBondContact O-N 3.01Å; L275-M279 WeakPolarHBondContact O-CB 3.46Å; L275-M279 VanDerWaalsContact O-CG 3.27Å; L275-M279 WeakPolarHBondContact O-CG 3.27Å; L275-M279 PolarHBondContact O-N 3.05Å
276	I	98.6	Very high	95.6	Very high	9 Å²	9	57.1 Å²	57.1	5%	0.046	29%	0.287	C	S	.	.	H	α-helix	trans	-61.1	-47.4	174.9	-73.8	162.2	0	0	0	110.4	L252 L256 S272 E273 K274 M279 L280 V289 F292 S293 Y296	L252-I276 HydrophobicContact CD1-CG1 4.15Å; L252-I276 HydrophobicContact CD2-CD1 4.04Å; L252-I276 HydrophobicContact CD2-CG1 3.79Å; L256-I276 HydrophobicContact CD1-CD1 4.1Å; S272-I276 WeakPolarHBondContact O-CB 3.47Å; S272-I276 WeakPolarHBondContact O-CD1 3.42Å; S272-I276 VanDerWaalsContact O-CG1 3.29Å; S272-I276 WeakPolarHBondContact O-CG1 3.44Å; S272-I276 PolarHBondContact O-N 3.31Å; E273-I276 PolarHBondContact O-N 3.19Å; K274-I276 VanDerWaalsContact C-N 3.31Å; K274-I276 PolarHBondContact O-N 2.96Å; I276-M279 PolarHBondContact O-N 3.03Å; I276-L280 HydrophobicContact CG2-CD1 3.84Å; I276-L280 HydrophobicContact CG2-CG 4.31Å; I276-L280 WeakPolarHBondContact O-CB 3.42Å; I276-L280 WeakPolarHBondContact O-CG 3.35Å; I276-L280 PolarHBondContact O-N 2.85Å; I276-V289 HydrophobicContact CG2-CG1 4.46Å; I276-F292 HydrophobicContact CD1-CB 4.44Å; I276-F292 HydrophobicContact CG1-CB 4.43Å; I276-S293 WeakPolarHBondContact CG2-OG 3.23Å; I276-Y296 HydrophobicContact CD1-CG 4.18Å
277	L	98.4	Very high	96.8	Very high	108 Å²	108	53.3 Å²	53.3	57%	0.565	27%	0.27	S	S	*	.	H	α-helix	trans	-65.1	-43	179.6	-67.8	173.6	0	0	0	112.2	E273 K274 M279 L280 S281	E273-L277 HydrophobicContact CG-CD1 4.14Å; E273-L277 WeakPolarHBondContact O-CG 3.45Å; E273-L277 PolarHBondContact O-N 3.01Å; K274-L277 PolarHBondContact O-N 3.31Å; L277-M279 VanDerWaalsContact C-N 3.31Å; L277-M279 PolarHBondContact O-N 3.35Å; L277-L280 PolarHBondContact O-N 2.85Å; L277-S281 PolarHBondContact O-N 3.2Å
278	D	98.3	Very high	97.2	Very high	32 Å²	32	52.6 Å²	52.6	17%	0.171	26%	0.264	C	S	.	.	H	α-helix	trans	-59	-44.5	175.2	-70	-21.6	0	0	0	110.1	H239 K274 S281	H239-D278 IonicContact CE1-OD2 3.56Å; H239-D278 IonicContact NE2-OD2 3.75Å; K274-D278 VanDerWaalsContact CE-OD2 3.27Å; K274-D278 WeakPolarHBondContact CE-OD2 3.45Å; K274-D278 IonicContact NZ-OD2 2.96Å; K274-D278 WeakPolarHBondContact O-CB 3.21Å; K274-D278 VanDerWaalsContact O-CG 3.27Å; K274-D278 PolarHBondContact O-N 2.67Å; D278-S281 PolarHBondContact O-N 3.25Å; D278-S281 PolarHBondContact O-OG 3.48Å
279	M	98.3	Very high	97.4	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-67.8	-44.3	176.8	-70.8	-172.9	82.8	0	0	113.3	F41 W244 P245 A248 L249 L252 L275 I276 L277 S281 I282 Y283 V289	F41-M279 HydrophobicContact CD1-CE 4.01Å; F41-M279 HydrophobicContact CE1-CE 3.6Å; F41-M279 HydrophobicContact CZ-CE 4.17Å; W244-M279 HydrophobicContact CH2-CG 3.83Å; W244-M279 HydrophobicContact CZ3-CG 3.74Å; P245-M279 HydrophobicContact CB-CE 4.06Å; A248-M279 HydrophobicContact CB-CG 4.41Å; A248-M279 HydrophobicContact CB-SD 3.79Å; L249-M279 HydrophobicContact CD2-CE 4.2Å; L249-M279 HydrophobicContact CG-CE 4.41Å; L252-M279 HydrophobicContact CD1-SD 4.19Å; L275-M279 WeakPolarHBondContact O-CB 3.46Å; L275-M279 VanDerWaalsContact O-CG 3.27Å; L275-M279 WeakPolarHBondContact O-CG 3.27Å; L275-M279 PolarHBondContact O-N 3.05Å; I276-M279 PolarHBondContact O-N 3.03Å; L277-M279 VanDerWaalsContact C-N 3.31Å; L277-M279 PolarHBondContact O-N 3.35Å; M279-S281 PolarHBondContact O-N 3.46Å; M279-I282 PolarHBondContact O-N 2.89Å; M279-I282 VanDerWaalsContact O-N 3.11Å; M279-Y283 WeakPolarHBondContact O-CD2 3.4Å; M279-Y283 PolarHBondContact O-N 3.15Å; M279-V289 HydrophobicContact CB-CG1 3.81Å; M279-V289 HydrophobicContact CB-CG2 3.89Å; M279-V289 HydrophobicContact CE-CG2 3.74Å; M279-V289 HydrophobicContact SD-CG2 4.2Å
280	L	98.1	Very high	97.6	Very high	42 Å²	42	48.3 Å²	48.3	22%	0.22	24%	0.241	C	C	.	.	H	α-helix	trans	-64.9	-26.2	177.7	-73.5	175.9	0	0	0	112.5	I276 L277 I282 P284 V289 L290	I276-L280 HydrophobicContact CG2-CD1 3.84Å; I276-L280 HydrophobicContact CG2-CG 4.31Å; I276-L280 WeakPolarHBondContact O-CB 3.42Å; I276-L280 WeakPolarHBondContact O-CG 3.35Å; I276-L280 PolarHBondContact O-N 2.85Å; L277-L280 PolarHBondContact O-N 2.85Å; L280-I282 PolarHBondContact O-N 3.49Å; L280-P284 VanDerWaalsContact O-CA 3.24Å; L280-P284 WeakPolarHBondContact O-CA 3.4Å; L280-V289 HydrophobicContact CD2-CB 4.04Å; L280-V289 HydrophobicContact CD2-CG1 3.55Å; L280-V289 HydrophobicContact CG-CG1 3.59Å; L280-L290 HydrophobicContact CD2-CD2 4.37Å
281	S	97.8	Very high	97.6	Very high	95 Å²	95	38.5 Å²	38.5	66%	0.664	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-20	175	77.7	0	0	0	0	113.6	L277 D278 M279	L277-S281 PolarHBondContact O-N 3.2Å; D278-S281 PolarHBondContact O-N 3.25Å; D278-S281 PolarHBondContact O-OG 3.48Å; M279-S281 PolarHBondContact O-N 3.46Å
282	I	96.8	Very high	97.7	Very high	75 Å²	75	38.1 Å²	38.1	39%	0.385	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-37	-178.5	-58.1	169.7	0	0	0	110.8	W244 M279 L280 P284	W244-I282 HydrophobicContact CH2-CD1 3.74Å; W244-I282 HydrophobicContact CZ2-CD1 3.44Å; W244-I282 VanDerWaalsContact CZ2-CD1 3.44Å; M279-I282 PolarHBondContact O-N 2.89Å; M279-I282 VanDerWaalsContact O-N 3.11Å; L280-I282 PolarHBondContact O-N 3.49Å; I282-P284 VanDerWaalsContact C-CD 3.47Å; I282-P284 WeakPolarHBondContact O-CD 3.34Å
283	Y	97.5	Very high	97.7	Very high	5 Å²	5	38.6 Å²	38.6	2%	0.02	21%	0.205	C	C	.	.			trans	-125	66.4	-177.3	-42.2	-68.8	0	0	0	110.5	N38 F41 W244 P245 M279 E285 S286	N38-Y283 HydrophobicContact CB-CE1 4.32Å; N38-Y283 WeakPolarHBondContact OD1-CE1 3.36Å; N38-Y283 PolarHBondContact OD1-OH 2.87Å; F41-Y283 HydrophobicContact CB-CD1 3.54Å; F41-Y283 HydrophobicContact CB-CD2 3.98Å; F41-Y283 HydrophobicContact CB-CE1 3.69Å; F41-Y283 HydrophobicContact CB-CE2 4.1Å; F41-Y283 HydrophobicContact CB-CG 3.69Å; F41-Y283 HydrophobicContact CD2-CE2 4.26Å; F41-Y283 HydrophobicContact CG-CD2 4.26Å; F41-Y283 HydrophobicContact CG-CE1 4.44Å; F41-Y283 HydrophobicContact CG-CE2 4.13Å; F41-Y283 HydrophobicContact CG-CG 4.46Å; W244-Y283 HydrophobicContact CH2-CE2 4.25Å; W244-Y283 AromaticContact CZ2-CE2 3.92Å; W244-Y283 HydrophobicContact CZ2-CE2 3.92Å; P245-Y283 HydrophobicContact CB-CE2 4.49Å; M279-Y283 WeakPolarHBondContact O-CD2 3.4Å; M279-Y283 PolarHBondContact O-N 3.15Å; Y283-E285 PolarHBondContact O-N 3.25Å; Y283-S286 WeakPolarHBondContact O-CB 3.49Å; Y283-S286 PolarHBondContact O-N 2.84Å; Y283-S286 VanDerWaalsContact O-N 3.16Å
284	P	97.3	Very high	97.7	Very high	80 Å²	80	34.4 Å²	34.4	52%	0.519	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-29.2	-171.3	24.6	-35	0	0	0	113.6	L280 I282	L280-P284 VanDerWaalsContact O-CA 3.24Å; L280-P284 WeakPolarHBondContact O-CA 3.4Å; I282-P284 VanDerWaalsContact C-CD 3.47Å; I282-P284 WeakPolarHBondContact O-CD 3.34Å
285	E	96	Very high	97.6	Very high	125 Å²	125	30.6 Å²	30.6	58%	0.584	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.1	14.4	-177.5	-68.8	-178.5	165.4	0	0	112.2	N43 Y283 S287 Q316	N43-E285 PolarHBondContact ND2-O 2.7Å; Y283-E285 PolarHBondContact O-N 3.25Å; E285-S287 PolarHBondContact O-N 3.02Å; E285-S287 VanDerWaalsContact O-N 3.09Å; E285-Q316 VanDerWaalsContact O-CG 3.27Å; E285-Q316 WeakPolarHBondContact O-CG 3.45Å
286	S	97.4	Very high	97.6	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.007	18%	0.177	C	C	.	.			trans	-64.3	116.6	179	-173.4	0	0	0	0	111.1	F41 Y283 L288 V289 L290	F41-S286 WeakPolarHBondContact O-CA 3.32Å; F41-S286 WeakPolarHBondContact O-CB 3.4Å; F41-S286 PolarHBondContact O-OG 2.92Å; Y283-S286 WeakPolarHBondContact O-CB 3.49Å; Y283-S286 PolarHBondContact O-N 2.84Å; Y283-S286 VanDerWaalsContact O-N 3.16Å; S286-L288 PolarHBondContact O-N 2.9Å; S286-V289 PolarHBondContact O-N 2.93Å; S286-V289 VanDerWaalsContact O-N 3.14Å; S286-V289 PolarHBondContact OG-N 3.47Å; S286-L290 WeakPolarHBondContact O-CB 3.32Å; S286-L290 VanDerWaalsContact O-CG 3.31Å; S286-L290 WeakPolarHBondContact O-CG 3.29Å; S286-L290 PolarHBondContact O-N 3Å
287	S	96.6	Very high	97.6	Very high	3 Å²	3	32.4 Å²	32.4	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-52.9	-42.5	175.5	57.9	0	0	0	0	110.9	N43 E285 L290 F291 S313 F323	N43-S287 WeakPolarHBondContact OD1-CB 3.29Å; N43-S287 PolarHBondContact OD1-N 3.47Å; N43-S287 PolarHBondContact OD1-OG 3.43Å; E285-S287 PolarHBondContact O-N 3.02Å; E285-S287 VanDerWaalsContact O-N 3.09Å; S287-L290 PolarHBondContact O-N 3.43Å; S287-F291 PolarHBondContact O-N 3.5Å; S287-S313 PolarHBondContact O-OG 3.21Å; S287-F323 WeakPolarHBondContact O-CZ 3.44Å
288	L	95	Very high	97.6	Very high	13 Å²	13	27.3 Å²	27.3	7%	0.068	15%	0.149	C	C	.	.	H	α-helix	trans	-65.1	-45.7	179.1	-172.6	61.9	0	0	0	112.6	F41 M76 L249 S286 F291 F292 F323	F41-L288 HydrophobicContact CE1-CD2 4.07Å; M76-L288 HydrophobicContact CE-CD1 3.62Å; M76-L288 HydrophobicContact SD-CD1 4.23Å; L249-L288 HydrophobicContact CD1-CD2 3.66Å; L249-L288 HydrophobicContact CD2-CD2 3.54Å; L249-L288 HydrophobicContact CD2-CG 3.93Å; L249-L288 HydrophobicContact CG-CD2 4.25Å; S286-L288 PolarHBondContact O-N 2.9Å; L288-F291 WeakPolarHBondContact O-CB 3.38Å; L288-F291 PolarHBondContact O-N 3.42Å; L288-F292 HydrophobicContact CD1-CD2 4.34Å; L288-F292 HydrophobicContact CD1-CE2 3.67Å; L288-F292 HydrophobicContact CG-CD2 4.29Å; L288-F292 HydrophobicContact CG-CE2 3.9Å; L288-F292 WeakPolarHBondContact O-CD2 3.37Å; L288-F292 PolarHBondContact O-N 3.31Å; L288-F323 HydrophobicContact CD1-CE2 4.06Å
289	V	97.6	Very high	97.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-70.4	-36.7	179.8	-172.6	0	0	0	0	110.8	I276 M279 L280 S286 F291 F292 S293	I276-V289 HydrophobicContact CG2-CG1 4.46Å; M279-V289 HydrophobicContact CB-CG1 3.81Å; M279-V289 HydrophobicContact CB-CG2 3.89Å; M279-V289 HydrophobicContact CE-CG2 3.74Å; M279-V289 HydrophobicContact SD-CG2 4.2Å; L280-V289 HydrophobicContact CD2-CB 4.04Å; L280-V289 HydrophobicContact CD2-CG1 3.55Å; L280-V289 HydrophobicContact CG-CG1 3.59Å; S286-V289 PolarHBondContact O-N 2.93Å; S286-V289 VanDerWaalsContact O-N 3.14Å; S286-V289 PolarHBondContact OG-N 3.47Å; V289-F291 VanDerWaalsContact C-N 3.34Å; V289-F291 PolarHBondContact O-N 3.06Å; V289-F292 PolarHBondContact O-N 2.85Å; V289-S293 WeakPolarHBondContact O-CB 3.32Å; V289-S293 PolarHBondContact O-N 3.16Å; V289-S293 PolarHBondContact O-OG 3.41Å
290	L	98.4	Very high	97.3	Very high	17 Å²	17	28.4 Å²	28.4	9%	0.089	16%	0.157	C	C	.	.	H	α-helix	trans	-62.9	-39	173	-70.7	171	0	0	0	112	L280 S286 S287 S293 G294 L309 Q316	L280-L290 HydrophobicContact CD2-CD2 4.37Å; S286-L290 WeakPolarHBondContact O-CB 3.32Å; S286-L290 VanDerWaalsContact O-CG 3.31Å; S286-L290 WeakPolarHBondContact O-CG 3.29Å; S286-L290 PolarHBondContact O-N 3Å; S287-L290 PolarHBondContact O-N 3.43Å; L290-S293 WeakPolarHBondContact O-CB 3.15Å; L290-S293 PolarHBondContact O-N 2.72Å; L290-G294 PolarHBondContact O-N 3.49Å; L290-L309 HydrophobicContact CD2-CD2 4.11Å; L290-Q316 HydrophobicContact CD1-CG 3.52Å
291	F	97.8	Very high	97.2	Very high	8 Å²	8	26.7 Å²	26.7	4%	0.035	15%	0.15	C	C	.	.	H	α-helix	trans	-59.3	-49.2	173	171	-93.8	0	0	0	111.5	S287 L288 V289 S293 G294 R295 F310 F323 L326 E330	S287-F291 PolarHBondContact O-N 3.5Å; L288-F291 WeakPolarHBondContact O-CB 3.38Å; L288-F291 PolarHBondContact O-N 3.42Å; V289-F291 VanDerWaalsContact C-N 3.34Å; V289-F291 PolarHBondContact O-N 3.06Å; F291-S293 VanDerWaalsContact C-N 3.28Å; F291-S293 PolarHBondContact O-N 3.45Å; F291-G294 PolarHBondContact O-N 2.92Å; F291-R295 PolarHBondContact O-N 3.21Å; F291-F310 AromaticContact CD2-CD1 3.94Å; F291-F310 HydrophobicContact CD2-CD1 3.94Å; F291-F310 AromaticContact CD2-CE1 3.75Å; F291-F310 HydrophobicContact CD2-CE1 3.75Å; F291-F310 HydrophobicContact CE2-CD1 4.39Å; F291-F310 AromaticContact CE2-CE1 3.91Å; F291-F310 HydrophobicContact CE2-CE1 3.91Å; F291-F310 HydrophobicContact CG-CE1 4.45Å; F291-F310 WeakPolarHBondContact O-CE1 3.39Å; F291-F323 HydrophobicContact CB-CE2 4.39Å; F291-F323 HydrophobicContact CB-CZ 3.77Å; F291-F323 HydrophobicContact CG-CZ 4.35Å; F291-L326 HydrophobicContact CE2-CB 4.01Å; F291-L326 HydrophobicContact CZ-CB 4.42Å; F291-E330 HydrophobicContact CE2-CG 4.12Å; F291-E330 HydrophobicContact CZ-CG 4.42Å
292	F	98	Very high	97.3	Very high	4 Å²	4	25.7 Å²	25.7	2%	0.018	14%	0.137	C	C	.	.	H	α-helix	trans	-65.6	-32.1	176.6	-72.8	-66.8	0	0	0	112.8	L249 L252 V253 L256 N257 I276 L288 V289 R295 Y296	L249-F292 HydrophobicContact CD2-CD2 4.17Å; L249-F292 HydrophobicContact CD2-CE2 3.68Å; L252-F292 HydrophobicContact CB-CD1 3.76Å; L252-F292 HydrophobicContact CB-CD2 4.4Å; L252-F292 HydrophobicContact CB-CE1 3.94Å; L252-F292 HydrophobicContact CB-CG 4Å; L252-F292 HydrophobicContact CB-CZ 4.38Å; L252-F292 HydrophobicContact CD1-CB 4.13Å; L252-F292 HydrophobicContact CD1-CD2 4.14Å; L252-F292 HydrophobicContact CD1-CG 4.07Å; V253-F292 HydrophobicContact CG2-CE1 3.97Å; V253-F292 HydrophobicContact CG2-CZ 3.61Å; L256-F292 HydrophobicContact CD1-CB 4.29Å; L256-F292 HydrophobicContact CD1-CD1 4.15Å; N257-F292 WeakPolarHBondContact ND2-CE1 3.39Å; I276-F292 HydrophobicContact CD1-CB 4.44Å; I276-F292 HydrophobicContact CG1-CB 4.43Å; L288-F292 HydrophobicContact CD1-CD2 4.34Å; L288-F292 HydrophobicContact CD1-CE2 3.67Å; L288-F292 HydrophobicContact CG-CD2 4.29Å; L288-F292 HydrophobicContact CG-CE2 3.9Å; L288-F292 WeakPolarHBondContact O-CD2 3.37Å; L288-F292 PolarHBondContact O-N 3.31Å; V289-F292 PolarHBondContact O-N 2.85Å; F292-R295 PolarHBondContact O-N 3.37Å; F292-Y296 WeakPolarHBondContact O-CB 3.4Å; F292-Y296 PolarHBondContact O-N 3.49Å
293	S	98.5	Very high	97.3	Very high	10 Å²	10	22.1 Å²	22.1	7%	0.07	12%	0.118	C	C	.	.	H	α-helix	trans	-62.5	-44.9	172.1	-56	0	0	0	0	111.4	I276 V289 L290 F291 Y296 A297	I276-S293 WeakPolarHBondContact CG2-OG 3.23Å; V289-S293 WeakPolarHBondContact O-CB 3.32Å; V289-S293 PolarHBondContact O-N 3.16Å; V289-S293 PolarHBondContact O-OG 3.41Å; L290-S293 WeakPolarHBondContact O-CB 3.15Å; L290-S293 PolarHBondContact O-N 2.72Å; F291-S293 VanDerWaalsContact C-N 3.28Å; F291-S293 PolarHBondContact O-N 3.45Å; S293-Y296 PolarHBondContact O-N 3.35Å; S293-A297 PolarHBondContact O-N 3.07Å
294	G	98.5	Very high	97.4	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-61.9	-44.9	174.7	0	0	0	0	0	111.8	L290 F291 Y296 A297 E298 A306	L290-G294 PolarHBondContact O-N 3.49Å; F291-G294 PolarHBondContact O-N 2.92Å; G294-Y296 VanDerWaalsContact C-N 3.35Å; G294-Y296 PolarHBondContact O-N 2.98Å; G294-A297 PolarHBondContact O-N 2.76Å; G294-E298 PolarHBondContact O-N 3.32Å; G294-A306 WeakPolarHBondContact O-CB 3.45Å
295	R	97.4	Very high	97.4	Very high	15 Å²	15	26 Å²	26	6%	0.057	14%	0.138	C	C	.	.	H	α-helix	trans	-62.4	-40	176.9	-173.6	65.2	-169.5	138.8	3.5	112.6	L256 F291 F292 E298 I299 F310 E330	L256-R295 HydrophobicContact CB-CG 3.81Å; L256-R295 PolarHBondContact O-NE 3.03Å; L256-R295 PolarHBondContact O-NH2 3.49Å; F291-R295 PolarHBondContact O-N 3.21Å; F292-R295 PolarHBondContact O-N 3.37Å; R295-E298 IonicContact CZ-OE2 2.69Å; R295-E298 IonicContact NH1-OE1 3.74Å; R295-E298 PolarHBondContact NH1-OE1 3.47Å; R295-E298 IonicContact NH1-OE2 3.14Å; R295-E298 PolarHBondContact NH1-OE2 3.03Å; R295-I299 HydrophobicContact CG-CD1 4.14Å; R295-I299 WeakPolarHBondContact O-CB 3.39Å; R295-I299 WeakPolarHBondContact O-CD1 3.48Å; R295-I299 WeakPolarHBondContact O-CG1 3.29Å; R295-I299 PolarHBondContact O-N 2.96Å; R295-F310 HydrophobicContact CB-CE1 4.48Å; R295-F310 HydrophobicContact CB-CZ 4.3Å; R295-F310 VanDerWaalsContact N-CZ 3.35Å; R295-E330 IonicContact NH1-OE2 3.62Å
296	Y	98.1	Very high	97.6	Very high	44 Å²	44	20.1 Å²	20.1	17%	0.173	11%	0.111	C	C	.	.	H	α-helix	trans	-61.6	-49.5	172.4	175.1	-97.5	0	0	0	111.4	L256 L269 E273 I276 F292 S293 G294 E298 I299 T300	L256-Y296 HydrophobicContact CD2-CD2 4.35Å; L269-Y296 HydrophobicContact CB-CE2 4.18Å; L269-Y296 WeakPolarHBondContact O-CE2 3.42Å; E273-Y296 HydrophobicContact CB-CE1 4.33Å; E273-Y296 HydrophobicContact CB-CE2 3.86Å; E273-Y296 HydrophobicContact CG-CE1 4.24Å; E273-Y296 PolarHBondContact OE1-OH 3.05Å; I276-Y296 HydrophobicContact CD1-CG 4.18Å; F292-Y296 WeakPolarHBondContact O-CB 3.4Å; F292-Y296 PolarHBondContact O-N 3.49Å; S293-Y296 PolarHBondContact O-N 3.35Å; G294-Y296 VanDerWaalsContact C-N 3.35Å; G294-Y296 PolarHBondContact O-N 2.98Å; Y296-E298 VanDerWaalsContact C-N 3.32Å; Y296-E298 PolarHBondContact O-N 3.34Å; Y296-I299 PolarHBondContact O-N 3.36Å; Y296-T300 HydrophobicContact CD1-CG2 4.41Å; Y296-T300 HydrophobicContact CD2-CG2 4.36Å; Y296-T300 HydrophobicContact CE1-CG2 4.02Å; Y296-T300 HydrophobicContact CE2-CG2 3.95Å; Y296-T300 WeakPolarHBondContact O-CG2 3.45Å; Y296-T300 PolarHBondContact O-N 2.94Å; Y296-T300 PolarHBondContact O-OG1 3.34Å; Y296-T300 VanDerWaalsContact O-OG1 3.13Å
297	A	98.3	Very high	97.6	Very high	3 Å²	3	20.8 Å²	20.8	3%	0.025	11%	0.114	C	C	.	.	H	α-helix	trans	-57.7	-44.6	178.3	0	0	0	0	0	111.8	S293 G294 I299 T300 G301 D302 K305 A306 L309	S293-A297 PolarHBondContact O-N 3.07Å; G294-A297 PolarHBondContact O-N 2.76Å; A297-I299 PolarHBondContact O-N 3.21Å; A297-T300 WeakPolarHBondContact CA-OG1 3.48Å; A297-T300 CarbonylContact O-C 3.58Å; A297-T300 PolarHBondContact O-N 3.38Å; A297-T300 PolarHBondContact O-OG1 3.01Å; A297-G301 PolarHBondContact O-N 3.12Å; A297-G301 VanDerWaalsContact O-N 3.08Å; A297-D302 PolarHBondContact O-N 2.93Å; A297-K305 HydrophobicContact CB-CB 4.34Å; A297-K305 HydrophobicContact CB-CG 4.28Å; A297-A306 HydrophobicContact CB-CB 3.99Å; A297-L309 HydrophobicContact CB-CD1 4.17Å
298	E	97.4	Very high	97.7	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.009	14%	0.141	C	C	.	.	H	α-helix	trans	-58.8	-49.7	176.1	-174.2	-161.4	156.7	0	0	111.9	G294 R295 Y296 T300 G301 F303 A306 F337	G294-E298 PolarHBondContact O-N 3.32Å; R295-E298 IonicContact CZ-OE2 2.69Å; R295-E298 IonicContact NH1-OE1 3.74Å; R295-E298 PolarHBondContact NH1-OE1 3.47Å; R295-E298 IonicContact NH1-OE2 3.14Å; R295-E298 PolarHBondContact NH1-OE2 3.03Å; Y296-E298 VanDerWaalsContact C-N 3.32Å; Y296-E298 PolarHBondContact O-N 3.34Å; E298-T300 VanDerWaalsContact C-N 3.25Å; E298-T300 PolarHBondContact O-N 3.02Å; E298-G301 PolarHBondContact O-N 3.04Å; E298-F303 HydrophobicContact CG-CD1 4.34Å; E298-F303 HydrophobicContact CG-CE1 4.49Å; E298-F303 VanDerWaalsContact O-CE1 3.32Å; E298-F303 WeakPolarHBondContact O-CE1 3.28Å; E298-A306 HydrophobicContact CB-CB 3.89Å; E298-F337 HydrophobicContact CG-CE2 3.99Å
299	I	95.5	Very high	97.9	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-59.8	-38.1	178.8	-78.4	165.2	0	0	0	111.8	L256 Y260 L269 R295 Y296 A297 G301 R451	L256-I299 HydrophobicContact CB-CD1 4Å; L256-I299 HydrophobicContact CD2-CD1 3.83Å; L256-I299 WeakPolarHBondContact O-CD1 3.32Å; Y260-I299 HydrophobicContact CD1-CG1 4.35Å; Y260-I299 HydrophobicContact CD2-CD1 3.71Å; Y260-I299 HydrophobicContact CD2-CG1 4.29Å; Y260-I299 HydrophobicContact CE1-CD1 4.37Å; Y260-I299 HydrophobicContact CE1-CG1 3.95Å; Y260-I299 HydrophobicContact CE1-CG2 4.1Å; Y260-I299 HydrophobicContact CE2-CD1 3.43Å; Y260-I299 VanDerWaalsContact CE2-CD1 3.43Å; Y260-I299 HydrophobicContact CE2-CG1 3.92Å; Y260-I299 HydrophobicContact CE2-CG2 4.09Å; Y260-I299 HydrophobicContact CG-CD1 4.33Å; Y260-I299 VanDerWaalsContact CZ-CG2 3.47Å; Y260-I299 WeakPolarHBondContact OH-CG2 3.17Å; L269-I299 HydrophobicContact CD1-CG2 3.9Å; L269-I299 HydrophobicContact CD2-CG2 3.74Å; L269-I299 HydrophobicContact CG-CG2 4.5Å; R295-I299 HydrophobicContact CG-CD1 4.14Å; R295-I299 WeakPolarHBondContact O-CB 3.39Å; R295-I299 WeakPolarHBondContact O-CD1 3.48Å; R295-I299 WeakPolarHBondContact O-CG1 3.29Å; R295-I299 PolarHBondContact O-N 2.96Å; Y296-I299 PolarHBondContact O-N 3.36Å; A297-I299 PolarHBondContact O-N 3.21Å; I299-G301 VanDerWaalsContact C-N 3.27Å; I299-G301 PolarHBondContact O-N 3.14Å; I299-R451 VanDerWaalsContact O-CG 3.29Å; I299-R451 WeakPolarHBondContact O-CG 2.99Å
300	T	95.8	Very high	98	Very high	54 Å²	54	27.4 Å²	27.4	33%	0.331	15%	0.145	S	C	.	.	H	α-helix	trans	-79.2	-5.3	178.1	60	0	0	0	0	114.1	Y296 A297 E298 R451	Y296-T300 HydrophobicContact CD1-CG2 4.41Å; Y296-T300 HydrophobicContact CD2-CG2 4.36Å; Y296-T300 HydrophobicContact CE1-CG2 4.02Å; Y296-T300 HydrophobicContact CE2-CG2 3.95Å; Y296-T300 WeakPolarHBondContact O-CG2 3.45Å; Y296-T300 PolarHBondContact O-N 2.94Å; Y296-T300 PolarHBondContact O-OG1 3.34Å; Y296-T300 VanDerWaalsContact O-OG1 3.13Å; A297-T300 WeakPolarHBondContact CA-OG1 3.48Å; A297-T300 CarbonylContact O-C 3.58Å; A297-T300 PolarHBondContact O-N 3.38Å; A297-T300 PolarHBondContact O-OG1 3.01Å; E298-T300 VanDerWaalsContact C-N 3.25Å; E298-T300 PolarHBondContact O-N 3.02Å; T300-R451 WeakPolarHBondContact O-CB 3.4Å
301	G	96.8	Very high	98	Very high	6 Å²	6	29.5 Å²	29.5	6%	0.062	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.6	5.6	176	0	0	0	0	0	115.4	A297 E298 I299 F303 N452	A297-G301 PolarHBondContact O-N 3.12Å; A297-G301 VanDerWaalsContact O-N 3.08Å; E298-G301 PolarHBondContact O-N 3.04Å; I299-G301 VanDerWaalsContact C-N 3.27Å; I299-G301 PolarHBondContact O-N 3.14Å; G301-F303 PolarHBondContact O-N 3.35Å; G301-N452 WeakPolarHBondContact O-CB 3.34Å; G301-N452 PolarHBondContact O-ND2 3.45Å
302	D	98.1	Very high	98	Very high	73 Å²	73	31.3 Å²	31.3	39%	0.39	17%	0.168	S	C	.	.			trans	-90	73	173.6	-168.7	-10.3	0	0	0	110.6	A297 A304 K305 A306	A297-D302 PolarHBondContact O-N 2.93Å; D302-A304 VanDerWaalsContact C-N 3.28Å; D302-A304 PolarHBondContact O-N 2.92Å; D302-K305 HydrophobicContact CB-CB 4.16Å; D302-K305 PolarHBondContact O-N 2.93Å; D302-K305 VanDerWaalsContact OD1-CB 3.3Å; D302-K305 WeakPolarHBondContact OD1-CB 3.31Å; D302-K305 PolarHBondContact OD1-N 2.81Å; D302-K305 VanDerWaalsContact OD1-N 3.11Å; D302-K305 VanDerWaalsContact OD2-CB 3.25Å; D302-K305 WeakPolarHBondContact OD2-CB 3.44Å; D302-A306 WeakPolarHBondContact O-CB 3.47Å; D302-A306 PolarHBondContact O-N 3.43Å
303	F	98.4	Very high	98	Very high	1 Å²	1	31.1 Å²	31.1	0%	0.004	17%	0.167	C	C	.	.	H	α-helix	trans	-66.3	-29.7	-175	-50	-45	0	0	0	113.2	E298 G301 A306 I307 F337 L338 C448 N452 S455	E298-F303 HydrophobicContact CG-CD1 4.34Å; E298-F303 HydrophobicContact CG-CE1 4.49Å; E298-F303 VanDerWaalsContact O-CE1 3.32Å; E298-F303 WeakPolarHBondContact O-CE1 3.28Å; G301-F303 PolarHBondContact O-N 3.35Å; F303-A306 PolarHBondContact O-N 3.44Å; F303-I307 WeakPolarHBondContact O-CD1 3.32Å; F303-I307 VanDerWaalsContact O-CG1 3.25Å; F303-I307 WeakPolarHBondContact O-CG1 3Å; F303-I307 PolarHBondContact O-N 3.46Å; F303-F337 AromaticContact CD1-CD2 3.62Å; F303-F337 HydrophobicContact CD1-CD2 3.62Å; F303-F337 HydrophobicContact CD1-CE2 4.34Å; F303-F337 HydrophobicContact CD2-CB 3.8Å; F303-F337 HydrophobicContact CD2-CD2 4.34Å; F303-F337 AromaticContact CE1-CD2 3.49Å; F303-F337 HydrophobicContact CE1-CD2 3.49Å; F303-F337 VanDerWaalsContact CE1-CD2 3.49Å; F303-F337 HydrophobicContact CE1-CE2 4.05Å; F303-F337 HydrophobicContact CE1-CG 4.37Å; F303-F337 HydrophobicContact CE2-CB 3.79Å; F303-F337 HydrophobicContact CE2-CD2 4.22Å; F303-F337 HydrophobicContact CE2-CG 4.37Å; F303-F337 HydrophobicContact CG-CB 4.22Å; F303-F337 HydrophobicContact CG-CD2 4.07Å; F303-F337 HydrophobicContact CZ-CB 4.22Å; F303-F337 AromaticContact CZ-CD2 3.83Å; F303-F337 HydrophobicContact CZ-CD2 3.83Å; F303-F337 HydrophobicContact CZ-CG 4.3Å; F303-L338 HydrophobicContact CB-CD1 4.18Å; F303-L338 HydrophobicContact CB-CD2 4.27Å; F303-L338 HydrophobicContact CB-CG 4.16Å; F303-L338 HydrophobicContact CD2-CD2 4.11Å; F303-C448 HydrophobicContact CE1-CB 4.46Å; F303-N452 HydrophobicContact CD2-CB 4.27Å; F303-N452 HydrophobicContact CE2-CB 3.46Å; F303-N452 VanDerWaalsContact CE2-CB 3.46Å; F303-N452 HydrophobicContact CZ-CB 3.86Å; F303-S455 WeakPolarHBondContact CE2-OG 3.24Å
304	A	98.2	Very high	97.9	Very high	59 Å²	59	31.7 Å²	31.7	49%	0.488	17%	0.169	S	C	.	.	H	α-helix	trans	-66.9	-46	177.1	0	0	0	0	0	110.7	D302 I307 Q308	D302-A304 VanDerWaalsContact C-N 3.28Å; D302-A304 PolarHBondContact O-N 2.92Å; A304-I307 PolarHBondContact O-N 3.14Å; A304-Q308 WeakPolarHBondContact O-CG 3.39Å; A304-Q308 PolarHBondContact O-N 3.05Å
305	K	98.6	Very high	97.9	Very high	108 Å²	108	37.7 Å²	37.7	47%	0.47	20%	0.201	S	C	.	.	H	α-helix	trans	-66	-38.9	173.9	-174	174.8	-179.9	178.5	0	112.1	A297 D302 I307 Q308 L309	A297-K305 HydrophobicContact CB-CB 4.34Å; A297-K305 HydrophobicContact CB-CG 4.28Å; D302-K305 HydrophobicContact CB-CB 4.16Å; D302-K305 PolarHBondContact O-N 2.93Å; D302-K305 VanDerWaalsContact OD1-CB 3.3Å; D302-K305 WeakPolarHBondContact OD1-CB 3.31Å; D302-K305 PolarHBondContact OD1-N 2.81Å; D302-K305 VanDerWaalsContact OD1-N 3.11Å; D302-K305 VanDerWaalsContact OD2-CB 3.25Å; D302-K305 WeakPolarHBondContact OD2-CB 3.44Å; K305-I307 VanDerWaalsContact C-N 3.34Å; K305-I307 PolarHBondContact O-N 2.91Å; K305-Q308 PolarHBondContact O-N 3.2Å; K305-L309 HydrophobicContact CD-CD1 4.47Å; K305-L309 HydrophobicContact CG-CD1 3.81Å; K305-L309 HydrophobicContact CG-CG 4.36Å; K305-L309 WeakPolarHBondContact O-CG 3.35Å; K305-L309 PolarHBondContact O-N 3.12Å
306	A	98.8	Very high	97.8	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-57.2	-47.6	175.2	0	0	0	0	0	111.6	G294 A297 E298 D302 F303 Q308 L309 F310	G294-A306 WeakPolarHBondContact O-CB 3.45Å; A297-A306 HydrophobicContact CB-CB 3.99Å; E298-A306 HydrophobicContact CB-CB 3.89Å; D302-A306 WeakPolarHBondContact O-CB 3.47Å; D302-A306 PolarHBondContact O-N 3.43Å; F303-A306 PolarHBondContact O-N 3.44Å; A306-Q308 VanDerWaalsContact C-N 3.35Å; A306-Q308 PolarHBondContact O-N 3.01Å; A306-L309 PolarHBondContact O-N 2.8Å; A306-F310 HydrophobicContact CB-CD2 4.41Å; A306-F310 HydrophobicContact CB-CE2 4.11Å; A306-F310 WeakPolarHBondContact O-CD2 3.41Å; A306-F310 WeakPolarHBondContact O-CG 3.3Å; A306-F310 PolarHBondContact O-N 3.31Å
307	I	98.8	Very high	97.5	Very high	16 Å²	16	38.5 Å²	38.5	8%	0.082	21%	0.208	C	C	.	.	H	α-helix	trans	-57.5	-47.3	176.3	-71.2	159	0	0	0	111.2	F303 A304 K305 L309 F310 Q311 L331 C334 L338	F303-I307 WeakPolarHBondContact O-CD1 3.32Å; F303-I307 VanDerWaalsContact O-CG1 3.25Å; F303-I307 WeakPolarHBondContact O-CG1 3Å; F303-I307 PolarHBondContact O-N 3.46Å; A304-I307 PolarHBondContact O-N 3.14Å; K305-I307 VanDerWaalsContact C-N 3.34Å; K305-I307 PolarHBondContact O-N 2.91Å; I307-L309 PolarHBondContact O-N 3.44Å; I307-F310 PolarHBondContact O-N 3.14Å; I307-Q311 WeakPolarHBondContact O-CB 3.25Å; I307-Q311 VanDerWaalsContact O-CG 3.28Å; I307-Q311 WeakPolarHBondContact O-CG 3.49Å; I307-Q311 PolarHBondContact O-N 2.8Å; I307-L331 HydrophobicContact CB-CD2 4.11Å; I307-L331 HydrophobicContact CG1-CD2 4.02Å; I307-L331 HydrophobicContact CG2-CD2 3.94Å; I307-C334 HydrophobicContact CD1-CB 4.04Å; I307-C334 HydrophobicContact CG1-CB 3.62Å; I307-L338 HydrophobicContact CD1-CD1 3.72Å
308	Q	98.6	Very high	97.2	Very high	125 Å²	125	43.3 Å²	43.3	58%	0.584	24%	0.241	S	C	*	.	H	α-helix	trans	-59.7	-46.5	178.2	-70.8	176.2	-10.6	0	0	111.6	A304 K305 A306 Q311 S312	A304-Q308 WeakPolarHBondContact O-CG 3.39Å; A304-Q308 PolarHBondContact O-N 3.05Å; K305-Q308 PolarHBondContact O-N 3.2Å; A306-Q308 VanDerWaalsContact C-N 3.35Å; A306-Q308 PolarHBondContact O-N 3.01Å; Q308-Q311 PolarHBondContact O-N 3.48Å; Q308-S312 PolarHBondContact O-N 3.36Å; Q308-S312 PolarHBondContact O-OG 2.8Å; Q308-S312 VanDerWaalsContact O-OG 3.08Å
309	L	98.7	Very high	96.8	Very high	30 Å²	30	47.4 Å²	47.4	16%	0.157	26%	0.26	C	S	.	.	H	α-helix	trans	-67.2	-39.3	-178.4	-72	166.3	0	0	0	112.8	L290 A297 K305 A306 I307 S312 S313	L290-L309 HydrophobicContact CD2-CD2 4.11Å; A297-L309 HydrophobicContact CB-CD1 4.17Å; K305-L309 HydrophobicContact CD-CD1 4.47Å; K305-L309 HydrophobicContact CG-CD1 3.81Å; K305-L309 HydrophobicContact CG-CG 4.36Å; K305-L309 WeakPolarHBondContact O-CG 3.35Å; K305-L309 PolarHBondContact O-N 3.12Å; A306-L309 PolarHBondContact O-N 2.8Å; I307-L309 PolarHBondContact O-N 3.44Å; L309-S312 PolarHBondContact O-N 3.33Å; L309-S313 VanDerWaalsContact O-CB 3.27Å; L309-S313 WeakPolarHBondContact O-CB 3.48Å; L309-S313 PolarHBondContact O-N 3.16Å
310	F	98.6	Very high	96.4	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-66.4	-37.9	174	-68.9	-50.6	0	0	0	112	F291 R295 A306 I307 S313 I314 C327 E330 L331	F291-F310 AromaticContact CD2-CD1 3.94Å; F291-F310 HydrophobicContact CD2-CD1 3.94Å; F291-F310 AromaticContact CD2-CE1 3.75Å; F291-F310 HydrophobicContact CD2-CE1 3.75Å; F291-F310 HydrophobicContact CE2-CD1 4.39Å; F291-F310 AromaticContact CE2-CE1 3.91Å; F291-F310 HydrophobicContact CE2-CE1 3.91Å; F291-F310 HydrophobicContact CG-CE1 4.45Å; F291-F310 WeakPolarHBondContact O-CE1 3.39Å; R295-F310 HydrophobicContact CB-CE1 4.48Å; R295-F310 HydrophobicContact CB-CZ 4.3Å; R295-F310 VanDerWaalsContact N-CZ 3.35Å; A306-F310 HydrophobicContact CB-CD2 4.41Å; A306-F310 HydrophobicContact CB-CE2 4.11Å; A306-F310 WeakPolarHBondContact O-CD2 3.41Å; A306-F310 WeakPolarHBondContact O-CG 3.3Å; A306-F310 PolarHBondContact O-N 3.31Å; I307-F310 PolarHBondContact O-N 3.14Å; F310-S313 WeakPolarHBondContact O-CB 3.32Å; F310-S313 PolarHBondContact O-N 3.12Å; F310-I314 WeakPolarHBondContact O-CD1 3.48Å; F310-I314 VanDerWaalsContact O-CG1 3.31Å; F310-I314 WeakPolarHBondContact O-CG1 3.41Å; F310-I314 PolarHBondContact O-N 2.61Å; F310-I314 VanDerWaalsContact O-N 3.08Å; F310-C327 HydrophobicContact CB-CB 4.42Å; F310-E330 HydrophobicContact CD1-CB 4.5Å; F310-E330 HydrophobicContact CD2-CB 4.09Å; F310-E330 HydrophobicContact CE1-CB 3.97Å; F310-E330 HydrophobicContact CE1-CG 4.12Å; F310-E330 HydrophobicContact CE2-CB 3.5Å; F310-E330 HydrophobicContact CE2-CG 4.39Å; F310-E330 HydrophobicContact CZ-CB 3.42Å; F310-E330 VanDerWaalsContact CZ-CB 3.42Å; F310-E330 HydrophobicContact CZ-CG 3.81Å; F310-L331 HydrophobicContact CB-CD1 4.06Å; F310-L331 HydrophobicContact CB-CD2 3.92Å; F310-L331 HydrophobicContact CB-CG 3.83Å; F310-L331 HydrophobicContact CD2-CD2 4.33Å; F310-L331 HydrophobicContact CD2-CG 4.34Å; F310-L331 HydrophobicContact CG-CG 4.42Å
311	Q	98.3	Very high	96.1	Very high	60 Å²	60	50.2 Å²	50.2	28%	0.28	26%	0.264	S	S	.	.	H	α-helix	trans	-64.6	-48.8	173.3	-73.6	173.1	-19	0	0	111.1	I307 Q308 S313 I314 D315 L331 Y347	I307-Q311 WeakPolarHBondContact O-CB 3.25Å; I307-Q311 VanDerWaalsContact O-CG 3.28Å; I307-Q311 WeakPolarHBondContact O-CG 3.49Å; I307-Q311 PolarHBondContact O-N 2.8Å; Q308-Q311 PolarHBondContact O-N 3.48Å; Q311-S313 VanDerWaalsContact C-N 3.26Å; Q311-S313 PolarHBondContact O-N 2.8Å; Q311-I314 WeakPolarHBondContact O-CB 3.37Å; Q311-I314 PolarHBondContact O-N 3.11Å; Q311-I314 VanDerWaalsContact O-N 3.08Å; Q311-D315 VanDerWaalsContact O-CG 3.23Å; Q311-D315 PolarHBondContact O-N 2.9Å; Q311-L331 HydrophobicContact CG-CD2 4.49Å; Q311-Y347 PolarHBondContact NE2-OH 2.61Å
312	S	98.1	Very high	95.6	Very high	47 Å²	47	52.7 Å²	52.7	33%	0.329	27%	0.274	S	S	.	.	H	α-helix	trans	-56.9	-41.3	175.2	-61.4	0	0	0	0	112	Q308 L309 I314 D315 Q316	Q308-S312 PolarHBondContact O-N 3.36Å; Q308-S312 PolarHBondContact O-OG 2.8Å; Q308-S312 VanDerWaalsContact O-OG 3.08Å; L309-S312 PolarHBondContact O-N 3.33Å; S312-I314 PolarHBondContact O-N 3.34Å; S312-D315 PolarHBondContact O-N 3.18Å; S312-Q316 VanDerWaalsContact O-CG 3.26Å; S312-Q316 WeakPolarHBondContact O-CG 3.34Å; S312-Q316 PolarHBondContact O-N 2.94Å; S312-Q316 PolarHBondContact O-NE2 3.36Å
313	S	97.9	Very high	95.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.2	-41.3	176	178.8	0	0	0	0	112.8	S287 L309 F310 Q311 F323	S287-S313 PolarHBondContact O-OG 3.21Å; L309-S313 VanDerWaalsContact O-CB 3.27Å; L309-S313 WeakPolarHBondContact O-CB 3.48Å; L309-S313 PolarHBondContact O-N 3.16Å; F310-S313 WeakPolarHBondContact O-CB 3.32Å; F310-S313 PolarHBondContact O-N 3.12Å; Q311-S313 VanDerWaalsContact C-N 3.26Å; Q311-S313 PolarHBondContact O-N 2.8Å; S313-F323 VanDerWaalsContact OG-CE1 3.26Å; S313-F323 WeakPolarHBondContact OG-CE1 3.19Å
314	I	97.3	Very high	95.1	Very high	22 Å²	22	49.6 Å²	49.6	11%	0.113	26%	0.258	C	S	.	.	H	α-helix	trans	-64.2	-41.8	173.5	-69	157.4	0	0	0	110.8	F310 Q311 S312 Q316 H324 C327 F328 L331	F310-I314 WeakPolarHBondContact O-CD1 3.48Å; F310-I314 VanDerWaalsContact O-CG1 3.31Å; F310-I314 WeakPolarHBondContact O-CG1 3.41Å; F310-I314 PolarHBondContact O-N 2.61Å; F310-I314 VanDerWaalsContact O-N 3.08Å; Q311-I314 WeakPolarHBondContact O-CB 3.37Å; Q311-I314 PolarHBondContact O-N 3.11Å; Q311-I314 VanDerWaalsContact O-N 3.08Å; S312-I314 PolarHBondContact O-N 3.34Å; I314-Q316 PolarHBondContact O-N 3.19Å; I314-H324 HydrophobicContact CG1-CB 4.37Å; I314-C327 HydrophobicContact CD1-CB 3.55Å; I314-C327 HydrophobicContact CG1-CB 3.51Å; I314-F328 HydrophobicContact CD1-CD1 3.86Å; I314-F328 HydrophobicContact CD1-CE1 3.68Å; I314-F328 HydrophobicContact CG1-CE1 4.46Å; I314-L331 HydrophobicContact CD1-CD1 3.79Å
315	D	97.3	Very high	94.8	Very high	125 Å²	125	47.2 Å²	47.2	67%	0.668	24%	0.236	S	C	*	.	H	α-helix	trans	-70.9	-17.6	-174.7	-63	-25.3	0	0	0	113.2	Q311 S312 Q317	Q311-D315 VanDerWaalsContact O-CG 3.23Å; Q311-D315 PolarHBondContact O-N 2.9Å; S312-D315 PolarHBondContact O-N 3.18Å; D315-Q317 PolarHBondContact O-N 3.37Å
316	Q	96.3	Very high	94.5	Very high	61 Å²	61	44.9 Å²	44.9	29%	0.285	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-20.1	-177.3	-67.5	-43	-54.8	0	0	115.1	E285 L290 S312 I314	E285-Q316 VanDerWaalsContact O-CG 3.27Å; E285-Q316 WeakPolarHBondContact O-CG 3.45Å; L290-Q316 HydrophobicContact CD1-CG 3.52Å; S312-Q316 VanDerWaalsContact O-CG 3.26Å; S312-Q316 WeakPolarHBondContact O-CG 3.34Å; S312-Q316 PolarHBondContact O-N 2.94Å; S312-Q316 PolarHBondContact O-NE2 3.36Å; I314-Q316 PolarHBondContact O-N 3.19Å
317	Q	92.2	Very high	94.4	Very high	16 Å²	16	44.9 Å²	44.9	8%	0.075	23%	0.228	C	C	.	.			trans	-155	158.7	-177.5	63.4	77.8	20.2	0	0	111.2	N43 F45 D315 W320 H324	N43-Q317 HydrophobicContact CB-CB 4.16Å; F45-Q317 HydrophobicContact CE2-CB 4.23Å; F45-Q317 HydrophobicContact CE2-CG 4.15Å; D315-Q317 PolarHBondContact O-N 3.37Å; Q317-W320 PolarHBondContact NE2-O 3.42Å; Q317-H324 PolarHBondContact NE2-CD2 3.45Å; Q317-H324 PolarHBondContact NE2-NE2 2.92Å; Q317-H324 PolarHBondContact O-CE1 3.39Å; Q317-H324 VanDerWaalsContact O-CE1 3.28Å; Q317-H324 PolarHBondContact O-NE2 3.45Å
318	S	91.2	Very high	94.3	Very high	103 Å²	103	44.6 Å²	44.6	72%	0.72	23%	0.227	S	C	*	.	S	Bend	trans	-131.1	-0.5	174.2	57.7	0	0	0	0	114.1
319	E	88.6	Confident	94.2	Very high	88 Å²	88	40.8 Å²	40.8	41%	0.411	21%	0.207	S	C	.	.	S	Bend	trans	-68.2	-42.7	-179.6	-65.2	179.4	-136.7	0	0	111.4	F45 R321	F45-E319 WeakPolarHBondContact CB-OE2 3.32Å; F45-E319 HydrophobicContact CD2-CB 4.27Å; E319-R321 PolarHBondContact O-N 3.37Å
320	W	87.6	Confident	94.1	Very high	18 Å²	18	40.3 Å²	40.3	7%	0.068	20%	0.204	C	C	.	.			trans	-102.5	76.2	-175.3	-67.1	7.8	0	0	0	110.4	F40 F45 Q73 Q317 Q322 F323	F40-W320 AromaticContact CE2-CH2 3.48Å; F40-W320 HydrophobicContact CE2-CH2 3.48Å; F40-W320 VanDerWaalsContact CE2-CH2 3.48Å; F40-W320 AromaticContact CE2-CZ2 3.88Å; F40-W320 HydrophobicContact CE2-CZ2 3.88Å; F40-W320 AromaticContact CZ-CH2 3.57Å; F40-W320 HydrophobicContact CZ-CH2 3.57Å; F40-W320 HydrophobicContact CZ-CZ2 4.42Å; F40-W320 HydrophobicContact CZ-CZ3 4.3Å; F45-W320 HydrophobicContact CB-CZ2 4.31Å; F45-W320 HydrophobicContact CD1-CH2 4Å; F45-W320 AromaticContact CD1-CZ2 3.62Å; F45-W320 HydrophobicContact CD1-CZ2 3.62Å; F45-W320 HydrophobicContact CD2-CD2 4.32Å; F45-W320 AromaticContact CD2-CE2 3.91Å; F45-W320 HydrophobicContact CD2-CG 4.48Å; F45-W320 HydrophobicContact CD2-CZ2 4.35Å; F45-W320 AromaticContact CD2-NE1 3.77Å; F45-W320 HydrophobicContact CE1-CE3 4.45Å; F45-W320 AromaticContact CE1-CH2 3.91Å; F45-W320 HydrophobicContact CE1-CH2 3.91Å; F45-W320 AromaticContact CE1-CZ2 3.94Å; F45-W320 HydrophobicContact CE1-CZ2 3.94Å; F45-W320 HydrophobicContact CE1-CZ3 4.16Å; F45-W320 HydrophobicContact CE2-CD2 4.11Å; F45-W320 HydrophobicContact CE2-CG 4.34Å; F45-W320 AromaticContact CG-CE2 3.83Å; F45-W320 AromaticContact CG-CZ2 3.84Å; F45-W320 HydrophobicContact CG-CZ2 3.84Å; F45-W320 AromaticContact CG-NE1 3.88Å; F45-W320 HydrophobicContact CZ-CD2 4.22Å; F45-W320 HydrophobicContact CZ-CE3 4.21Å; F45-W320 HydrophobicContact CZ-CH2 4.46Å; F45-W320 HydrophobicContact CZ-CZ2 4.42Å; F45-W320 HydrophobicContact CZ-CZ3 4.33Å; Q73-W320 HydrophobicContact CB-CH2 3.74Å; Q73-W320 HydrophobicContact CB-CZ2 3.66Å; Q73-W320 HydrophobicContact CB-CZ3 4.45Å; Q73-W320 HydrophobicContact CG-CD2 4.31Å; Q73-W320 HydrophobicContact CG-CH2 4.14Å; Q73-W320 HydrophobicContact CG-CZ2 3.72Å; Q317-W320 PolarHBondContact NE2-O 3.42Å; W320-Q322 PolarHBondContact O-N 2.89Å; W320-Q322 VanDerWaalsContact O-N 3.13Å; W320-F323 HydrophobicContact CB-CB 3.85Å; W320-F323 VanDerWaalsContact O-CB 3.23Å; W320-F323 WeakPolarHBondContact O-CB 3.1Å; W320-F323 PolarHBondContact O-N 2.97Å
321	R	89.7	Confident	94.1	Very high	96 Å²	96	40.3 Å²	40.3	36%	0.362	20%	0.204	S	C	.	.	H	α-helix	trans	-56.5	-34.3	-178.8	-173.9	60.5	-175.4	175.7	3.9	113.2	E319 F323 H324 E354	E319-R321 PolarHBondContact O-N 3.37Å; R321-F323 VanDerWaalsContact C-N 3.27Å; R321-F323 PolarHBondContact O-N 3.44Å; R321-H324 PolarHBondContact NH1-ND1 3.45Å; R321-H324 VanDerWaalsContact O-CB 3.3Å; R321-H324 WeakPolarHBondContact O-CB 3.44Å; R321-H324 PolarHBondContact O-N 3.39Å; R321-H324 VanDerWaalsContact O-N 3.1Å; R321-E354 IonicContact CZ-OE1 2.67Å; R321-E354 IonicContact CZ-OE2 3.38Å; R321-E354 VanDerWaalsContact CZ-OE2 3.3Å; R321-E354 IonicContact NE-OE1 2.7Å; R321-E354 IonicContact NE-OE2 3.94Å; R321-E354 PolarHBondContact NE-OE2 3.22Å; R321-E354 VanDerWaalsContact NH2-CD 3.29Å; R321-E354 IonicContact NH2-OE1 3.26Å; R321-E354 PolarHBondContact NH2-OE1 3.43Å; R321-E354 IonicContact NH2-OE2 3.34Å; R321-E354 PolarHBondContact NH2-OE2 3.03Å
322	Q	87.2	Confident	94.1	Very high	59 Å²	59	37.5 Å²	37.5	28%	0.276	19%	0.191	S	C	.	.	H	α-helix	trans	-67.8	-26.8	177.5	-64.5	75.4	10.9	0	0	112.5	T77 W320 H324 H325 L326	T77-Q322 HydrophobicContact CG2-CB 3.94Å; W320-Q322 PolarHBondContact O-N 2.89Å; W320-Q322 VanDerWaalsContact O-N 3.13Å; Q322-H324 VanDerWaalsContact C-N 3.25Å; Q322-H324 PolarHBondContact O-N 3.46Å; Q322-H325 VanDerWaalsContact O-CB 3.27Å; Q322-H325 WeakPolarHBondContact O-CB 3.44Å; Q322-H325 PolarHBondContact O-N 3.2Å; Q322-H325 VanDerWaalsContact O-N 3.1Å; Q322-L326 PolarHBondContact O-N 2.96Å
323	F	89.7	Confident	94.1	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.009	18%	0.176	C	C	.	.	H	α-helix	trans	-63.9	-34.1	171.5	178.3	-89.7	0	0	0	111.1	M76 S287 L288 F291 S313 W320 R321 H325 L326 C327	M76-F323 HydrophobicContact CE-CD2 3.63Å; M76-F323 HydrophobicContact CE-CE2 3.53Å; S287-F323 WeakPolarHBondContact O-CZ 3.44Å; L288-F323 HydrophobicContact CD1-CE2 4.06Å; F291-F323 HydrophobicContact CB-CE2 4.39Å; F291-F323 HydrophobicContact CB-CZ 3.77Å; F291-F323 HydrophobicContact CG-CZ 4.35Å; S313-F323 VanDerWaalsContact OG-CE1 3.26Å; S313-F323 WeakPolarHBondContact OG-CE1 3.19Å; W320-F323 HydrophobicContact CB-CB 3.85Å; W320-F323 VanDerWaalsContact O-CB 3.23Å; W320-F323 WeakPolarHBondContact O-CB 3.1Å; W320-F323 PolarHBondContact O-N 2.97Å; R321-F323 VanDerWaalsContact C-N 3.27Å; R321-F323 PolarHBondContact O-N 3.44Å; F323-H325 PolarHBondContact O-N 3.39Å; F323-L326 HydrophobicContact CD2-CD1 4.37Å; F323-L326 WeakPolarHBondContact O-CB 3.47Å; F323-L326 PolarHBondContact O-N 2.86Å; F323-L326 VanDerWaalsContact O-N 3.15Å; F323-C327 PolarHBondContact O-N 3.39Å
324	H	94.4	Very high	94.1	Very high	7 Å²	7	35.4 Å²	35.4	3%	0.032	18%	0.176	C	C	.	.	H	α-helix	trans	-64.1	-31.3	174.9	-57.8	-171.9	0	0	0	111	I314 Q317 R321 Q322 L326 C327 F328	I314-H324 HydrophobicContact CG1-CB 4.37Å; Q317-H324 PolarHBondContact NE2-CD2 3.45Å; Q317-H324 PolarHBondContact NE2-NE2 2.92Å; Q317-H324 PolarHBondContact O-CE1 3.39Å; Q317-H324 VanDerWaalsContact O-CE1 3.28Å; Q317-H324 PolarHBondContact O-NE2 3.45Å; R321-H324 PolarHBondContact NH1-ND1 3.45Å; R321-H324 VanDerWaalsContact O-CB 3.3Å; R321-H324 WeakPolarHBondContact O-CB 3.44Å; R321-H324 PolarHBondContact O-N 3.39Å; R321-H324 VanDerWaalsContact O-N 3.1Å; Q322-H324 VanDerWaalsContact C-N 3.25Å; Q322-H324 PolarHBondContact O-N 3.46Å; H324-L326 VanDerWaalsContact C-N 3.3Å; H324-L326 PolarHBondContact O-N 3Å; H324-C327 WeakPolarHBondContact O-CB 3.47Å; H324-C327 PolarHBondContact O-N 3Å; H324-C327 VanDerWaalsContact O-N 3.14Å; H324-F328 HydrophobicContact CB-CE1 4.28Å; H324-F328 HydrophobicContact CB-CE2 4.34Å; H324-F328 HydrophobicContact CB-CZ 4.03Å; H324-F328 VanDerWaalsContact O-CD1 3.3Å; H324-F328 WeakPolarHBondContact O-CD1 3.41Å; H324-F328 WeakPolarHBondContact O-CG 3.15Å; H324-F328 PolarHBondContact O-N 2.94Å
325	H	93	Very high	94.2	Very high	9 Å²	9	34.7 Å²	34.7	4%	0.042	17%	0.172	C	C	.	.	H	α-helix	trans	-65.6	-33.4	177.6	-57.6	167.2	0	0	0	112	Q322 F323 C327 F328 W329 L351 E354 N355	Q322-H325 VanDerWaalsContact O-CB 3.27Å; Q322-H325 WeakPolarHBondContact O-CB 3.44Å; Q322-H325 PolarHBondContact O-N 3.2Å; Q322-H325 VanDerWaalsContact O-N 3.1Å; F323-H325 PolarHBondContact O-N 3.39Å; H325-C327 VanDerWaalsContact C-N 3.35Å; H325-F328 AromaticContact CD2-CD2 3.91Å; H325-F328 AromaticContact CD2-CE2 3.98Å; H325-F328 PolarHBondContact O-N 2.87Å; H325-W329 WeakPolarHBondContact O-CB 3.49Å; H325-W329 PolarHBondContact O-N 3.18Å; H325-L351 HydrophobicContact CB-CD2 3.48Å; H325-L351 VanDerWaalsContact CB-CD2 3.48Å; H325-E354 IonicContact CD2-OE2 3.57Å; H325-E354 IonicContact CE1-OE2 3.67Å; H325-E354 WeakPolarHBondContact NE2-CB 3.35Å; H325-E354 IonicContact NE2-OE2 3.27Å; H325-E354 PolarHBondContact NE2-OE2 2.92Å; H325-N355 WeakPolarHBondContact CB-ND2 3.38Å; H325-N355 WeakPolarHBondContact ND1-CB 3.49Å; H325-N355 PolarHBondContact ND1-ND2 3.28Å
326	L	91.7	Very high	94.2	Very high	58 Å²	58	28.8 Å²	28.8	30%	0.304	14%	0.14	S	C	.	.	H	α-helix	trans	-62.8	-43.7	170.9	-63.6	175.5	0	0	0	111.2	M76 F291 Q322 F323 H324 W329 E330	M76-L326 HydrophobicContact CE-CD1 3.4Å; M76-L326 WeakPolarHBondContact O-CD1 3.32Å; M76-L326 HydrophobicContact SD-CD1 4.35Å; F291-L326 HydrophobicContact CE2-CB 4.01Å; F291-L326 HydrophobicContact CZ-CB 4.42Å; Q322-L326 PolarHBondContact O-N 2.96Å; F323-L326 HydrophobicContact CD2-CD1 4.37Å; F323-L326 WeakPolarHBondContact O-CB 3.47Å; F323-L326 PolarHBondContact O-N 2.86Å; F323-L326 VanDerWaalsContact O-N 3.15Å; H324-L326 VanDerWaalsContact C-N 3.3Å; H324-L326 PolarHBondContact O-N 3Å; L326-W329 WeakPolarHBondContact O-CB 3.25Å; L326-W329 PolarHBondContact O-N 3.13Å; L326-E330 PolarHBondContact O-N 3.43Å
327	C	96.7	Very high	94.3	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-65.3	-43	176.5	-61.4	0	0	0	0	111.7	F310 I314 F323 H324 H325 W329 E330 L331	F310-C327 HydrophobicContact CB-CB 4.42Å; I314-C327 HydrophobicContact CD1-CB 3.55Å; I314-C327 HydrophobicContact CG1-CB 3.51Å; F323-C327 PolarHBondContact O-N 3.39Å; H324-C327 WeakPolarHBondContact O-CB 3.47Å; H324-C327 PolarHBondContact O-N 3Å; H324-C327 VanDerWaalsContact O-N 3.14Å; H325-C327 VanDerWaalsContact C-N 3.35Å; C327-W329 VanDerWaalsContact C-N 3.27Å; C327-W329 PolarHBondContact O-N 3.46Å; C327-E330 PolarHBondContact O-N 2.9Å; C327-L331 WeakPolarHBondContact O-CB 3.45Å; C327-L331 WeakPolarHBondContact O-CD1 3.45Å; C327-L331 WeakPolarHBondContact O-CG 3.3Å; C327-L331 PolarHBondContact O-N 3.25Å
328	F	97.7	Very high	94.6	Very high	10 Å²	10	28.8 Å²	28.8	4%	0.044	14%	0.142	C	C	.	.	H	α-helix	trans	-58.6	-41.6	176.4	-64.7	-13	0	0	0	111.4	I314 H324 H325 L331 I332 Y347 N350 L351	I314-F328 HydrophobicContact CD1-CD1 3.86Å; I314-F328 HydrophobicContact CD1-CE1 3.68Å; I314-F328 HydrophobicContact CG1-CE1 4.46Å; H324-F328 HydrophobicContact CB-CE1 4.28Å; H324-F328 HydrophobicContact CB-CE2 4.34Å; H324-F328 HydrophobicContact CB-CZ 4.03Å; H324-F328 VanDerWaalsContact O-CD1 3.3Å; H324-F328 WeakPolarHBondContact O-CD1 3.41Å; H324-F328 WeakPolarHBondContact O-CG 3.15Å; H324-F328 PolarHBondContact O-N 2.94Å; H325-F328 AromaticContact CD2-CD2 3.91Å; H325-F328 AromaticContact CD2-CE2 3.98Å; H325-F328 PolarHBondContact O-N 2.87Å; F328-L331 HydrophobicContact CD1-CD1 4.42Å; F328-L331 PolarHBondContact O-N 3.27Å; F328-I332 VanDerWaalsContact O-CG1 3.24Å; F328-I332 WeakPolarHBondContact O-CG1 3.48Å; F328-I332 PolarHBondContact O-N 3.22Å; F328-Y347 HydrophobicContact CB-CD1 4.23Å; F328-Y347 AromaticContact CD1-CD1 3.52Å; F328-Y347 HydrophobicContact CD1-CD1 3.52Å; F328-Y347 AromaticContact CD1-CE1 3.81Å; F328-Y347 HydrophobicContact CD1-CE1 3.81Å; F328-Y347 HydrophobicContact CE1-CD1 4.07Å; F328-Y347 HydrophobicContact CE1-CE1 4.05Å; F328-Y347 AromaticContact CG-CD1 3.96Å; F328-Y347 HydrophobicContact CG-CD1 3.96Å; F328-N350 HydrophobicContact CD2-CB 3.92Å; F328-N350 HydrophobicContact CE2-CB 3.86Å; F328-L351 HydrophobicContact CB-CD1 4.37Å; F328-L351 HydrophobicContact CB-CD2 3.94Å; F328-L351 HydrophobicContact CB-CG 3.94Å; F328-L351 HydrophobicContact CD2-CD2 4.19Å
329	W	95.6	Very high	94.9	Very high	46 Å²	46	27.4 Å²	27.4	17%	0.174	12%	0.121	C	C	.	.	H	α-helix	trans	-57.6	-49.7	177.2	177.6	-95.1	0	0	0	112.3	H325 L326 C327 I332 F333 L351 Y362 L365 W443	H325-W329 WeakPolarHBondContact O-CB 3.49Å; H325-W329 PolarHBondContact O-N 3.18Å; L326-W329 WeakPolarHBondContact O-CB 3.25Å; L326-W329 PolarHBondContact O-N 3.13Å; C327-W329 VanDerWaalsContact C-N 3.27Å; C327-W329 PolarHBondContact O-N 3.46Å; W329-I332 PolarHBondContact O-N 3.31Å; W329-F333 AromaticContact CD1-CE2 3.96Å; W329-F333 HydrophobicContact CD2-CE2 4.27Å; W329-F333 AromaticContact CE2-CE2 3.43Å; W329-F333 VanDerWaalsContact CE2-CE2 3.43Å; W329-F333 AromaticContact CE2-CZ 3.74Å; W329-F333 HydrophobicContact CH2-CZ 4.07Å; W329-F333 AromaticContact CZ2-CE2 3.61Å; W329-F333 HydrophobicContact CZ2-CE2 3.61Å; W329-F333 AromaticContact CZ2-CZ 3.42Å; W329-F333 HydrophobicContact CZ2-CZ 3.42Å; W329-F333 VanDerWaalsContact CZ2-CZ 3.42Å; W329-F333 AromaticContact NE1-CE2 3.27Å; W329-F333 VanDerWaalsContact NE1-CE2 3.27Å; W329-L351 HydrophobicContact CB-CD1 4.19Å; W329-L351 HydrophobicContact CE3-CD1 4Å; W329-Y362 HydrophobicContact CE3-CE1 4.05Å; W329-Y362 HydrophobicContact CZ3-CD1 4.28Å; W329-Y362 AromaticContact CZ3-CE1 3.98Å; W329-Y362 HydrophobicContact CZ3-CE1 3.98Å; W329-L365 HydrophobicContact CE3-CD2 4.48Å; W329-L365 HydrophobicContact CZ3-CD2 4Å; W329-W443 AromaticContact CH2-CE2 3.78Å; W329-W443 HydrophobicContact CH2-CH2 4.23Å; W329-W443 AromaticContact CH2-CZ2 3.6Å; W329-W443 HydrophobicContact CH2-CZ2 3.6Å; W329-W443 AromaticContact CH2-NE1 3.92Å; W329-W443 AromaticContact CZ2-CD1 3.87Å; W329-W443 HydrophobicContact CZ2-CD2 4.31Å; W329-W443 AromaticContact CZ2-CE2 3.64Å; W329-W443 HydrophobicContact CZ2-CG 4.46Å; W329-W443 AromaticContact CZ2-CZ2 3.97Å; W329-W443 HydrophobicContact CZ2-CZ2 3.97Å; W329-W443 AromaticContact CZ2-NE1 3.34Å; W329-W443 VanDerWaalsContact CZ2-NE1 3.34Å
330	E	97	Very high	95.3	Very high	20 Å²	20	26.1 Å²	26.1	9%	0.093	12%	0.117	C	C	.	.	H	α-helix	trans	-69.5	-33.3	177.8	-57.2	-55.9	157.4	0	0	112.4	F291 R295 F310 L326 C327 I332 F333 C334	F291-E330 HydrophobicContact CE2-CG 4.12Å; F291-E330 HydrophobicContact CZ-CG 4.42Å; R295-E330 IonicContact NH1-OE2 3.62Å; F310-E330 HydrophobicContact CD1-CB 4.5Å; F310-E330 HydrophobicContact CD2-CB 4.09Å; F310-E330 HydrophobicContact CE1-CB 3.97Å; F310-E330 HydrophobicContact CE1-CG 4.12Å; F310-E330 HydrophobicContact CE2-CB 3.5Å; F310-E330 HydrophobicContact CE2-CG 4.39Å; F310-E330 HydrophobicContact CZ-CB 3.42Å; F310-E330 VanDerWaalsContact CZ-CB 3.42Å; F310-E330 HydrophobicContact CZ-CG 3.81Å; L326-E330 PolarHBondContact O-N 3.43Å; C327-E330 PolarHBondContact O-N 2.9Å; E330-I332 PolarHBondContact O-N 3.41Å; E330-F333 PolarHBondContact O-N 2.96Å; E330-C334 PolarHBondContact O-N 3.18Å; E330-C334 PolarHBondContact O-SG 2.97Å
331	L	98.7	Very high	95.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-64.5	-36.6	176.4	-77.4	163.9	0	0	0	112.7	I307 F310 Q311 I314 C327 F328 F333 C334 H335 Y347	I307-L331 HydrophobicContact CB-CD2 4.11Å; I307-L331 HydrophobicContact CG1-CD2 4.02Å; I307-L331 HydrophobicContact CG2-CD2 3.94Å; F310-L331 HydrophobicContact CB-CD1 4.06Å; F310-L331 HydrophobicContact CB-CD2 3.92Å; F310-L331 HydrophobicContact CB-CG 3.83Å; F310-L331 HydrophobicContact CD2-CD2 4.33Å; F310-L331 HydrophobicContact CD2-CG 4.34Å; F310-L331 HydrophobicContact CG-CG 4.42Å; Q311-L331 HydrophobicContact CG-CD2 4.49Å; I314-L331 HydrophobicContact CD1-CD1 3.79Å; C327-L331 WeakPolarHBondContact O-CB 3.45Å; C327-L331 WeakPolarHBondContact O-CD1 3.45Å; C327-L331 WeakPolarHBondContact O-CG 3.3Å; C327-L331 PolarHBondContact O-N 3.25Å; F328-L331 HydrophobicContact CD1-CD1 4.42Å; F328-L331 PolarHBondContact O-N 3.27Å; L331-F333 VanDerWaalsContact C-N 3.28Å; L331-F333 PolarHBondContact O-N 3.22Å; L331-C334 PolarHBondContact O-N 3.07Å; L331-H335 WeakPolarHBondContact O-CB 3.31Å; L331-H335 PolarHBondContact O-CD2 2.9Å; L331-H335 VanDerWaalsContact O-CD2 3.25Å; L331-H335 PolarHBondContact O-N 2.85Å; L331-Y347 HydrophobicContact CB-CD1 4.41Å; L331-Y347 HydrophobicContact CB-CD2 3.77Å; L331-Y347 HydrophobicContact CB-CE2 3.89Å; L331-Y347 HydrophobicContact CB-CG 4.06Å; L331-Y347 HydrophobicContact CD1-CD1 4.21Å; L331-Y347 HydrophobicContact CD1-CE1 3.71Å; L331-Y347 HydrophobicContact CD1-CE2 4.16Å; L331-Y347 HydrophobicContact CD2-CE2 4.41Å; L331-Y347 HydrophobicContact CG-CE2 4.39Å
332	I	98.5	Very high	96.1	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-57.1	-46.7	173.2	-65.3	161	0	0	0	109.6	F328 W329 E330 S336 A344 A348 L351 L365	F328-I332 VanDerWaalsContact O-CG1 3.24Å; F328-I332 WeakPolarHBondContact O-CG1 3.48Å; F328-I332 PolarHBondContact O-N 3.22Å; W329-I332 PolarHBondContact O-N 3.31Å; E330-I332 PolarHBondContact O-N 3.41Å; I332-S336 VanDerWaalsContact O-CB 3.31Å; I332-S336 WeakPolarHBondContact O-CB 3.46Å; I332-S336 PolarHBondContact O-N 3.29Å; I332-S336 PolarHBondContact O-OG 3.29Å; I332-A344 HydrophobicContact CG2-CB 4.4Å; I332-A348 HydrophobicContact CD1-CB 3.83Å; I332-A348 HydrophobicContact CG1-CB 4.23Å; I332-L351 HydrophobicContact CD1-CD1 3.58Å; I332-L351 HydrophobicContact CD1-CG 4.45Å; I332-L365 HydrophobicContact CD1-CD2 3.75Å; I332-L365 HydrophobicContact CG2-CD1 4.13Å; I332-L365 HydrophobicContact CG2-CD2 3.89Å; I332-L365 HydrophobicContact CG2-CG 4.12Å
333	F	97.8	Very high	96.6	Very high	4 Å²	4	29.9 Å²	29.9	2%	0.018	13%	0.131	C	C	.	.	H	α-helix	trans	-68.9	-47.4	-179.8	-64.9	-41.2	0	0	0	112.5	W329 E330 L331 H335 S336 F337 L440 W443	W329-F333 AromaticContact CD1-CE2 3.96Å; W329-F333 HydrophobicContact CD2-CE2 4.27Å; W329-F333 AromaticContact CE2-CE2 3.43Å; W329-F333 VanDerWaalsContact CE2-CE2 3.43Å; W329-F333 AromaticContact CE2-CZ 3.74Å; W329-F333 HydrophobicContact CH2-CZ 4.07Å; W329-F333 AromaticContact CZ2-CE2 3.61Å; W329-F333 HydrophobicContact CZ2-CE2 3.61Å; W329-F333 AromaticContact CZ2-CZ 3.42Å; W329-F333 HydrophobicContact CZ2-CZ 3.42Å; W329-F333 VanDerWaalsContact CZ2-CZ 3.42Å; W329-F333 AromaticContact NE1-CE2 3.27Å; W329-F333 VanDerWaalsContact NE1-CE2 3.27Å; E330-F333 PolarHBondContact O-N 2.96Å; L331-F333 VanDerWaalsContact C-N 3.28Å; L331-F333 PolarHBondContact O-N 3.22Å; F333-H335 VanDerWaalsContact C-N 3.3Å; F333-H335 PolarHBondContact O-N 3.39Å; F333-S336 CarbonylContact O-C 3.52Å; F333-S336 WeakPolarHBondContact O-CA 3.4Å; F333-S336 WeakPolarHBondContact O-CB 3.45Å; F333-S336 PolarHBondContact O-N 2.53Å; F333-F337 HydrophobicContact CB-CE1 4.04Å; F333-F337 HydrophobicContact CB-CE2 4.11Å; F333-F337 HydrophobicContact CB-CZ 3.63Å; F333-F337 WeakPolarHBondContact O-CD1 3.25Å; F333-F337 WeakPolarHBondContact O-CD2 3.36Å; F333-F337 WeakPolarHBondContact O-CE1 3.19Å; F333-F337 WeakPolarHBondContact O-CG 3.36Å; F333-F337 PolarHBondContact O-N 3.29Å; F333-L440 HydrophobicContact CD1-CD2 3.54Å; F333-L440 HydrophobicContact CE1-CD2 3.92Å; F333-W443 HydrophobicContact CZ-CB 4.17Å; F333-W443 HydrophobicContact CZ-CD2 4.15Å; F333-W443 AromaticContact CZ-CG 3.92Å; F333-W443 HydrophobicContact CZ-CG 3.92Å
334	C	98.5	Very high	97	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-56.2	-44.8	177	-67.4	0	0	0	0	112	I307 E330 L331 F337 L338	I307-C334 HydrophobicContact CD1-CB 4.04Å; I307-C334 HydrophobicContact CG1-CB 3.62Å; E330-C334 PolarHBondContact O-N 3.18Å; E330-C334 PolarHBondContact O-SG 2.97Å; L331-C334 PolarHBondContact O-N 3.07Å; C334-F337 PolarHBondContact O-N 3.37Å; C334-L338 PolarHBondContact O-N 2.98Å
335	H	98.7	Very high	97.2	Very high	7 Å²	7	31.4 Å²	31.4	3%	0.032	14%	0.137	C	C	.	.	H	α-helix	trans	-67.4	-36.3	175.4	-79.6	-56.7	0	0	0	112.8	L331 F333 F337 L338 R339 N340 K343 A344 Y347	L331-H335 WeakPolarHBondContact O-CB 3.31Å; L331-H335 PolarHBondContact O-CD2 2.9Å; L331-H335 VanDerWaalsContact O-CD2 3.25Å; L331-H335 PolarHBondContact O-N 2.85Å; F333-H335 VanDerWaalsContact C-N 3.3Å; F333-H335 PolarHBondContact O-N 3.39Å; H335-F337 VanDerWaalsContact C-N 3.34Å; H335-F337 PolarHBondContact O-N 3.37Å; H335-L338 CarbonylContact O-C 3.58Å; H335-L338 PolarHBondContact O-N 2.99Å; H335-R339 PolarHBondContact O-N 3.42Å; H335-R339 VanDerWaalsContact O-N 3.12Å; H335-N340 HydrophobicContact CB-CB 4.26Å; H335-N340 PolarHBondContact O-N 3.35Å; H335-K343 HydrophobicContact CB-CB 4.34Å; H335-K343 WeakPolarHBondContact CE1-CD 3.29Å; H335-A344 HydrophobicContact CB-CB 3.89Å; H335-Y347 AromaticContact CD2-CD2 3.9Å; H335-Y347 AromaticContact CD2-CE2 3.66Å; H335-Y347 AromaticContact NE2-CE2 3.71Å
336	S	98.3	Very high	97.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.9	-37.2	174	-59.9	0	0	0	0	112.2	I332 F333 L338 R339	I332-S336 VanDerWaalsContact O-CB 3.31Å; I332-S336 WeakPolarHBondContact O-CB 3.46Å; I332-S336 PolarHBondContact O-N 3.29Å; I332-S336 PolarHBondContact O-OG 3.29Å; F333-S336 CarbonylContact O-C 3.52Å; F333-S336 WeakPolarHBondContact O-CA 3.4Å; F333-S336 WeakPolarHBondContact O-CB 3.45Å; F333-S336 PolarHBondContact O-N 2.53Å; S336-L338 PolarHBondContact O-N 3.13Å; S336-R339 PolarHBondContact O-N 3.05Å
337	F	98.2	Very high	97.8	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-65.7	-24.8	176.1	-54.3	-22.8	0	0	0	113	E298 F303 F333 C334 H335 L440 C445 C448 I449 S455	E298-F337 HydrophobicContact CG-CE2 3.99Å; F303-F337 AromaticContact CD1-CD2 3.62Å; F303-F337 HydrophobicContact CD1-CD2 3.62Å; F303-F337 HydrophobicContact CD1-CE2 4.34Å; F303-F337 HydrophobicContact CD2-CB 3.8Å; F303-F337 HydrophobicContact CD2-CD2 4.34Å; F303-F337 AromaticContact CE1-CD2 3.49Å; F303-F337 HydrophobicContact CE1-CD2 3.49Å; F303-F337 VanDerWaalsContact CE1-CD2 3.49Å; F303-F337 HydrophobicContact CE1-CE2 4.05Å; F303-F337 HydrophobicContact CE1-CG 4.37Å; F303-F337 HydrophobicContact CE2-CB 3.79Å; F303-F337 HydrophobicContact CE2-CD2 4.22Å; F303-F337 HydrophobicContact CE2-CG 4.37Å; F303-F337 HydrophobicContact CG-CB 4.22Å; F303-F337 HydrophobicContact CG-CD2 4.07Å; F303-F337 HydrophobicContact CZ-CB 4.22Å; F303-F337 AromaticContact CZ-CD2 3.83Å; F303-F337 HydrophobicContact CZ-CD2 3.83Å; F303-F337 HydrophobicContact CZ-CG 4.3Å; F333-F337 HydrophobicContact CB-CE1 4.04Å; F333-F337 HydrophobicContact CB-CE2 4.11Å; F333-F337 HydrophobicContact CB-CZ 3.63Å; F333-F337 WeakPolarHBondContact O-CD1 3.25Å; F333-F337 WeakPolarHBondContact O-CD2 3.36Å; F333-F337 WeakPolarHBondContact O-CE1 3.19Å; F333-F337 WeakPolarHBondContact O-CG 3.36Å; F333-F337 PolarHBondContact O-N 3.29Å; C334-F337 PolarHBondContact O-N 3.37Å; H335-F337 VanDerWaalsContact C-N 3.34Å; H335-F337 PolarHBondContact O-N 3.37Å; F337-L440 HydrophobicContact CD1-CD1 4.1Å; F337-L440 HydrophobicContact CE1-CD1 4.1Å; F337-L440 HydrophobicContact CE1-CD2 4.07Å; F337-C445 HydrophobicContact CE1-CB 3.56Å; F337-C445 HydrophobicContact CZ-CB 3.65Å; F337-C448 HydrophobicContact CE2-CB 4.35Å; F337-I449 HydrophobicContact CB-CG1 4.42Å; F337-I449 HydrophobicContact CD1-CD1 3.65Å; F337-I449 HydrophobicContact CD1-CG1 3.42Å; F337-I449 VanDerWaalsContact CD1-CG1 3.42Å; F337-I449 HydrophobicContact CD2-CG1 4.47Å; F337-I449 HydrophobicContact CE1-CD1 3.81Å; F337-I449 HydrophobicContact CE1-CG1 3.72Å; F337-I449 HydrophobicContact CG-CG1 3.85Å; F337-I449 HydrophobicContact CZ-CG1 4.33Å; F337-S455 WeakPolarHBondContact O-CB 3.33Å; F337-S455 PolarHBondContact O-OG 3.49Å; F337-S455 VanDerWaalsContact O-OG 3.07Å
338	L	97.9	Very high	97.8	Very high	77 Å²	77	33.3 Å²	33.3	40%	0.403	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	4.3	175.2	-62.1	176.3	0	0	0	112.7	F303 I307 C334 H335 S336 N340	F303-L338 HydrophobicContact CB-CD1 4.18Å; F303-L338 HydrophobicContact CB-CD2 4.27Å; F303-L338 HydrophobicContact CB-CG 4.16Å; F303-L338 HydrophobicContact CD2-CD2 4.11Å; I307-L338 HydrophobicContact CD1-CD1 3.72Å; C334-L338 PolarHBondContact O-N 2.98Å; H335-L338 CarbonylContact O-C 3.58Å; H335-L338 PolarHBondContact O-N 2.99Å; S336-L338 PolarHBondContact O-N 3.13Å; L338-N340 PolarHBondContact O-N 2.81Å
339	R	96.9	Very high	97.9	Very high	74 Å²	74	36.2 Å²	36.2	28%	0.279	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	28.5	-173.3	-57.7	-165.6	-64.4	174.6	-12.6	114.1	H335 S336 W341 Y437 S458 I459 D462	H335-R339 PolarHBondContact O-N 3.42Å; H335-R339 VanDerWaalsContact O-N 3.12Å; S336-R339 PolarHBondContact O-N 3.05Å; R339-W341 VanDerWaalsContact C-N 3.3Å; R339-W341 HydrophobicContact CB-CH2 3.96Å; R339-W341 HydrophobicContact CB-CZ2 3.52Å; R339-W341 HydrophobicContact CG-CH2 3.73Å; R339-W341 HydrophobicContact CG-CZ2 3.51Å; R339-W341 PolarHBondContact O-N 3.07Å; R339-W341 VanDerWaalsContact O-N 3.13Å; R339-Y437 WeakPolarHBondContact CD-OH 3.43Å; R339-S458 PolarHBondContact NE-OG 3.09Å; R339-S458 PolarHBondContact NH1-O 2.68Å; R339-S458 PolarHBondContact NH2-OG 2.87Å; R339-I459 HydrophobicContact CG-CG1 4.45Å; R339-D462 IonicContact NH1-OD1 2.56Å
340	N	97.3	Very high	97.9	Very high	61 Å²	61	37 Å²	37	33%	0.326	16%	0.164	S	C	.	.			trans	-86.6	73.9	172	-168.7	-21.7	0	0	0	109.9	H335 L338 R342 K343 A344	H335-N340 HydrophobicContact CB-CB 4.26Å; H335-N340 PolarHBondContact O-N 3.35Å; L338-N340 PolarHBondContact O-N 2.81Å; N340-R342 VanDerWaalsContact C-N 3.28Å; N340-R342 PolarHBondContact O-N 3.45Å; N340-K343 PolarHBondContact O-N 3.34Å; N340-K343 PolarHBondContact OD1-N 3.38Å; N340-A344 PolarHBondContact O-N 3.45Å
341	W	97.3	Very high	97.9	Very high	13 Å²	13	36 Å²	36	5%	0.049	16%	0.16	C	C	.	.	H	α-helix	trans	-59.4	-38.1	-173	-48.5	129.4	0	0	0	113.3	R339 A344 R345 E373 L436 Y437	R339-W341 VanDerWaalsContact C-N 3.3Å; R339-W341 HydrophobicContact CB-CH2 3.96Å; R339-W341 HydrophobicContact CB-CZ2 3.52Å; R339-W341 HydrophobicContact CG-CH2 3.73Å; R339-W341 HydrophobicContact CG-CZ2 3.51Å; R339-W341 PolarHBondContact O-N 3.07Å; R339-W341 VanDerWaalsContact O-N 3.13Å; W341-A344 PolarHBondContact O-N 2.94Å; W341-R345 WeakPolarHBondContact O-CB 3.5Å; W341-R345 PolarHBondContact O-N 3.1Å; W341-E373 HydrophobicContact CB-CB 3.81Å; W341-E373 HydrophobicContact CB-CG 4.43Å; W341-L436 HydrophobicContact CE3-CD2 3.63Å; W341-L436 HydrophobicContact CH2-CD2 4.41Å; W341-L436 HydrophobicContact CZ3-CD2 3.4Å; W341-L436 VanDerWaalsContact CZ3-CD2 3.4Å; W341-L436 HydrophobicContact CZ3-CG 4.47Å; W341-Y437 AromaticContact CH2-CE1 3.92Å; W341-Y437 HydrophobicContact CH2-CE1 3.92Å; W341-Y437 AromaticContact CH2-CZ 3.71Å; W341-Y437 VanDerWaalsContact CH2-OH 3.3Å; W341-Y437 WeakPolarHBondContact CH2-OH 3.3Å; W341-Y437 WeakPolarHBondContact CZ2-OH 3.33Å
342	R	96.6	Very high	97.8	Very high	154 Å²	154	38.3 Å²	38.3	58%	0.581	17%	0.169	S	C	*	.	H	α-helix	trans	-62.3	-51.8	179.8	180	174.1	173.7	161.6	4.2	111.8	N340 A344 R345 E346	N340-R342 VanDerWaalsContact C-N 3.28Å; N340-R342 PolarHBondContact O-N 3.45Å; R342-A344 PolarHBondContact O-N 2.68Å; R342-R345 WeakPolarHBondContact O-CB 3.45Å; R342-R345 PolarHBondContact O-N 2.81Å; R342-E346 WeakPolarHBondContact CG-OE1 3.4Å; R342-E346 IonicContact NE-OE1 2.87Å; R342-E346 PolarHBondContact NE-OE1 2.86Å; R342-E346 WeakPolarHBondContact O-CG 3.48Å; R342-E346 PolarHBondContact O-N 3.47Å
343	K	98.2	Very high	97.6	Very high	85 Å²	85	42.1 Å²	42.1	37%	0.37	20%	0.2	S	C	.	.	H	α-helix	trans	-65.6	-39.2	177.5	-74.6	-163.2	172.6	-169.1	0	112.2	H335 N340 R345 E346 Y347	H335-K343 HydrophobicContact CB-CB 4.34Å; H335-K343 WeakPolarHBondContact CE1-CD 3.29Å; N340-K343 PolarHBondContact O-N 3.34Å; N340-K343 PolarHBondContact OD1-N 3.38Å; K343-R345 VanDerWaalsContact C-N 3.27Å; K343-R345 PolarHBondContact O-N 2.89Å; K343-E346 PolarHBondContact O-N 3.33Å; K343-Y347 WeakPolarHBondContact O-CD2 3.21Å; K343-Y347 PolarHBondContact O-N 2.92Å
344	A	98.4	Very high	97.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-58.9	-42.1	174.1	0	0	0	0	0	111.3	I332 H335 N340 W341 R342 A348	I332-A344 HydrophobicContact CG2-CB 4.4Å; H335-A344 HydrophobicContact CB-CB 3.89Å; N340-A344 PolarHBondContact O-N 3.45Å; W341-A344 PolarHBondContact O-N 2.94Å; R342-A344 PolarHBondContact O-N 2.68Å; A344-A348 WeakPolarHBondContact O-CB 3.35Å; A344-A348 PolarHBondContact O-N 2.9Å; A344-A348 VanDerWaalsContact O-N 3.07Å
345	R	98.1	Very high	96.8	Very high	41 Å²	41	46.5 Å²	46.5	16%	0.155	22%	0.221	C	C	.	.	H	α-helix	trans	-63.7	-46.1	175.7	-178.1	175.4	54.8	74.9	1.2	112.4	W341 R342 K343 Y347 A348 E349 T366 C369 E373	W341-R345 WeakPolarHBondContact O-CB 3.5Å; W341-R345 PolarHBondContact O-N 3.1Å; R342-R345 WeakPolarHBondContact O-CB 3.45Å; R342-R345 PolarHBondContact O-N 2.81Å; K343-R345 VanDerWaalsContact C-N 3.27Å; K343-R345 PolarHBondContact O-N 2.89Å; R345-Y347 VanDerWaalsContact C-N 3.3Å; R345-Y347 PolarHBondContact O-N 3.44Å; R345-A348 CarbonylContact O-C 3.59Å; R345-A348 WeakPolarHBondContact O-CB 3.19Å; R345-A348 PolarHBondContact O-N 3.49Å; R345-E349 WeakPolarHBondContact CD-OE1 3.49Å; R345-E349 HydrophobicContact CG-CG 4.17Å; R345-E349 VanDerWaalsContact CG-OE1 3.31Å; R345-E349 WeakPolarHBondContact CG-OE1 3.49Å; R345-E349 IonicContact CZ-OE1 2.72Å; R345-E349 IonicContact NE-OE1 2.72Å; R345-E349 VanDerWaalsContact NH1-CD 3.34Å; R345-E349 IonicContact NH1-OE1 3.21Å; R345-E349 PolarHBondContact NH1-OE1 2.89Å; R345-E349 IonicContact NH1-OE2 3.52Å; R345-E349 PolarHBondContact NH1-OE2 3.38Å; R345-E349 WeakPolarHBondContact O-CG 3.21Å; R345-E349 PolarHBondContact O-N 3.19Å; R345-T366 HydrophobicContact CG-CG2 4.13Å; R345-C369 HydrophobicContact CB-CB 3.75Å; R345-C369 HydrophobicContact CG-CB 4.39Å; R345-E373 IonicContact CZ-OE2 3.65Å; R345-E373 IonicContact NE-OE2 3.65Å; R345-E373 PolarHBondContact NE-OE2 2.87Å; R345-E373 IonicContact NH2-OE1 2.65Å; R345-E373 PolarHBondContact NH2-OE1 3.19Å; R345-E373 IonicContact NH2-OE2 2.94Å; R345-E373 PolarHBondContact NH2-OE2 2.76Å; R345-E373 VanDerWaalsContact NH2-OE2 3.16Å
346	E	98.3	Very high	96.1	Very high	73 Å²	73	54.9 Å²	54.9	34%	0.341	26%	0.258	S	S	.	.	H	α-helix	trans	-55.2	-44.6	179.3	-72.8	166.6	-171.5	0	0	111.4	R342 K343 E349 N350	R342-E346 WeakPolarHBondContact CG-OE1 3.4Å; R342-E346 IonicContact NE-OE1 2.87Å; R342-E346 PolarHBondContact NE-OE1 2.86Å; R342-E346 WeakPolarHBondContact O-CG 3.48Å; R342-E346 PolarHBondContact O-N 3.47Å; K343-E346 PolarHBondContact O-N 3.33Å; E346-E349 PolarHBondContact O-N 3.45Å; E346-N350 VanDerWaalsContact O-CG 3.28Å; E346-N350 PolarHBondContact O-N 2.95Å; E346-N350 VanDerWaalsContact O-N 3.1Å; E346-N350 PolarHBondContact O-ND2 3.39Å
347	Y	98.5	Very high	95.1	Very high	35 Å²	35	62.1 Å²	62.1	14%	0.137	29%	0.285	C	S	.	.	H	α-helix	trans	-69.4	-36.6	175.1	-70.3	-64	0	0	0	113.2	Q311 F328 L331 H335 K343 R345 E349 N350 L351	Q311-Y347 PolarHBondContact NE2-OH 2.61Å; F328-Y347 HydrophobicContact CB-CD1 4.23Å; F328-Y347 AromaticContact CD1-CD1 3.52Å; F328-Y347 HydrophobicContact CD1-CD1 3.52Å; F328-Y347 AromaticContact CD1-CE1 3.81Å; F328-Y347 HydrophobicContact CD1-CE1 3.81Å; F328-Y347 HydrophobicContact CE1-CD1 4.07Å; F328-Y347 HydrophobicContact CE1-CE1 4.05Å; F328-Y347 AromaticContact CG-CD1 3.96Å; F328-Y347 HydrophobicContact CG-CD1 3.96Å; L331-Y347 HydrophobicContact CB-CD1 4.41Å; L331-Y347 HydrophobicContact CB-CD2 3.77Å; L331-Y347 HydrophobicContact CB-CE2 3.89Å; L331-Y347 HydrophobicContact CB-CG 4.06Å; L331-Y347 HydrophobicContact CD1-CD1 4.21Å; L331-Y347 HydrophobicContact CD1-CE1 3.71Å; L331-Y347 HydrophobicContact CD1-CE2 4.16Å; L331-Y347 HydrophobicContact CD2-CE2 4.41Å; L331-Y347 HydrophobicContact CG-CE2 4.39Å; H335-Y347 AromaticContact CD2-CD2 3.9Å; H335-Y347 AromaticContact CD2-CE2 3.66Å; H335-Y347 AromaticContact NE2-CE2 3.71Å; K343-Y347 WeakPolarHBondContact O-CD2 3.21Å; K343-Y347 PolarHBondContact O-N 2.92Å; R345-Y347 VanDerWaalsContact C-N 3.3Å; R345-Y347 PolarHBondContact O-N 3.44Å; Y347-E349 VanDerWaalsContact C-N 3.34Å; Y347-N350 PolarHBondContact O-N 3.27Å; Y347-L351 PolarHBondContact O-N 3.07Å
348	A	98.2	Very high	94.6	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.8	-38.4	175.1	0	0	0	0	0	112.1	I332 A344 R345 L351 Y352 L365 T366	I332-A348 HydrophobicContact CD1-CB 3.83Å; I332-A348 HydrophobicContact CG1-CB 4.23Å; A344-A348 WeakPolarHBondContact O-CB 3.35Å; A344-A348 PolarHBondContact O-N 2.9Å; A344-A348 VanDerWaalsContact O-N 3.07Å; R345-A348 CarbonylContact O-C 3.59Å; R345-A348 WeakPolarHBondContact O-CB 3.19Å; R345-A348 PolarHBondContact O-N 3.49Å; A348-L351 PolarHBondContact O-N 3.48Å; A348-Y352 WeakPolarHBondContact O-CB 3.39Å; A348-Y352 PolarHBondContact O-N 2.88Å; A348-L365 HydrophobicContact CB-CG 4.26Å; A348-T366 WeakPolarHBondContact CB-OG1 3.48Å; A348-T366 PolarHBondContact O-OG1 2.76Å
349	E	98.1	Very high	94.3	Very high	70 Å²	70	63.2 Å²	63.2	33%	0.327	28%	0.284	S	S	.	.	H	α-helix	trans	-62.9	-43.5	173.6	-73.7	169.5	176	0	0	111.6	R345 E346 Y347 L351 Y352 A353 T366	R345-E349 WeakPolarHBondContact CD-OE1 3.49Å; R345-E349 HydrophobicContact CG-CG 4.17Å; R345-E349 VanDerWaalsContact CG-OE1 3.31Å; R345-E349 WeakPolarHBondContact CG-OE1 3.49Å; R345-E349 IonicContact CZ-OE1 2.72Å; R345-E349 IonicContact NE-OE1 2.72Å; R345-E349 VanDerWaalsContact NH1-CD 3.34Å; R345-E349 IonicContact NH1-OE1 3.21Å; R345-E349 PolarHBondContact NH1-OE1 2.89Å; R345-E349 IonicContact NH1-OE2 3.52Å; R345-E349 PolarHBondContact NH1-OE2 3.38Å; R345-E349 WeakPolarHBondContact O-CG 3.21Å; R345-E349 PolarHBondContact O-N 3.19Å; E346-E349 PolarHBondContact O-N 3.45Å; Y347-E349 VanDerWaalsContact C-N 3.34Å; E349-L351 VanDerWaalsContact C-N 3.35Å; E349-L351 PolarHBondContact O-N 3.49Å; E349-Y352 PolarHBondContact O-N 3.08Å; E349-A353 WeakPolarHBondContact O-CB 3.45Å; E349-A353 PolarHBondContact O-N 3.45Å; E349-T366 HydrophobicContact CG-CG2 3.54Å
350	N	97.3	Very high	94.2	Very high	62 Å²	62	59.7 Å²	59.7	33%	0.332	27%	0.271	S	S	.	.	H	α-helix	trans	-59.6	-44.8	175	-67.7	-21.8	0	0	0	111.7	F328 E346 Y347 A353 E354	F328-N350 HydrophobicContact CD2-CB 3.92Å; F328-N350 HydrophobicContact CE2-CB 3.86Å; E346-N350 VanDerWaalsContact O-CG 3.28Å; E346-N350 PolarHBondContact O-N 2.95Å; E346-N350 VanDerWaalsContact O-N 3.1Å; E346-N350 PolarHBondContact O-ND2 3.39Å; Y347-N350 PolarHBondContact O-N 3.27Å; N350-A353 PolarHBondContact O-N 3.3Å; N350-E354 WeakPolarHBondContact O-CB 3.45Å; N350-E354 WeakPolarHBondContact O-CG 3.39Å; N350-E354 PolarHBondContact O-N 3.5Å
351	L	95.6	Very high	94.1	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-62.2	-43.8	174.2	-73.2	-176.5	0	0	0	112.4	H325 F328 W329 I332 Y347 A348 E349 A353 N355 Y362	H325-L351 HydrophobicContact CB-CD2 3.48Å; H325-L351 VanDerWaalsContact CB-CD2 3.48Å; F328-L351 HydrophobicContact CB-CD1 4.37Å; F328-L351 HydrophobicContact CB-CD2 3.94Å; F328-L351 HydrophobicContact CB-CG 3.94Å; F328-L351 HydrophobicContact CD2-CD2 4.19Å; W329-L351 HydrophobicContact CB-CD1 4.19Å; W329-L351 HydrophobicContact CE3-CD1 4Å; I332-L351 HydrophobicContact CD1-CD1 3.58Å; I332-L351 HydrophobicContact CD1-CG 4.45Å; Y347-L351 PolarHBondContact O-N 3.07Å; A348-L351 PolarHBondContact O-N 3.48Å; E349-L351 VanDerWaalsContact C-N 3.35Å; E349-L351 PolarHBondContact O-N 3.49Å; L351-A353 VanDerWaalsContact C-N 3.3Å; L351-A353 PolarHBondContact O-N 2.89Å; L351-N355 HydrophobicContact CD2-CB 4.25Å; L351-N355 WeakPolarHBondContact O-CA 3.33Å; L351-N355 VanDerWaalsContact O-CB 3.29Å; L351-N355 WeakPolarHBondContact O-CB 3.43Å; L351-N355 PolarHBondContact O-N 3.42Å; L351-Y362 HydrophobicContact CB-CD1 4Å; L351-Y362 HydrophobicContact CB-CD2 4.19Å; L351-Y362 HydrophobicContact CB-CE1 4.37Å; L351-Y362 HydrophobicContact CB-CG 3.91Å; L351-Y362 HydrophobicContact CD1-CD1 4.12Å; L351-Y362 HydrophobicContact CD1-CE1 4.08Å; L351-Y362 WeakPolarHBondContact O-CD2 3.33Å
352	Y	96.2	Very high	94	Very high	48 Å²	48	57 Å²	57	19%	0.188	26%	0.257	C	S	.	.	H	α-helix	trans	-63.5	-36.8	179.1	173.7	-126.8	0	0	0	112.8	A348 E349 A363 L396 L403	A348-Y352 WeakPolarHBondContact O-CB 3.39Å; A348-Y352 PolarHBondContact O-N 2.88Å; E349-Y352 PolarHBondContact O-N 3.08Å; Y352-A363 HydrophobicContact CD2-CB 3.88Å; Y352-A363 HydrophobicContact CE2-CB 3.78Å; Y352-A363 HydrophobicContact CG-CB 4.5Å; Y352-L396 HydrophobicContact CD1-CD2 4.23Å; Y352-L396 HydrophobicContact CE1-CD2 3.92Å; Y352-L403 HydrophobicContact CE2-CD1 3.53Å
353	A	94.9	Very high	94.1	Very high	80 Å²	80	49.6 Å²	49.6	66%	0.661	23%	0.229	S	C	*	.	H	α-helix	trans	-74.5	-42.5	179.1	0	0	0	0	0	112.5	E349 N350 L351	E349-A353 WeakPolarHBondContact O-CB 3.45Å; E349-A353 PolarHBondContact O-N 3.45Å; N350-A353 PolarHBondContact O-N 3.3Å; L351-A353 VanDerWaalsContact C-N 3.3Å; L351-A353 PolarHBondContact O-N 2.89Å
354	E	92.2	Very high	94.1	Very high	72 Å²	72	45.6 Å²	45.6	34%	0.336	21%	0.212	S	C	.	.	H	α-helix	trans	-103.7	-34.7	-167.1	-61.2	180	-159.2	0	0	114.3	R321 H325 N350	R321-E354 IonicContact CZ-OE1 2.67Å; R321-E354 IonicContact CZ-OE2 3.38Å; R321-E354 VanDerWaalsContact CZ-OE2 3.3Å; R321-E354 IonicContact NE-OE1 2.7Å; R321-E354 IonicContact NE-OE2 3.94Å; R321-E354 PolarHBondContact NE-OE2 3.22Å; R321-E354 VanDerWaalsContact NH2-CD 3.29Å; R321-E354 IonicContact NH2-OE1 3.26Å; R321-E354 PolarHBondContact NH2-OE1 3.43Å; R321-E354 IonicContact NH2-OE2 3.34Å; R321-E354 PolarHBondContact NH2-OE2 3.03Å; H325-E354 IonicContact CD2-OE2 3.57Å; H325-E354 IonicContact CE1-OE2 3.67Å; H325-E354 WeakPolarHBondContact NE2-CB 3.35Å; H325-E354 IonicContact NE2-OE2 3.27Å; H325-E354 PolarHBondContact NE2-OE2 2.92Å; N350-E354 WeakPolarHBondContact O-CB 3.45Å; N350-E354 WeakPolarHBondContact O-CG 3.39Å; N350-E354 PolarHBondContact O-N 3.5Å
355	N	87.5	Confident	94.1	Very high	23 Å²	23	45.7 Å²	45.7	12%	0.123	21%	0.212	C	C	.	.			trans	-94.7	124	-169.7	-169.4	-55.2	0	0	0	111.8	H325 L351 W357 R359 Y362	H325-N355 WeakPolarHBondContact CB-ND2 3.38Å; H325-N355 WeakPolarHBondContact ND1-CB 3.49Å; H325-N355 PolarHBondContact ND1-ND2 3.28Å; L351-N355 HydrophobicContact CD2-CB 4.25Å; L351-N355 WeakPolarHBondContact O-CA 3.33Å; L351-N355 VanDerWaalsContact O-CB 3.29Å; L351-N355 WeakPolarHBondContact O-CB 3.43Å; L351-N355 PolarHBondContact O-N 3.42Å; N355-W357 WeakPolarHBondContact OD1-CB 3.4Å; N355-W357 PolarHBondContact OD1-N 3.01Å; N355-R359 VanDerWaalsContact O-CG 3.28Å; N355-R359 WeakPolarHBondContact O-CG 3.43Å; N355-Y362 HydrophobicContact CB-CD2 4.25Å; N355-Y362 HydrophobicContact CB-CE2 3.55Å; N355-Y362 WeakPolarHBondContact OD1-CE2 3.33Å; N355-Y362 PolarHBondContact OD1-OH 2.92Å; N355-Y362 VanDerWaalsContact OD1-OH 3.12Å
356	K	83.2	Confident	94.1	Very high	183 Å²	183	43.8 Å²	43.8	80%	0.796	21%	0.205	S	C	*	.			trans	-88.9	-10.2	-175.4	-63.1	-178.4	-171.5	175.8	0	114.4
357	W	78.2	Confident	94.2	Very high	153 Å²	153	40.3 Å²	40.3	58%	0.58	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-46.8	-169.1	-175.1	63.8	0	0	0	113.4	N355	N355-W357 WeakPolarHBondContact OD1-CB 3.4Å; N355-W357 PolarHBondContact OD1-N 3.01Å
358	S	86.9	Confident	94.2	Very high	3 Å²	3	38.7 Å²	38.7	2%	0.021	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-146.8	65.8	177.3	-167.5	0	0	0	0	112	S360 T361 Y362 E415	S358-S360 PolarHBondContact O-N 3.47Å; S358-S360 VanDerWaalsContact O-N 3.14Å; S358-T361 WeakPolarHBondContact O-CA 3.32Å; S358-T361 WeakPolarHBondContact O-CB 3.25Å; S358-T361 PolarHBondContact O-N 3.2Å; S358-T361 VanDerWaalsContact OG-CB 3.3Å; S358-T361 WeakPolarHBondContact OG-CB 3.4Å; S358-T361 PolarHBondContact OG-OG1 3.49Å; S358-Y362 VanDerWaalsContact O-CD2 3.32Å; S358-Y362 WeakPolarHBondContact O-CD2 3.4Å; S358-Y362 PolarHBondContact O-N 3.34Å; S358-E415 WeakPolarHBondContact CA-OE1 3.38Å; S358-E415 WeakPolarHBondContact CB-OE1 3.45Å; S358-E415 WeakPolarHBondContact OG-CG 3.23Å; S358-E415 PolarHBondContact OG-OE1 3.4Å
359	R	92.1	Very high	94.2	Very high	96 Å²	96	38.7 Å²	38.7	36%	0.362	18%	0.183	S	C	.	.	H	α-helix	trans	-55.2	-33.1	179.7	-65.9	-173	70.6	-151.7	-1.9	113	N355 Y362 A363 L403	N355-R359 VanDerWaalsContact O-CG 3.28Å; N355-R359 WeakPolarHBondContact O-CG 3.43Å; R359-Y362 PolarHBondContact O-N 2.89Å; R359-A363 WeakPolarHBondContact O-CB 3.34Å; R359-A363 PolarHBondContact O-N 3.46Å; R359-L403 HydrophobicContact CB-CB 4.24Å; R359-L403 HydrophobicContact CB-CD1 4.41Å; R359-L403 HydrophobicContact CB-CD2 4.2Å
360	S	94.9	Very high	94.1	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60.9	-43.8	174	-175.5	0	0	0	0	112	S358 Y364 V400	S358-S360 PolarHBondContact O-N 3.47Å; S358-S360 VanDerWaalsContact O-N 3.14Å; S360-Y364 WeakPolarHBondContact O-CB 3.31Å; S360-Y364 PolarHBondContact O-N 3.42Å; S360-Y364 VanDerWaalsContact O-N 3.14Å; S360-V400 WeakPolarHBondContact CB-O 3.3Å; S360-V400 PolarHBondContact OG-O 3.13Å
361	T	95.1	Very high	94.1	Very high	7 Å²	7	34.1 Å²	34.1	4%	0.043	16%	0.16	C	C	.	.	H	α-helix	trans	-67.3	-44.3	176.7	-57.4	0	0	0	0	111.1	S358 Y364 L365 V414 W443	S358-T361 WeakPolarHBondContact O-CA 3.32Å; S358-T361 WeakPolarHBondContact O-CB 3.25Å; S358-T361 PolarHBondContact O-N 3.2Å; S358-T361 VanDerWaalsContact OG-CB 3.3Å; S358-T361 WeakPolarHBondContact OG-CB 3.4Å; S358-T361 PolarHBondContact OG-OG1 3.49Å; T361-Y364 PolarHBondContact O-N 3.28Å; T361-L365 WeakPolarHBondContact O-CB 3.46Å; T361-L365 PolarHBondContact O-N 3.24Å; T361-V414 HydrophobicContact CG2-CG1 3.77Å; T361-W443 HydrophobicContact CG2-CH2 4.08Å; T361-W443 HydrophobicContact CG2-CZ2 4.36Å
362	Y	96.5	Very high	94.1	Very high	10 Å²	10	34.9 Å²	34.9	4%	0.039	17%	0.166	C	C	.	.	H	α-helix	trans	-65.3	-42.9	-179.7	-51.5	-39.8	0	0	0	111.9	W329 L351 N355 S358 R359 Y364 L365 T366	W329-Y362 HydrophobicContact CE3-CE1 4.05Å; W329-Y362 HydrophobicContact CZ3-CD1 4.28Å; W329-Y362 AromaticContact CZ3-CE1 3.98Å; W329-Y362 HydrophobicContact CZ3-CE1 3.98Å; L351-Y362 HydrophobicContact CB-CD1 4Å; L351-Y362 HydrophobicContact CB-CD2 4.19Å; L351-Y362 HydrophobicContact CB-CE1 4.37Å; L351-Y362 HydrophobicContact CB-CG 3.91Å; L351-Y362 HydrophobicContact CD1-CD1 4.12Å; L351-Y362 HydrophobicContact CD1-CE1 4.08Å; L351-Y362 WeakPolarHBondContact O-CD2 3.33Å; N355-Y362 HydrophobicContact CB-CD2 4.25Å; N355-Y362 HydrophobicContact CB-CE2 3.55Å; N355-Y362 WeakPolarHBondContact OD1-CE2 3.33Å; N355-Y362 PolarHBondContact OD1-OH 2.92Å; N355-Y362 VanDerWaalsContact OD1-OH 3.12Å; S358-Y362 VanDerWaalsContact O-CD2 3.32Å; S358-Y362 WeakPolarHBondContact O-CD2 3.4Å; S358-Y362 PolarHBondContact O-N 3.34Å; R359-Y362 PolarHBondContact O-N 2.89Å; Y362-Y364 VanDerWaalsContact C-N 3.31Å; Y362-Y364 PolarHBondContact O-N 3.42Å; Y362-L365 PolarHBondContact O-N 3.28Å; Y362-T366 PolarHBondContact O-N 3.27Å; Y362-T366 PolarHBondContact O-OG1 3.17Å
363	A	98.2	Very high	94.1	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59	-42.5	174.1	0	0	0	0	0	112.1	Y352 R359 A367 L396 V400 L403	Y352-A363 HydrophobicContact CD2-CB 3.88Å; Y352-A363 HydrophobicContact CE2-CB 3.78Å; Y352-A363 HydrophobicContact CG-CB 4.5Å; R359-A363 WeakPolarHBondContact O-CB 3.34Å; R359-A363 PolarHBondContact O-N 3.46Å; A363-A367 PolarHBondContact O-N 2.96Å; A363-L396 HydrophobicContact CB-CD2 4.28Å; A363-V400 HydrophobicContact CB-CG2 3.98Å; A363-L403 HydrophobicContact CB-CD1 3.81Å
364	Y	98.5	Very high	94	Very high	0 Å²	0	30 Å²	30	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-66.2	-41.9	176.5	-177.3	-111.3	0	0	0	111.9	S360 T361 Y362 A367 C368 M397 V400 F417 C418 K421 L432 L439	S360-Y364 WeakPolarHBondContact O-CB 3.31Å; S360-Y364 PolarHBondContact O-N 3.42Å; S360-Y364 VanDerWaalsContact O-N 3.14Å; T361-Y364 PolarHBondContact O-N 3.28Å; Y362-Y364 VanDerWaalsContact C-N 3.31Å; Y362-Y364 PolarHBondContact O-N 3.42Å; Y364-A367 WeakPolarHBondContact O-CB 3.48Å; Y364-A367 PolarHBondContact O-N 2.95Å; Y364-C368 VanDerWaalsContact CE1-SG 3.55Å; Y364-C368 VanDerWaalsContact CZ-SG 3.52Å; Y364-C368 PolarHBondContact O-N 3.08Å; Y364-C368 PolarHBondContact O-SG 2.89Å; Y364-M397 HydrophobicContact CD2-CE 4.23Å; Y364-M397 HydrophobicContact CD2-SD 3.99Å; Y364-M397 HydrophobicContact CE2-CE 3.91Å; Y364-M397 HydrophobicContact CE2-SD 4.1Å; Y364-V400 HydrophobicContact CD2-CG2 4.47Å; Y364-F417 HydrophobicContact CE1-CE1 4.06Å; Y364-C418 HydrophobicContact CD1-CB 3.92Å; Y364-C418 VanDerWaalsContact CD1-SG 3.5Å; Y364-C418 HydrophobicContact CG-CB 3.81Å; Y364-K421 HydrophobicContact CE1-CB 4.39Å; Y364-K421 HydrophobicContact CE2-CB 3.62Å; Y364-K421 VanDerWaalsContact OH-CB 3.26Å; Y364-K421 WeakPolarHBondContact OH-CB 3.43Å; Y364-K421 WeakPolarHBondContact OH-CG 3.41Å; Y364-L432 HydrophobicContact CE2-CD1 4.15Å; Y364-L439 HydrophobicContact CD1-CD1 3.88Å; Y364-L439 HydrophobicContact CD1-CD2 4.39Å; Y364-L439 HydrophobicContact CE1-CD1 3.73Å; Y364-L439 HydrophobicContact CE1-CD2 3.78Å; Y364-L439 HydrophobicContact CE1-CG 3.98Å
365	L	98.1	Very high	93.8	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.01	12%	0.123	C	C	.	.	H	α-helix	trans	-63.8	-43.9	177.9	-177	58.4	0	0	0	111.8	W329 I332 A348 T361 Y362 A367 C368 C369 L436 L439	W329-L365 HydrophobicContact CE3-CD2 4.48Å; W329-L365 HydrophobicContact CZ3-CD2 4Å; I332-L365 HydrophobicContact CD1-CD2 3.75Å; I332-L365 HydrophobicContact CG2-CD1 4.13Å; I332-L365 HydrophobicContact CG2-CD2 3.89Å; I332-L365 HydrophobicContact CG2-CG 4.12Å; A348-L365 HydrophobicContact CB-CG 4.26Å; T361-L365 WeakPolarHBondContact O-CB 3.46Å; T361-L365 PolarHBondContact O-N 3.24Å; Y362-L365 PolarHBondContact O-N 3.28Å; L365-A367 VanDerWaalsContact C-N 3.33Å; L365-A367 PolarHBondContact O-N 3.15Å; L365-C368 WeakPolarHBondContact O-CB 3.17Å; L365-C368 PolarHBondContact O-N 2.91Å; L365-C369 PolarHBondContact O-N 3.42Å; L365-C369 PolarHBondContact O-SG 3.27Å; L365-L436 HydrophobicContact CD1-CD1 3.98Å; L365-L439 HydrophobicContact CD1-CD1 3.96Å
366	T	98.6	Very high	93.8	Very high	2 Å²	2	30.7 Å²	30.7	1%	0.012	14%	0.138	C	C	.	.	H	α-helix	trans	-57	-46.8	172.1	-57.9	0	0	0	0	110.9	R345 A348 E349 Y362 C368 C369 L370 L396	R345-T366 HydrophobicContact CG-CG2 4.13Å; A348-T366 WeakPolarHBondContact CB-OG1 3.48Å; A348-T366 PolarHBondContact O-OG1 2.76Å; E349-T366 HydrophobicContact CG-CG2 3.54Å; Y362-T366 PolarHBondContact O-N 3.27Å; Y362-T366 PolarHBondContact O-OG1 3.17Å; T366-C368 VanDerWaalsContact C-N 3.32Å; T366-C368 PolarHBondContact O-N 3.06Å; T366-C369 PolarHBondContact O-N 3.49Å; T366-L370 WeakPolarHBondContact O-CB 3.34Å; T366-L370 PolarHBondContact O-N 2.99Å; T366-L396 HydrophobicContact CG2-CD1 3.6Å; T366-L396 HydrophobicContact CG2-CD2 4.41Å
367	A	98.6	Very high	94.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-61.7	-39.6	177.1	0	0	0	0	0	112.1	A363 Y364 L365 L370 I371 L396 M397	A363-A367 PolarHBondContact O-N 2.96Å; Y364-A367 WeakPolarHBondContact O-CB 3.48Å; Y364-A367 PolarHBondContact O-N 2.95Å; L365-A367 VanDerWaalsContact C-N 3.33Å; L365-A367 PolarHBondContact O-N 3.15Å; A367-L370 PolarHBondContact O-N 3.3Å; A367-I371 WeakPolarHBondContact O-CB 3.49Å; A367-I371 WeakPolarHBondContact O-CG1 3.29Å; A367-I371 PolarHBondContact O-N 3.45Å; A367-L396 HydrophobicContact CB-CB 3.94Å; A367-L396 HydrophobicContact CB-CD1 4.18Å; A367-M397 HydrophobicContact CB-CE 4.1Å; A367-M397 HydrophobicContact CB-CG 4.35Å; A367-M397 HydrophobicContact CB-SD 4.37Å
368	C	98.4	Very high	94.5	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-64.1	-41.3	176.7	-66.5	0	0	0	0	112.5	Y364 L365 T366 S372 P435 L436 L439	Y364-C368 VanDerWaalsContact CE1-SG 3.55Å; Y364-C368 VanDerWaalsContact CZ-SG 3.52Å; Y364-C368 PolarHBondContact O-N 3.08Å; Y364-C368 PolarHBondContact O-SG 2.89Å; L365-C368 WeakPolarHBondContact O-CB 3.17Å; L365-C368 PolarHBondContact O-N 2.91Å; T366-C368 VanDerWaalsContact C-N 3.32Å; T366-C368 PolarHBondContact O-N 3.06Å; C368-S372 PolarHBondContact O-N 3.18Å; C368-S372 PolarHBondContact O-OG 2.94Å; C368-P435 HydrophobicContact CB-CG 4.4Å; C368-L436 HydrophobicContact CB-CB 4.05Å; C368-L436 HydrophobicContact CB-CD1 4.29Å; C368-L439 HydrophobicContact CB-CD1 4.49Å
369	C	98.4	Very high	94.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.8	-45.1	175.1	-61.8	0	0	0	0	110.7	R345 L365 T366 S372 E373	R345-C369 HydrophobicContact CB-CB 3.75Å; R345-C369 HydrophobicContact CG-CB 4.39Å; L365-C369 PolarHBondContact O-N 3.42Å; L365-C369 PolarHBondContact O-SG 3.27Å; T366-C369 PolarHBondContact O-N 3.49Å; C369-S372 WeakPolarHBondContact O-CB 3.48Å; C369-S372 PolarHBondContact O-N 3.4Å; C369-S372 VanDerWaalsContact O-N 3.15Å; C369-E373 PolarHBondContact O-N 3.35Å
370	L	97.6	Very high	93.8	Very high	8 Å²	8	26.1 Å²	26.1	4%	0.042	14%	0.138	C	C	.	.	H	α-helix	trans	-65.8	-40.1	179.5	-169.8	56.7	0	0	0	112.6	T366 A367 S372 E373 I374 A389 N392 V393	T366-L370 WeakPolarHBondContact O-CB 3.34Å; T366-L370 PolarHBondContact O-N 2.99Å; A367-L370 PolarHBondContact O-N 3.3Å; L370-S372 PolarHBondContact O-N 2.95Å; L370-E373 PolarHBondContact O-N 2.85Å; L370-I374 HydrophobicContact CG-CD1 4.35Å; L370-I374 VanDerWaalsContact O-CG1 3.27Å; L370-I374 WeakPolarHBondContact O-CG1 3.17Å; L370-I374 PolarHBondContact O-N 3.39Å; L370-A389 HydrophobicContact CD1-CB 3.83Å; L370-A389 WeakPolarHBondContact CD2-O 3.28Å; L370-A389 HydrophobicContact CG-CB 4.27Å; L370-N392 HydrophobicContact CD2-CB 3.57Å; L370-V393 HydrophobicContact CB-CG2 3.94Å; L370-V393 HydrophobicContact CD2-CG2 3.69Å; L370-V393 HydrophobicContact CG-CG2 3.72Å
371	I	96.8	Very high	92.9	Very high	28 Å²	28	30.2 Å²	30.2	14%	0.144	16%	0.16	C	C	.	.	H	α-helix	trans	-57.4	-41	172.2	-72.2	166.7	0	0	0	110.8	A367 V393 M397 F425 P435	A367-I371 WeakPolarHBondContact O-CB 3.49Å; A367-I371 WeakPolarHBondContact O-CG1 3.29Å; A367-I371 PolarHBondContact O-N 3.45Å; I371-V393 HydrophobicContact CD1-CG1 3.94Å; I371-V393 HydrophobicContact CG1-CG1 3.82Å; I371-V393 HydrophobicContact CG1-CG2 3.88Å; I371-M397 HydrophobicContact CD1-CE 3.76Å; I371-F425 HydrophobicContact CD1-CE2 4.33Å; I371-P435 HydrophobicContact CD1-CG 4.05Å; I371-P435 HydrophobicContact CG2-CG 4.18Å
372	S	96.1	Very high	91.9	Very high	17 Å²	17	32.1 Å²	32.1	12%	0.119	18%	0.181	C	C	.	.	H	α-helix	trans	-70.6	-37.1	179.1	-50.6	0	0	0	0	111.7	C368 C369 L370	C368-S372 PolarHBondContact O-N 3.18Å; C368-S372 PolarHBondContact O-OG 2.94Å; C369-S372 WeakPolarHBondContact O-CB 3.48Å; C369-S372 PolarHBondContact O-N 3.4Å; C369-S372 VanDerWaalsContact O-N 3.15Å; L370-S372 PolarHBondContact O-N 2.95Å
373	E	95	Very high	91.3	Very high	21 Å²	21	38 Å²	38	10%	0.098	21%	0.213	C	C	.	.	H	α-helix	trans	-67	-42	175.8	-171.6	176.3	-175.2	0	0	112.6	W341 R345 C369 L370 E375 V376 L377	W341-E373 HydrophobicContact CB-CB 3.81Å; W341-E373 HydrophobicContact CB-CG 4.43Å; R345-E373 IonicContact CZ-OE2 3.65Å; R345-E373 IonicContact NE-OE2 3.65Å; R345-E373 PolarHBondContact NE-OE2 2.87Å; R345-E373 IonicContact NH2-OE1 2.65Å; R345-E373 PolarHBondContact NH2-OE1 3.19Å; R345-E373 IonicContact NH2-OE2 2.94Å; R345-E373 PolarHBondContact NH2-OE2 2.76Å; R345-E373 VanDerWaalsContact NH2-OE2 3.16Å; C369-E373 PolarHBondContact O-N 3.35Å; L370-E373 PolarHBondContact O-N 2.85Å; E373-E375 PolarHBondContact O-N 3.24Å; E373-V376 WeakPolarHBondContact O-CA 3.5Å; E373-V376 WeakPolarHBondContact O-CB 3.39Å; E373-V376 PolarHBondContact O-N 3.26Å; E373-L377 HydrophobicContact CG-CD1 4.09Å; E373-L377 HydrophobicContact CG-CG 4.15Å; E373-L377 WeakPolarHBondContact O-CG 3.38Å; E373-L377 PolarHBondContact O-N 3.48Å
374	I	94.1	Very high	90.9	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-53.8	-39.1	178.7	-75.9	164.4	0	0	0	111.7	L370 V376 L377 K378 V386 A389 L390 V393	L370-I374 HydrophobicContact CG-CD1 4.35Å; L370-I374 VanDerWaalsContact O-CG1 3.27Å; L370-I374 WeakPolarHBondContact O-CG1 3.17Å; L370-I374 PolarHBondContact O-N 3.39Å; I374-V376 PolarHBondContact O-N 2.93Å; I374-L377 PolarHBondContact O-N 2.93Å; I374-K378 HydrophobicContact CG2-CD 4.19Å; I374-K378 HydrophobicContact CG2-CG 4.38Å; I374-K378 WeakPolarHBondContact O-CG 3.36Å; I374-K378 PolarHBondContact O-N 3.24Å; I374-V386 HydrophobicContact CG2-CG1 4.23Å; I374-A389 HydrophobicContact CD1-CB 3.76Å; I374-A389 HydrophobicContact CG1-CB 3.49Å; I374-A389 VanDerWaalsContact CG1-CB 3.49Å; I374-L390 HydrophobicContact CD1-CD2 3.95Å; I374-L390 HydrophobicContact CD1-CG 4.15Å; I374-V393 HydrophobicContact CD1-CG2 3.89Å
375	E	86.9	Confident	90.4	Very high	39 Å²	39	44 Å²	44	18%	0.182	26%	0.257	C	S	.	.	H	α-helix	trans	-67.7	-23.7	179.6	-69	-58.5	127.8	0	0	113.5	E373 K378 Q379 R469	E373-E375 PolarHBondContact O-N 3.24Å; E375-K378 IonicContact OE1-NZ 2.99Å; E375-K378 PolarHBondContact OE1-NZ 2.86Å; E375-Q379 PolarHBondContact O-NE2 3Å; E375-R469 IonicContact OE2-NH1 2.67Å; E375-R469 PolarHBondContact OE2-NH1 2.95Å
376	V	87.9	Confident	90.2	Very high	71 Å²	71	44.5 Å²	44.5	43%	0.43	26%	0.26	S	S	.	.	H	α-helix	trans	-82.1	-44.6	170	-178.1	0	0	0	0	110	E373 I374 K378 Q379 S380	E373-V376 WeakPolarHBondContact O-CA 3.5Å; E373-V376 WeakPolarHBondContact O-CB 3.39Å; E373-V376 PolarHBondContact O-N 3.26Å; I374-V376 PolarHBondContact O-N 2.93Å; V376-K378 VanDerWaalsContact C-N 3.31Å; V376-K378 PolarHBondContact O-N 2.84Å; V376-Q379 WeakPolarHBondContact O-CB 3.27Å; V376-Q379 PolarHBondContact O-N 3.29Å; V376-S380 PolarHBondContact O-N 3.47Å; V376-S380 PolarHBondContact O-OG 2.62Å
377	L	89	Confident	90	Very high	26 Å²	26	49.3 Å²	49.3	14%	0.136	29%	0.286	C	S	.	.	H	α-helix	trans	-59	-39.1	-180	-67.8	174.7	0	0	0	112.8	E373 I374 Q379 S380 N381 V386 A389	E373-L377 HydrophobicContact CG-CD1 4.09Å; E373-L377 HydrophobicContact CG-CG 4.15Å; E373-L377 WeakPolarHBondContact O-CG 3.38Å; E373-L377 PolarHBondContact O-N 3.48Å; I374-L377 PolarHBondContact O-N 2.93Å; L377-Q379 PolarHBondContact O-N 3.08Å; L377-S380 PolarHBondContact O-N 3.2Å; L377-S380 VanDerWaalsContact O-N 3.1Å; L377-N381 HydrophobicContact CD2-CB 4.4Å; L377-N381 PolarHBondContact O-N 3.42Å; L377-V386 HydrophobicContact CB-CG2 4.08Å; L377-A389 HydrophobicContact CD1-CB 4.48Å
378	K	87.3	Confident	89.7	Confident	110 Å²	110	55.6 Å²	55.6	48%	0.478	32%	0.315	S	S	.	.	H	α-helix	trans	-57.7	-18.9	174.2	-75.4	172.4	-178.1	168.5	0	113.9	I374 E375 V376 V386	I374-K378 HydrophobicContact CG2-CD 4.19Å; I374-K378 HydrophobicContact CG2-CG 4.38Å; I374-K378 WeakPolarHBondContact O-CG 3.36Å; I374-K378 PolarHBondContact O-N 3.24Å; E375-K378 IonicContact OE1-NZ 2.99Å; E375-K378 PolarHBondContact OE1-NZ 2.86Å; V376-K378 VanDerWaalsContact C-N 3.31Å; V376-K378 PolarHBondContact O-N 2.84Å; K378-V386 HydrophobicContact CG-CG1 4.07Å; K378-V386 HydrophobicContact CG-CG2 4.06Å
379	Q	82.2	Confident	89.6	Confident	122 Å²	122	55.9 Å²	55.9	57%	0.57	32%	0.318	S	S	*	.	H	α-helix	trans	-95.3	-23.6	179.5	-59.1	171.9	44.8	0	0	112.7	E375 V376 L377	E375-Q379 PolarHBondContact O-NE2 3Å; V376-Q379 WeakPolarHBondContact O-CB 3.27Å; V376-Q379 PolarHBondContact O-N 3.29Å; L377-Q379 PolarHBondContact O-N 3.08Å
380	S	82.4	Confident	89.4	Confident	82 Å²	82	59.4 Å²	59.4	57%	0.573	34%	0.336	S	S	*	.	H	α-helix	trans	-121.4	-21.8	-168.6	63.4	0	0	0	0	115.5	V376 L377	V376-S380 PolarHBondContact O-N 3.47Å; V376-S380 PolarHBondContact O-OG 2.62Å; L377-S380 PolarHBondContact O-N 3.2Å; L377-S380 VanDerWaalsContact O-N 3.1Å
381	N	74.4	Confident	89.4	Confident	85 Å²	85	63.6 Å²	63.6	46%	0.455	36%	0.355	S	S	.	.	S	Bend	trans	-121.9	170.2	-168.1	-70	34.3	0	0	0	112.3	L377	L377-N381 HydrophobicContact CD2-CB 4.4Å; L377-N381 PolarHBondContact O-N 3.42Å
382	G	74.7	Confident	89.5	Confident	48 Å²	48	65.2 Å²	65.2	50%	0.495	36%	0.364	S	S	.	.			trans	-79.8	162.8	173.8	0	0	0	0	0	113.7	S384 A385	G382-S384 PolarHBondContact O-N 3.49Å; G382-S384 VanDerWaalsContact O-N 3.11Å; G382-A385 PolarHBondContact O-N 2.82Å
383	D	85.2	Confident	89.6	Confident	134 Å²	134	64.5 Å²	64.5	72%	0.717	36%	0.359	S	S	*	.	H	α-helix	trans	-54.8	-32.6	-173	-63.9	-29.1	0	0	0	113.8	A385 V386 D387	D383-A385 PolarHBondContact O-N 3.21Å; D383-V386 WeakPolarHBondContact O-CB 3.34Å; D383-V386 PolarHBondContact O-N 3.23Å; D383-D387 PolarHBondContact O-N 2.86Å
384	S	88.4	Confident	89.8	Confident	94 Å²	94	64.9 Å²	64.9	66%	0.657	36%	0.362	S	S	*	.	H	α-helix	trans	-63	-40.9	-176.7	60.4	0	0	0	0	114.5	G382 V386 D387 E388	G382-S384 PolarHBondContact O-N 3.49Å; G382-S384 VanDerWaalsContact O-N 3.11Å; S384-V386 VanDerWaalsContact C-N 3.29Å; S384-V386 PolarHBondContact O-N 3.4Å; S384-D387 PolarHBondContact O-N 3.49Å; S384-E388 PolarHBondContact O-N 3.25Å
385	A	89.1	Confident	90	Very high	31 Å²	31	69.8 Å²	69.8	26%	0.256	39%	0.385	S	S	.	.	H	α-helix	trans	-69.9	-31.6	179	0	0	0	0	0	111.4	G382 D383 A389	G382-A385 PolarHBondContact O-N 2.82Å; D383-A385 PolarHBondContact O-N 3.21Å; A385-A389 WeakPolarHBondContact O-CB 3.27Å; A385-A389 PolarHBondContact O-N 2.94Å; A385-A389 VanDerWaalsContact O-N 3.16Å
386	V	93	Very high	90.5	Very high	13 Å²	13	68.9 Å²	68.9	8%	0.079	38%	0.381	C	S	.	.	H	α-helix	trans	-69.8	-43.5	174.9	175.7	0	0	0	0	110.1	I374 L377 K378 D383 S384 A389 L390	I374-V386 HydrophobicContact CG2-CG1 4.23Å; L377-V386 HydrophobicContact CB-CG2 4.08Å; K378-V386 HydrophobicContact CG-CG1 4.07Å; K378-V386 HydrophobicContact CG-CG2 4.06Å; D383-V386 WeakPolarHBondContact O-CB 3.34Å; D383-V386 PolarHBondContact O-N 3.23Å; S384-V386 VanDerWaalsContact C-N 3.29Å; S384-V386 PolarHBondContact O-N 3.4Å; V386-A389 PolarHBondContact O-N 3.33Å; V386-L390 HydrophobicContact CG1-CD1 3.95Å; V386-L390 HydrophobicContact CG1-CG 4.41Å; V386-L390 WeakPolarHBondContact O-CB 3.25Å; V386-L390 VanDerWaalsContact O-CG 3.28Å; V386-L390 WeakPolarHBondContact O-CG 3.47Å; V386-L390 PolarHBondContact O-N 3.31Å
387	D	93.7	Very high	91	Very high	102 Å²	102	65.5 Å²	65.5	55%	0.545	36%	0.36	S	S	.	.	H	α-helix	trans	-62.9	-44.5	178.2	-70.8	-24.2	0	0	0	112.3	D383 S384 A389 L390 E391	D383-D387 PolarHBondContact O-N 2.86Å; S384-D387 PolarHBondContact O-N 3.49Å; D387-A389 PolarHBondContact O-N 3.42Å; D387-L390 PolarHBondContact O-N 3.17Å; D387-E391 PolarHBondContact O-N 3.34Å
388	E	94.1	Very high	91.5	Very high	132 Å²	132	70.5 Å²	70.5	62%	0.617	38%	0.378	S	S	*	.	H	α-helix	trans	-60.8	-45.9	175.3	-175.6	-177	171.7	0	0	111.5	S384 L390 E391 N392	S384-E388 PolarHBondContact O-N 3.25Å; E388-L390 VanDerWaalsContact C-N 3.33Å; E388-L390 PolarHBondContact O-N 3.5Å; E388-E391 PolarHBondContact O-N 2.95Å; E388-N392 PolarHBondContact O-N 3.08Å; E388-N392 PolarHBondContact O-ND2 3.44Å
389	A	94.6	Very high	92	Very high	7 Å²	7	68.4 Å²	68.4	6%	0.058	37%	0.369	C	S	.	.	H	α-helix	trans	-62.4	-40.3	177.4	0	0	0	0	0	111.8	L370 I374 L377 A385 V386 D387 N392 V393	L370-A389 HydrophobicContact CD1-CB 3.83Å; L370-A389 WeakPolarHBondContact CD2-O 3.28Å; L370-A389 HydrophobicContact CG-CB 4.27Å; I374-A389 HydrophobicContact CD1-CB 3.76Å; I374-A389 HydrophobicContact CG1-CB 3.49Å; I374-A389 VanDerWaalsContact CG1-CB 3.49Å; L377-A389 HydrophobicContact CD1-CB 4.48Å; A385-A389 WeakPolarHBondContact O-CB 3.27Å; A385-A389 PolarHBondContact O-N 2.94Å; A385-A389 VanDerWaalsContact O-N 3.16Å; V386-A389 PolarHBondContact O-N 3.33Å; D387-A389 PolarHBondContact O-N 3.42Å; A389-N392 PolarHBondContact O-N 3.19Å; A389-V393 WeakPolarHBondContact O-CG2 3.45Å; A389-V393 PolarHBondContact O-N 2.96Å
390	L	95.9	Very high	92.7	Very high	73 Å²	73	62.6 Å²	62.6	38%	0.382	34%	0.342	S	S	.	.	H	α-helix	trans	-63.1	-43.3	175.7	-75.1	168.6	0	0	0	111.9	I374 V386 D387 E388 N392 V393 L394	I374-L390 HydrophobicContact CD1-CD2 3.95Å; I374-L390 HydrophobicContact CD1-CG 4.15Å; V386-L390 HydrophobicContact CG1-CD1 3.95Å; V386-L390 HydrophobicContact CG1-CG 4.41Å; V386-L390 WeakPolarHBondContact O-CB 3.25Å; V386-L390 VanDerWaalsContact O-CG 3.28Å; V386-L390 WeakPolarHBondContact O-CG 3.47Å; V386-L390 PolarHBondContact O-N 3.31Å; D387-L390 PolarHBondContact O-N 3.17Å; E388-L390 VanDerWaalsContact C-N 3.33Å; E388-L390 PolarHBondContact O-N 3.5Å; L390-N392 VanDerWaalsContact C-N 3.34Å; L390-N392 PolarHBondContact O-N 3.44Å; L390-V393 WeakPolarHBondContact O-CB 3.48Å; L390-V393 PolarHBondContact O-N 3.43Å; L390-L394 WeakPolarHBondContact O-CG 3.4Å; L390-L394 PolarHBondContact O-N 2.79Å
391	E	97.4	Very high	93.3	Very high	97 Å²	97	60.8 Å²	60.8	45%	0.453	33%	0.329	S	S	.	.	H	α-helix	trans	-64.3	-40.3	176.7	-172.5	56.7	-143.5	0	0	111.6	D387 E388 V393 L394 Q395 R398	D387-E391 PolarHBondContact O-N 3.34Å; E388-E391 PolarHBondContact O-N 2.95Å; E391-V393 VanDerWaalsContact C-N 3.34Å; E391-V393 PolarHBondContact O-N 3.3Å; E391-L394 WeakPolarHBondContact O-CB 3.36Å; E391-L394 PolarHBondContact O-N 3.44Å; E391-L394 VanDerWaalsContact O-N 3.13Å; E391-Q395 PolarHBondContact O-N 2.92Å; E391-R398 IonicContact OE1-NH1 2.88Å
392	N	97.7	Very high	94.3	Very high	61 Å²	61	63 Å²	63	33%	0.326	34%	0.34	S	S	.	.	H	α-helix	trans	-61.2	-40.8	174.4	-74.9	-21.5	0	0	0	112	L370 E388 A389 L390 Q395 L396	L370-N392 HydrophobicContact CD2-CB 3.57Å; E388-N392 PolarHBondContact O-N 3.08Å; E388-N392 PolarHBondContact O-ND2 3.44Å; A389-N392 PolarHBondContact O-N 3.19Å; L390-N392 VanDerWaalsContact C-N 3.34Å; L390-N392 PolarHBondContact O-N 3.44Å; N392-Q395 PolarHBondContact O-N 2.87Å; N392-L396 WeakPolarHBondContact O-CB 3.45Å; N392-L396 VanDerWaalsContact O-CG 3.29Å; N392-L396 WeakPolarHBondContact O-CG 3.29Å; N392-L396 PolarHBondContact O-N 3.46Å
393	V	98.4	Very high	95.2	Very high	3 Å²	3	61.9 Å²	61.9	2%	0.018	32%	0.322	C	S	.	.	H	α-helix	trans	-60.3	-45.9	172.2	172.6	0	0	0	0	110.9	L370 I371 I374 A389 L390 E391 Q395 L396 M397 F425	L370-V393 HydrophobicContact CB-CG2 3.94Å; L370-V393 HydrophobicContact CD2-CG2 3.69Å; L370-V393 HydrophobicContact CG-CG2 3.72Å; I371-V393 HydrophobicContact CD1-CG1 3.94Å; I371-V393 HydrophobicContact CG1-CG1 3.82Å; I371-V393 HydrophobicContact CG1-CG2 3.88Å; I374-V393 HydrophobicContact CD1-CG2 3.89Å; A389-V393 WeakPolarHBondContact O-CG2 3.45Å; A389-V393 PolarHBondContact O-N 2.96Å; L390-V393 WeakPolarHBondContact O-CB 3.48Å; L390-V393 PolarHBondContact O-N 3.43Å; E391-V393 VanDerWaalsContact C-N 3.34Å; E391-V393 PolarHBondContact O-N 3.3Å; V393-Q395 PolarHBondContact O-N 3.34Å; V393-L396 PolarHBondContact O-N 2.95Å; V393-M397 HydrophobicContact CG1-CG 4.12Å; V393-M397 VanDerWaalsContact O-CB 3.32Å; V393-M397 WeakPolarHBondContact O-CB 3.14Å; V393-M397 VanDerWaalsContact O-CG 3.24Å; V393-M397 WeakPolarHBondContact O-CG 3.36Å; V393-M397 PolarHBondContact O-N 3.32Å; V393-F425 HydrophobicContact CG1-CE2 3.88Å; V393-F425 HydrophobicContact CG1-CZ 3.67Å
394	L	98.5	Very high	95.4	Very high	28 Å²	28	59.1 Å²	59.1	15%	0.147	30%	0.304	C	S	.	.	H	α-helix	trans	-59.7	-45.9	178.4	-67.6	176	0	0	0	111.3	L390 E391 R398 F425 F426 N430	L390-L394 WeakPolarHBondContact O-CG 3.4Å; L390-L394 PolarHBondContact O-N 2.79Å; E391-L394 WeakPolarHBondContact O-CB 3.36Å; E391-L394 PolarHBondContact O-N 3.44Å; E391-L394 VanDerWaalsContact O-N 3.13Å; L394-R398 VanDerWaalsContact O-CG 3.29Å; L394-R398 WeakPolarHBondContact O-CG 3.42Å; L394-R398 PolarHBondContact O-N 3.15Å; L394-F425 HydrophobicContact CD2-CE1 3.82Å; L394-F425 HydrophobicContact CD2-CZ 4.07Å; L394-F426 HydrophobicContact CD2-CE1 4.24Å; L394-N430 HydrophobicContact CD2-CB 3.85Å
395	Q	98.3	Very high	95.1	Very high	107 Å²	107	57.6 Å²	57.6	50%	0.5	29%	0.29	S	S	.	.	H	α-helix	trans	-61.6	-50.5	178.4	-173.1	-178.4	8.3	0	0	111.3	E391 N392 V393 M397 R398 Q399	E391-Q395 PolarHBondContact O-N 2.92Å; N392-Q395 PolarHBondContact O-N 2.87Å; V393-Q395 PolarHBondContact O-N 3.34Å; Q395-M397 PolarHBondContact O-N 3.39Å; Q395-R398 PolarHBondContact O-N 3.29Å; Q395-Q399 WeakPolarHBondContact O-CG 3.04Å; Q395-Q399 PolarHBondContact O-N 3.01Å; Q395-Q399 VanDerWaalsContact O-N 3.1Å
396	L	98.6	Very high	94.1	Very high	20 Å²	20	63.7 Å²	63.7	11%	0.105	31%	0.311	C	S	.	.	H	α-helix	trans	-59.2	-48.5	178.7	-73	165	0	0	0	111.2	Y352 A363 T366 A367 N392 V393 R398 Q399 V400	Y352-L396 HydrophobicContact CD1-CD2 4.23Å; Y352-L396 HydrophobicContact CE1-CD2 3.92Å; A363-L396 HydrophobicContact CB-CD2 4.28Å; T366-L396 HydrophobicContact CG2-CD1 3.6Å; T366-L396 HydrophobicContact CG2-CD2 4.41Å; A367-L396 HydrophobicContact CB-CB 3.94Å; A367-L396 HydrophobicContact CB-CD1 4.18Å; N392-L396 WeakPolarHBondContact O-CB 3.45Å; N392-L396 VanDerWaalsContact O-CG 3.29Å; N392-L396 WeakPolarHBondContact O-CG 3.29Å; N392-L396 PolarHBondContact O-N 3.46Å; V393-L396 PolarHBondContact O-N 2.95Å; L396-R398 VanDerWaalsContact C-N 3.3Å; L396-R398 PolarHBondContact O-N 3.44Å; L396-Q399 WeakPolarHBondContact O-CB 3.28Å; L396-Q399 PolarHBondContact O-N 3.29Å; L396-V400 WeakPolarHBondContact O-CG2 3.46Å; L396-V400 PolarHBondContact O-N 2.89Å
397	M	98.5	Very high	92.6	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-60.2	-38.1	179.1	-73.2	-69.1	-165.5	0	0	112.2	Y364 A367 I371 V393 Q395 Q399 P401 S422 F425 F426 L432	Y364-M397 HydrophobicContact CD2-CE 4.23Å; Y364-M397 HydrophobicContact CD2-SD 3.99Å; Y364-M397 HydrophobicContact CE2-CE 3.91Å; Y364-M397 HydrophobicContact CE2-SD 4.1Å; A367-M397 HydrophobicContact CB-CE 4.1Å; A367-M397 HydrophobicContact CB-CG 4.35Å; A367-M397 HydrophobicContact CB-SD 4.37Å; I371-M397 HydrophobicContact CD1-CE 3.76Å; V393-M397 HydrophobicContact CG1-CG 4.12Å; V393-M397 VanDerWaalsContact O-CB 3.32Å; V393-M397 WeakPolarHBondContact O-CB 3.14Å; V393-M397 VanDerWaalsContact O-CG 3.24Å; V393-M397 WeakPolarHBondContact O-CG 3.36Å; V393-M397 PolarHBondContact O-N 3.32Å; Q395-M397 PolarHBondContact O-N 3.39Å; M397-Q399 VanDerWaalsContact C-N 3.32Å; M397-Q399 PolarHBondContact O-N 3.14Å; M397-P401 WeakPolarHBondContact O-CD 3.45Å; M397-S422 PolarHBondContact O-OG 2.98Å; M397-F425 HydrophobicContact CB-CD1 3.9Å; M397-F425 HydrophobicContact CB-CE1 4.04Å; M397-F425 HydrophobicContact CE-CB 4.2Å; M397-F425 HydrophobicContact CE-CD2 3.83Å; M397-F425 HydrophobicContact CE-CE2 4.34Å; M397-F425 HydrophobicContact CE-CG 3.98Å; M397-F425 HydrophobicContact CG-CD1 3.75Å; M397-F425 HydrophobicContact CG-CD2 4.42Å; M397-F425 HydrophobicContact CG-CE1 3.88Å; M397-F425 HydrophobicContact CG-CG 4.04Å; M397-F425 HydrophobicContact CG-CZ 4.27Å; M397-F425 HydrophobicContact SD-CB 4.27Å; M397-F425 HydrophobicContact SD-CD1 4.42Å; M397-F425 HydrophobicContact SD-CG 4.21Å; M397-F426 HydrophobicContact CB-CE2 3.79Å; M397-F426 HydrophobicContact CB-CZ 3.61Å; M397-L432 HydrophobicContact CE-CD1 3.83Å
398	R	98.4	Very high	90.7	Very high	132 Å²	132	67 Å²	67	50%	0.498	34%	0.335	S	S	.	.	H	α-helix	trans	-65.5	-32.8	173.7	-72.7	173.9	-171.6	136.9	-0	112.6	E391 L394 Q395 L396 P401 F426	E391-R398 IonicContact OE1-NH1 2.88Å; L394-R398 VanDerWaalsContact O-CG 3.29Å; L394-R398 WeakPolarHBondContact O-CG 3.42Å; L394-R398 PolarHBondContact O-N 3.15Å; Q395-R398 PolarHBondContact O-N 3.29Å; L396-R398 VanDerWaalsContact C-N 3.3Å; L396-R398 PolarHBondContact O-N 3.44Å; R398-P401 WeakPolarHBondContact O-CD 3.15Å; R398-F426 HydrophobicContact CB-CZ 4.43Å; R398-F426 HydrophobicContact CG-CE1 4.2Å; R398-F426 HydrophobicContact CG-CE2 4.29Å; R398-F426 HydrophobicContact CG-CZ 3.58Å
399	Q	97.9	Very high	88.8	Confident	65 Å²	65	63.8 Å²	63.8	30%	0.304	34%	0.338	S	S	.	.	H	α-helix	trans	-76.6	-31.2	179.9	-68.5	-63.2	-31.1	0	0	113.2	Q395 L396 M397 L402 L403	Q395-Q399 WeakPolarHBondContact O-CG 3.04Å; Q395-Q399 PolarHBondContact O-N 3.01Å; Q395-Q399 VanDerWaalsContact O-N 3.1Å; L396-Q399 WeakPolarHBondContact O-CB 3.28Å; L396-Q399 PolarHBondContact O-N 3.29Å; M397-Q399 VanDerWaalsContact C-N 3.32Å; M397-Q399 PolarHBondContact O-N 3.14Å; Q399-L402 WeakPolarHBondContact O-CA 3.09Å; Q399-L402 WeakPolarHBondContact O-CB 3.38Å; Q399-L402 PolarHBondContact O-N 3.46Å; Q399-L403 HydrophobicContact CB-CD1 3.85Å; Q399-L403 HydrophobicContact CB-CG 4.4Å; Q399-L403 WeakPolarHBondContact O-CG 3.34Å; Q399-L403 PolarHBondContact O-N 3.16Å
400	V	98	Very high	87.3	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	-48.5	-175.7	169	0	0	0	0	113.3	S360 A363 Y364 L396 L402 C418 V419	S360-V400 WeakPolarHBondContact CB-O 3.3Å; S360-V400 PolarHBondContact OG-O 3.13Å; A363-V400 HydrophobicContact CB-CG2 3.98Å; Y364-V400 HydrophobicContact CD2-CG2 4.47Å; L396-V400 WeakPolarHBondContact O-CG2 3.46Å; L396-V400 PolarHBondContact O-N 2.89Å; V400-L402 PolarHBondContact O-N 3.42Å; V400-C418 HydrophobicContact CG1-CB 3.94Å; V400-V419 HydrophobicContact CG1-CG2 4.09Å
401	P	95.6	Very high	86	Confident	45 Å²	45	67.7 Å²	67.7	29%	0.292	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-30.1	176.8	-20.1	34.3	0	0	0	114.8	M397 R398 V419	M397-P401 WeakPolarHBondContact O-CD 3.45Å; R398-P401 WeakPolarHBondContact O-CD 3.15Å; P401-V419 HydrophobicContact CB-CG1 4.09Å; P401-V419 HydrophobicContact CB-CG2 4.35Å; P401-V419 HydrophobicContact CG-CG1 4.23Å
402	L	95.5	Very high	85.1	Confident	132 Å²	132	64.2 Å²	64.2	69%	0.691	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-28.2	-178.2	-56	178.7	0	0	0	112.1	Q399 V400	Q399-L402 WeakPolarHBondContact O-CA 3.09Å; Q399-L402 WeakPolarHBondContact O-CB 3.38Å; Q399-L402 PolarHBondContact O-N 3.46Å; V400-L402 PolarHBondContact O-N 3.42Å
403	L	93.3	Very high	84.4	Confident	24 Å²	24	63.9 Å²	63.9	13%	0.126	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-2.8	-178.5	-65.9	167.1	0	0	0	113.8	Y352 R359 A363 Q399 V405	Y352-L403 HydrophobicContact CE2-CD1 3.53Å; R359-L403 HydrophobicContact CB-CB 4.24Å; R359-L403 HydrophobicContact CB-CD1 4.41Å; R359-L403 HydrophobicContact CB-CD2 4.2Å; A363-L403 HydrophobicContact CB-CD1 3.81Å; Q399-L403 HydrophobicContact CB-CD1 3.85Å; Q399-L403 HydrophobicContact CB-CG 4.4Å; Q399-L403 WeakPolarHBondContact O-CG 3.34Å; Q399-L403 PolarHBondContact O-N 3.16Å; L403-V405 PolarHBondContact O-N 3.45Å
404	K	88.3	Confident	84	Confident	75 Å²	75	64.8 Å²	64.8	33%	0.326	34%	0.344	S	S	.	.			trans	-67.3	124.9	-177.5	174.4	175.9	168.2	-176	0	110.6	S411 E415 V419	K404-S411 WeakPolarHBondContact CE-OG 3.4Å; K404-E415 HydrophobicContact CG-CB 4.39Å; K404-V419 HydrophobicContact CB-CG2 4.15Å; K404-V419 HydrophobicContact CD-CG2 3.81Å; K404-V419 HydrophobicContact CG-CG2 4.48Å
405	V	81.7	Confident	83.7	Confident	62 Å²	62	63.4 Å²	63.4	38%	0.376	34%	0.337	S	S	.	.			trans	-92.3	149.6	-179.8	-176.6	0	0	0	0	109.9	L403 L407 S411 E415	L403-V405 PolarHBondContact O-N 3.45Å; V405-L407 HydrophobicContact CG1-CD2 4.12Å; V405-L407 HydrophobicContact CG1-CG 4.35Å; V405-S411 VanDerWaalsContact O-CB 3.3Å; V405-S411 WeakPolarHBondContact O-CB 3.47Å; V405-S411 PolarHBondContact O-OG 3.06Å; V405-E415 PolarHBondContact N-OE2 3.46Å
406	K	69.5	Low	83.3	Confident	160 Å²	160	62.9 Å²	62.9	70%	0.696	33%	0.333	S	S	*	.			trans	-112.8	110.5	168.8	-68.6	-178.1	-177.7	176.4	0	108.2	K410	K406-K410 CarbonylContact C-O 3.48Å; K406-K410 WeakPolarHBondContact CA-O 3.46Å
407	L	60.3	Low	83.1	Confident	85 Å²	85	62 Å²	62	45%	0.445	33%	0.328	S	S	.	.	B	Isolated β-bridge	trans	-93.9	116	170.6	-60.4	172.1	0	0	0	107.7	V405 G409 K410 L412	V405-L407 HydrophobicContact CG1-CD2 4.12Å; V405-L407 HydrophobicContact CG1-CG 4.35Å; L407-G409 PolarHBondContact O-N 2.87Å; L407-G409 VanDerWaalsContact O-N 3.1Å; L407-K410 CarbonylContact C-O 3.46Å; L407-K410 PolarHBondContact N-O 3.21Å; L407-K410 CarbonylContact O-C 3.54Å; L407-K410 PolarHBondContact O-N 3.07Å; L407-L412 HydrophobicContact CD1-CD2 4.13Å; L407-L412 HydrophobicContact CD1-CG 4.44Å
408	S	53.7	Low	83	Confident	98 Å²	98	62 Å²	62	69%	0.685	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	38.9	-179.5	-61.2	0	0	0	0	113.9	K410	S408-K410 PolarHBondContact O-N 3.36Å
409	G	54.9	Low	82.9	Confident	66 Å²	66	56.5 Å²	56.5	68%	0.68	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	-5.6	-179.1	0	0	0	0	0	115.5	L407	L407-G409 PolarHBondContact O-N 2.87Å; L407-G409 VanDerWaalsContact O-N 3.1Å
410	K	63.4	Low	82.8	Confident	148 Å²	148	54.9 Å²	54.9	64%	0.643	31%	0.306	S	S	*	.	B	Isolated β-bridge	trans	-109.9	147.2	174.4	-65.6	-177.3	-177.5	174.1	0	110.2	K406 L407 S408	K406-K410 CarbonylContact C-O 3.48Å; K406-K410 WeakPolarHBondContact CA-O 3.46Å; L407-K410 CarbonylContact C-O 3.46Å; L407-K410 PolarHBondContact N-O 3.21Å; L407-K410 CarbonylContact O-C 3.54Å; L407-K410 PolarHBondContact O-N 3.07Å; S408-K410 PolarHBondContact O-N 3.36Å
411	S	67.3	Low	82.8	Confident	13 Å²	13	55 Å²	55	9%	0.091	31%	0.307	C	S	.	.			trans	-101.6	152.1	171.2	-59.4	0	0	0	0	110.1	K404 V405 K416	K404-S411 WeakPolarHBondContact CE-OG 3.4Å; V405-S411 VanDerWaalsContact O-CB 3.3Å; V405-S411 WeakPolarHBondContact O-CB 3.47Å; V405-S411 PolarHBondContact O-OG 3.06Å; S411-K416 WeakPolarHBondContact O-CE 3.42Å
412	L	78.7	Confident	82.9	Confident	25 Å²	25	53 Å²	53	13%	0.131	29%	0.294	C	S	.	.			trans	-50.4	134.6	174.3	-64.3	174.2	0	0	0	110	L407 V414 E415 K416	L407-L412 HydrophobicContact CD1-CD2 4.13Å; L407-L412 HydrophobicContact CD1-CG 4.44Å; L412-V414 PolarHBondContact O-N 3.4Å; L412-V414 VanDerWaalsContact O-N 3.16Å; L412-E415 HydrophobicContact CB-CB 4.29Å; L412-E415 HydrophobicContact CB-CG 4.03Å; L412-E415 HydrophobicContact CD1-CG 4.27Å; L412-E415 PolarHBondContact O-N 2.94Å; L412-E415 VanDerWaalsContact O-N 3.08Å; L412-K416 PolarHBondContact O-N 3.46Å; L412-K416 VanDerWaalsContact O-N 3.09Å
413	P	84.3	Confident	83	Confident	54 Å²	54	51 Å²	51	35%	0.351	28%	0.284	S	S	.	.	H	α-helix	trans	-53.6	-36	177.8	-28.8	35.7	0	0	0	113.2	K416 F417 L577	P413-K416 PolarHBondContact O-N 3.38Å; P413-F417 PolarHBondContact O-N 2.82Å; P413-F417 VanDerWaalsContact O-N 3.13Å; P413-L577 HydrophobicContact CB-CD2 4.05Å; P413-L577 WeakPolarHBondContact O-CD2 3.43Å
414	V	89	Confident	83	Confident	21 Å²	21	50.2 Å²	50.2	13%	0.127	28%	0.28	C	S	.	.	H	α-helix	trans	-67.1	-43	177.2	178.1	0	0	0	0	111.9	T361 L412 K416 F417 C418 W443 L577	T361-V414 HydrophobicContact CG2-CG1 3.77Å; L412-V414 PolarHBondContact O-N 3.4Å; L412-V414 VanDerWaalsContact O-N 3.16Å; V414-K416 VanDerWaalsContact C-N 3.3Å; V414-K416 PolarHBondContact O-N 3.44Å; V414-F417 WeakPolarHBondContact O-CA 3.43Å; V414-F417 WeakPolarHBondContact O-CB 3.26Å; V414-F417 PolarHBondContact O-N 3.1Å; V414-F417 VanDerWaalsContact O-N 3.1Å; V414-C418 PolarHBondContact O-N 3.02Å; V414-C418 PolarHBondContact O-SG 2.75Å; V414-W443 HydrophobicContact CG1-CH2 3.47Å; V414-W443 VanDerWaalsContact CG1-CH2 3.47Å; V414-W443 HydrophobicContact CG1-CZ2 3.58Å; V414-W443 HydrophobicContact CG2-CZ2 4.17Å; V414-L577 HydrophobicContact CG2-CD2 4.24Å
415	E	91.8	Very high	83.4	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.9	-36.4	176.3	-68.5	-168.9	163.2	0	0	111.8	S358 K404 V405 L412 F417 C418 V419	S358-E415 WeakPolarHBondContact CA-OE1 3.38Å; S358-E415 WeakPolarHBondContact CB-OE1 3.45Å; S358-E415 WeakPolarHBondContact OG-CG 3.23Å; S358-E415 PolarHBondContact OG-OE1 3.4Å; K404-E415 HydrophobicContact CG-CB 4.39Å; V405-E415 PolarHBondContact N-OE2 3.46Å; L412-E415 HydrophobicContact CB-CB 4.29Å; L412-E415 HydrophobicContact CB-CG 4.03Å; L412-E415 HydrophobicContact CD1-CG 4.27Å; L412-E415 PolarHBondContact O-N 2.94Å; L412-E415 VanDerWaalsContact O-N 3.08Å; E415-F417 VanDerWaalsContact C-N 3.26Å; E415-F417 PolarHBondContact O-N 2.91Å; E415-C418 PolarHBondContact O-N 2.76Å; E415-V419 WeakPolarHBondContact O-CB 3.31Å; E415-V419 WeakPolarHBondContact O-CG2 3.27Å; E415-V419 PolarHBondContact O-N 2.99Å
416	K	91.3	Very high	84.2	Confident	96 Å²	96	47.1 Å²	47.1	42%	0.417	26%	0.261	S	S	.	.	H	α-helix	trans	-60.2	-40.6	173	-66.6	-178.6	-175.5	176.2	0	111.4	S411 L412 P413 V414 A420	S411-K416 WeakPolarHBondContact O-CE 3.42Å; L412-K416 PolarHBondContact O-N 3.46Å; L412-K416 VanDerWaalsContact O-N 3.09Å; P413-K416 PolarHBondContact O-N 3.38Å; V414-K416 VanDerWaalsContact C-N 3.3Å; V414-K416 PolarHBondContact O-N 3.44Å; K416-A420 WeakPolarHBondContact O-CB 3.21Å; K416-A420 PolarHBondContact O-N 3.42Å
417	F	94.1	Very high	85.3	Confident	1 Å²	1	43.5 Å²	43.5	0%	0.004	26%	0.261	C	S	.	.	H	α-helix	trans	-62.2	-53	173.2	174.3	-85.5	0	0	0	110.8	Y364 P413 V414 E415 V419 A420 K421 E438 L439 F442 Y540 L576 L577	Y364-F417 HydrophobicContact CE1-CE1 4.06Å; P413-F417 PolarHBondContact O-N 2.82Å; P413-F417 VanDerWaalsContact O-N 3.13Å; V414-F417 WeakPolarHBondContact O-CA 3.43Å; V414-F417 WeakPolarHBondContact O-CB 3.26Å; V414-F417 PolarHBondContact O-N 3.1Å; V414-F417 VanDerWaalsContact O-N 3.1Å; E415-F417 VanDerWaalsContact C-N 3.26Å; E415-F417 PolarHBondContact O-N 2.91Å; F417-V419 VanDerWaalsContact C-N 3.32Å; F417-V419 PolarHBondContact O-N 3.41Å; F417-A420 WeakPolarHBondContact O-CB 3.36Å; F417-A420 PolarHBondContact O-N 3.1Å; F417-K421 HydrophobicContact CD1-CG 3.92Å; F417-K421 HydrophobicContact CD2-CG 4.37Å; F417-K421 HydrophobicContact CE1-CD 4.18Å; F417-K421 HydrophobicContact CE1-CG 3.43Å; F417-K421 VanDerWaalsContact CE1-CG 3.43Å; F417-K421 HydrophobicContact CE2-CD 3.95Å; F417-K421 HydrophobicContact CE2-CG 3.97Å; F417-K421 HydrophobicContact CG-CG 4.35Å; F417-K421 HydrophobicContact CZ-CD 3.69Å; F417-K421 HydrophobicContact CZ-CG 3.48Å; F417-K421 VanDerWaalsContact CZ-CG 3.48Å; F417-K421 WeakPolarHBondContact O-CG 3.49Å; F417-K421 PolarHBondContact O-N 2.84Å; F417-E438 HydrophobicContact CZ-CG 4.22Å; F417-E438 WeakPolarHBondContact CZ-OE1 3.26Å; F417-L439 HydrophobicContact CD1-CD2 4.04Å; F417-L439 HydrophobicContact CE1-CD2 3.35Å; F417-L439 HydrophobicContact CZ-CD2 4.15Å; F417-F442 HydrophobicContact CD2-CE2 4.22Å; F417-F442 AromaticContact CE2-CD2 4Å; F417-F442 HydrophobicContact CE2-CD2 4Å; F417-F442 AromaticContact CE2-CE2 3.34Å; F417-F442 HydrophobicContact CE2-CE2 3.34Å; F417-F442 AromaticContact CE2-CZ 3.91Å; F417-F442 HydrophobicContact CE2-CZ 3.91Å; F417-F442 AromaticContact CZ-CD2 3.93Å; F417-F442 HydrophobicContact CZ-CD2 3.93Å; F417-F442 AromaticContact CZ-CE2 3.59Å; F417-F442 HydrophobicContact CZ-CE2 3.59Å; F417-Y540 HydrophobicContact CE2-CE1 4.1Å; F417-L576 HydrophobicContact CD2-CB 4.05Å; F417-L576 HydrophobicContact CD2-CD1 4.02Å; F417-L577 HydrophobicContact CB-CD1 4.12Å; F417-L577 HydrophobicContact CB-CD2 4.17Å; F417-L577 HydrophobicContact CB-CG 4.02Å; F417-L577 HydrophobicContact CD2-CD1 3.78Å; F417-L577 HydrophobicContact CD2-CG 4.17Å; F417-L577 HydrophobicContact CE2-CD1 4.38Å; F417-L577 HydrophobicContact CG-CD1 3.9Å; F417-L577 HydrophobicContact CG-CG 4.28Å
418	C	96.9	Very high	86.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-56.2	-43.9	-179.5	-61.1	0	0	0	0	112.4	Y364 V400 V414 E415 K421 S422	Y364-C418 HydrophobicContact CD1-CB 3.92Å; Y364-C418 VanDerWaalsContact CD1-SG 3.5Å; Y364-C418 HydrophobicContact CG-CB 3.81Å; V400-C418 HydrophobicContact CG1-CB 3.94Å; V414-C418 PolarHBondContact O-N 3.02Å; V414-C418 PolarHBondContact O-SG 2.75Å; E415-C418 PolarHBondContact O-N 2.76Å; C418-K421 PolarHBondContact O-N 2.97Å; C418-S422 WeakPolarHBondContact O-CB 3.41Å; C418-S422 PolarHBondContact O-N 3.34Å
419	V	96.4	Very high	88.6	Confident	16 Å²	16	44 Å²	44	10%	0.097	26%	0.255	C	S	.	.	H	α-helix	trans	-64.6	-43.4	175.9	171.7	0	0	0	0	112.1	V400 P401 K404 E415 F417 K421 S422 N423	V400-V419 HydrophobicContact CG1-CG2 4.09Å; P401-V419 HydrophobicContact CB-CG1 4.09Å; P401-V419 HydrophobicContact CB-CG2 4.35Å; P401-V419 HydrophobicContact CG-CG1 4.23Å; K404-V419 HydrophobicContact CB-CG2 4.15Å; K404-V419 HydrophobicContact CD-CG2 3.81Å; K404-V419 HydrophobicContact CG-CG2 4.48Å; E415-V419 WeakPolarHBondContact O-CB 3.31Å; E415-V419 WeakPolarHBondContact O-CG2 3.27Å; E415-V419 PolarHBondContact O-N 2.99Å; F417-V419 VanDerWaalsContact C-N 3.32Å; F417-V419 PolarHBondContact O-N 3.41Å; V419-K421 VanDerWaalsContact C-N 3.3Å; V419-K421 PolarHBondContact O-N 3.5Å; V419-S422 PolarHBondContact O-N 2.91Å; V419-N423 PolarHBondContact O-N 3.43Å; V419-N423 PolarHBondContact O-ND2 3.18Å
420	A	95.5	Very high	90.5	Very high	31 Å²	31	44.8 Å²	44.8	26%	0.256	24%	0.244	S	C	.	.	H	α-helix	trans	-62.2	-40.1	176.6	0	0	0	0	0	111.6	K416 F417 N423 Q424 L576	K416-A420 WeakPolarHBondContact O-CB 3.21Å; K416-A420 PolarHBondContact O-N 3.42Å; F417-A420 WeakPolarHBondContact O-CB 3.36Å; F417-A420 PolarHBondContact O-N 3.1Å; A420-N423 PolarHBondContact O-N 2.94Å; A420-Q424 WeakPolarHBondContact O-CB 3.36Å; A420-Q424 PolarHBondContact O-N 3.15Å; A420-L576 HydrophobicContact CB-CD1 3.56Å; A420-L576 HydrophobicContact CB-CD2 4.16Å; A420-L576 HydrophobicContact CB-CG 4.49Å
421	K	97.2	Very high	91.9	Very high	4 Å²	4	39.5 Å²	39.5	2%	0.017	23%	0.226	C	C	.	.	H	α-helix	trans	-68.9	-38.8	176.1	-63.6	-57.4	-62.6	-164.4	0	113	Y364 F417 C418 V419 Q424 F425 L432 E438	Y364-K421 HydrophobicContact CE1-CB 4.39Å; Y364-K421 HydrophobicContact CE2-CB 3.62Å; Y364-K421 VanDerWaalsContact OH-CB 3.26Å; Y364-K421 WeakPolarHBondContact OH-CB 3.43Å; Y364-K421 WeakPolarHBondContact OH-CG 3.41Å; F417-K421 HydrophobicContact CD1-CG 3.92Å; F417-K421 HydrophobicContact CD2-CG 4.37Å; F417-K421 HydrophobicContact CE1-CD 4.18Å; F417-K421 HydrophobicContact CE1-CG 3.43Å; F417-K421 VanDerWaalsContact CE1-CG 3.43Å; F417-K421 HydrophobicContact CE2-CD 3.95Å; F417-K421 HydrophobicContact CE2-CG 3.97Å; F417-K421 HydrophobicContact CG-CG 4.35Å; F417-K421 HydrophobicContact CZ-CD 3.69Å; F417-K421 HydrophobicContact CZ-CG 3.48Å; F417-K421 VanDerWaalsContact CZ-CG 3.48Å; F417-K421 WeakPolarHBondContact O-CG 3.49Å; F417-K421 PolarHBondContact O-N 2.84Å; C418-K421 PolarHBondContact O-N 2.97Å; V419-K421 VanDerWaalsContact C-N 3.3Å; V419-K421 PolarHBondContact O-N 3.5Å; K421-Q424 VanDerWaalsContact CE-OE1 3.3Å; K421-Q424 WeakPolarHBondContact O-CB 3.43Å; K421-Q424 PolarHBondContact O-N 2.89Å; K421-F425 WeakPolarHBondContact O-CB 3.3Å; K421-F425 PolarHBondContact O-N 3.42Å; K421-L432 HydrophobicContact CB-CD1 4.27Å; K421-E438 WeakPolarHBondContact CE-OE1 3.42Å; K421-E438 VanDerWaalsContact CE-OE2 3.25Å; K421-E438 WeakPolarHBondContact CE-OE2 3.44Å; K421-E438 IonicContact NZ-OE1 3.06Å; K421-E438 PolarHBondContact NZ-OE1 2.7Å; K421-E438 IonicContact NZ-OE2 2.99Å; K421-E438 PolarHBondContact NZ-OE2 3.2Å
422	S	97.9	Very high	93.2	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.007	22%	0.224	C	C	.	.	H	α-helix	trans	-61	-44.9	171.9	159.1	0	0	0	0	111.3	M397 C418 V419 Q424 F425 F426	M397-S422 PolarHBondContact O-OG 2.98Å; C418-S422 WeakPolarHBondContact O-CB 3.41Å; C418-S422 PolarHBondContact O-N 3.34Å; V419-S422 PolarHBondContact O-N 2.91Å; S422-Q424 VanDerWaalsContact C-N 3.33Å; S422-Q424 PolarHBondContact O-N 3.48Å; S422-F425 WeakPolarHBondContact O-CB 3.2Å; S422-F425 PolarHBondContact O-N 3.22Å; S422-F426 WeakPolarHBondContact O-CD2 3.39Å; S422-F426 PolarHBondContact O-N 3.4Å
423	N	96.8	Very high	93.9	Very high	91 Å²	91	38.6 Å²	38.6	49%	0.487	22%	0.219	S	C	.	.	H	α-helix	trans	-63.1	-40.4	174.7	-68.4	-23.4	0	0	0	111.9	V419 A420 F425 F426 A427	V419-N423 PolarHBondContact O-N 3.43Å; V419-N423 PolarHBondContact O-ND2 3.18Å; A420-N423 PolarHBondContact O-N 2.94Å; N423-F425 VanDerWaalsContact C-N 3.33Å; N423-F425 PolarHBondContact O-N 2.99Å; N423-F426 PolarHBondContact O-N 3.31Å; N423-A427 WeakPolarHBondContact O-CB 3.47Å; N423-A427 PolarHBondContact O-N 2.89Å
424	Q	95.1	Very high	94.5	Very high	8 Å²	8	36.8 Å²	36.8	4%	0.037	21%	0.207	C	C	.	.	H	α-helix	trans	-60.7	-42	174.9	-179.6	-179	5.7	0	0	111.6	A420 K421 S422 F426 A427 Q428 L432 V537 N538	A420-Q424 WeakPolarHBondContact O-CB 3.36Å; A420-Q424 PolarHBondContact O-N 3.15Å; K421-Q424 VanDerWaalsContact CE-OE1 3.3Å; K421-Q424 WeakPolarHBondContact O-CB 3.43Å; K421-Q424 PolarHBondContact O-N 2.89Å; S422-Q424 VanDerWaalsContact C-N 3.33Å; S422-Q424 PolarHBondContact O-N 3.48Å; Q424-F426 PolarHBondContact O-N 3.16Å; Q424-A427 PolarHBondContact O-N 2.93Å; Q424-Q428 HydrophobicContact CG-CG 4.12Å; Q424-Q428 WeakPolarHBondContact O-CB 3.39Å; Q424-Q428 WeakPolarHBondContact O-CG 3.37Å; Q424-Q428 PolarHBondContact O-N 3.41Å; Q424-L432 HydrophobicContact CB-CD2 4.1Å; Q424-L432 HydrophobicContact CG-CD2 3.76Å; Q424-V537 HydrophobicContact CB-CG1 4.34Å; Q424-V537 HydrophobicContact CG-CG1 4.13Å; Q424-N538 PolarHBondContact OE1-OD1 3.46Å
425	F	96.6	Very high	94.9	Very high	6 Å²	6	35.9 Å²	35.9	3%	0.026	20%	0.201	C	C	.	.	H	α-helix	trans	-54.6	-49.7	177.6	171.5	-93.9	0	0	0	111.3	I371 V393 L394 M397 K421 S422 N423 Q428 N430 S431 L432	I371-F425 HydrophobicContact CD1-CE2 4.33Å; V393-F425 HydrophobicContact CG1-CE2 3.88Å; V393-F425 HydrophobicContact CG1-CZ 3.67Å; L394-F425 HydrophobicContact CD2-CE1 3.82Å; L394-F425 HydrophobicContact CD2-CZ 4.07Å; M397-F425 HydrophobicContact CB-CD1 3.9Å; M397-F425 HydrophobicContact CB-CE1 4.04Å; M397-F425 HydrophobicContact CE-CB 4.2Å; M397-F425 HydrophobicContact CE-CD2 3.83Å; M397-F425 HydrophobicContact CE-CE2 4.34Å; M397-F425 HydrophobicContact CE-CG 3.98Å; M397-F425 HydrophobicContact CG-CD1 3.75Å; M397-F425 HydrophobicContact CG-CD2 4.42Å; M397-F425 HydrophobicContact CG-CE1 3.88Å; M397-F425 HydrophobicContact CG-CG 4.04Å; M397-F425 HydrophobicContact CG-CZ 4.27Å; M397-F425 HydrophobicContact SD-CB 4.27Å; M397-F425 HydrophobicContact SD-CD1 4.42Å; M397-F425 HydrophobicContact SD-CG 4.21Å; K421-F425 WeakPolarHBondContact O-CB 3.3Å; K421-F425 PolarHBondContact O-N 3.42Å; S422-F425 WeakPolarHBondContact O-CB 3.2Å; S422-F425 PolarHBondContact O-N 3.22Å; N423-F425 VanDerWaalsContact C-N 3.33Å; N423-F425 PolarHBondContact O-N 2.99Å; F425-Q428 CarbonylContact O-C 3.42Å; F425-Q428 PolarHBondContact O-N 3.35Å; F425-N430 HydrophobicContact CE1-CB 3.76Å; F425-N430 HydrophobicContact CE2-CB 4.39Å; F425-N430 WeakPolarHBondContact CE2-O 3.22Å; F425-N430 VanDerWaalsContact CZ-CA 3.48Å; F425-N430 HydrophobicContact CZ-CB 3.67Å; F425-N430 VanDerWaalsContact CZ-O 3.27Å; F425-N430 WeakPolarHBondContact CZ-O 3.42Å; F425-N430 VanDerWaalsContact O-CA 3.23Å; F425-N430 WeakPolarHBondContact O-CA 3.38Å; F425-N430 PolarHBondContact O-N 3.37Å; F425-S431 PolarHBondContact O-N 2.82Å; F425-S431 VanDerWaalsContact O-N 3.09Å; F425-L432 HydrophobicContact CB-CD1 4.02Å; F425-L432 HydrophobicContact CB-CD2 4.2Å; F425-L432 HydrophobicContact CB-CG 3.76Å; F425-L432 HydrophobicContact CD2-CD1 4.48Å; F425-L432 HydrophobicContact CD2-CG 4.01Å; F425-L432 HydrophobicContact CG-CG 4.38Å
426	F	97	Very high	95.2	Very high	66 Å²	66	35.9 Å²	35.9	29%	0.289	20%	0.201	S	C	.	.	H	α-helix	trans	-67.9	-40.1	177.2	-66.7	-66.6	0	0	0	112.5	L394 M397 R398 S422 N423 Q424 Q428 N429 N430	L394-F426 HydrophobicContact CD2-CE1 4.24Å; M397-F426 HydrophobicContact CB-CE2 3.79Å; M397-F426 HydrophobicContact CB-CZ 3.61Å; R398-F426 HydrophobicContact CB-CZ 4.43Å; R398-F426 HydrophobicContact CG-CE1 4.2Å; R398-F426 HydrophobicContact CG-CE2 4.29Å; R398-F426 HydrophobicContact CG-CZ 3.58Å; S422-F426 WeakPolarHBondContact O-CD2 3.39Å; S422-F426 PolarHBondContact O-N 3.4Å; N423-F426 PolarHBondContact O-N 3.31Å; Q424-F426 PolarHBondContact O-N 3.16Å; F426-Q428 PolarHBondContact O-N 2.97Å; F426-N429 PolarHBondContact O-N 2.67Å; F426-N430 VanDerWaalsContact CD1-OD1 3.28Å; F426-N430 WeakPolarHBondContact CD1-OD1 3.27Å
427	A	92.7	Very high	95.6	Very high	84 Å²	84	31.5 Å²	31.5	69%	0.694	18%	0.182	S	C	*	.	H	α-helix	trans	-65.6	-21.7	177.3	0	0	0	0	0	113.5	N423 Q424	N423-A427 WeakPolarHBondContact O-CB 3.47Å; N423-A427 PolarHBondContact O-N 2.89Å; Q424-A427 PolarHBondContact O-N 2.93Å
428	Q	91.2	Very high	95.7	Very high	45 Å²	45	31.5 Å²	31.5	21%	0.21	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	30.5	177.4	-66.4	-171.7	-12.5	0	0	112.5	Q424 F425 F426 S431	Q424-Q428 HydrophobicContact CG-CG 4.12Å; Q424-Q428 WeakPolarHBondContact O-CB 3.39Å; Q424-Q428 WeakPolarHBondContact O-CG 3.37Å; Q424-Q428 PolarHBondContact O-N 3.41Å; F425-Q428 CarbonylContact O-C 3.42Å; F425-Q428 PolarHBondContact O-N 3.35Å; F426-Q428 PolarHBondContact O-N 2.97Å; Q428-S431 WeakPolarHBondContact CB-O 3.44Å; Q428-S431 PolarHBondContact OE1-O 3.06Å
429	N	92.2	Very high	95.7	Very high	149 Å²	149	31.6 Å²	31.6	80%	0.797	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.9	55.7	179.7	-60.5	-30.7	0	0	0	112.9	F426 S431	F426-N429 PolarHBondContact O-N 2.67Å; N429-S431 PolarHBondContact O-N 3.14Å
430	N	94.5	Very high	95.7	Very high	82 Å²	82	30.8 Å²	30.8	44%	0.439	18%	0.178	S	C	.	.	S	Bend	trans	57.9	44.9	177.8	-53.5	-28.4	0	0	0	112.8	L394 F425 F426	L394-N430 HydrophobicContact CD2-CB 3.85Å; F425-N430 HydrophobicContact CE1-CB 3.76Å; F425-N430 HydrophobicContact CE2-CB 4.39Å; F425-N430 WeakPolarHBondContact CE2-O 3.22Å; F425-N430 VanDerWaalsContact CZ-CA 3.48Å; F425-N430 HydrophobicContact CZ-CB 3.67Å; F425-N430 VanDerWaalsContact CZ-O 3.27Å; F425-N430 WeakPolarHBondContact CZ-O 3.42Å; F425-N430 VanDerWaalsContact O-CA 3.23Å; F425-N430 WeakPolarHBondContact O-CA 3.38Å; F425-N430 PolarHBondContact O-N 3.37Å; F426-N430 VanDerWaalsContact CD1-OD1 3.28Å; F426-N430 WeakPolarHBondContact CD1-OD1 3.27Å
431	S	92.8	Very high	95.7	Very high	37 Å²	37	29.8 Å²	29.8	26%	0.259	17%	0.167	S	C	.	.			trans	-148.4	137.7	-176.3	-163.1	0	0	0	0	113	F425 Q428 N429 R470	F425-S431 PolarHBondContact O-N 2.82Å; F425-S431 VanDerWaalsContact O-N 3.09Å; Q428-S431 WeakPolarHBondContact CB-O 3.44Å; Q428-S431 PolarHBondContact OE1-O 3.06Å; N429-S431 PolarHBondContact O-N 3.14Å; S431-R470 PolarHBondContact OG-NH1 2.94Å
432	L	94.8	Very high	95.4	Very high	10 Å²	10	30.3 Å²	30.3	5%	0.052	17%	0.17	C	C	.	.			trans	-127.2	144.9	167.7	-73	177.4	0	0	0	109.4	Y364 M397 K421 Q424 F425 P435	Y364-L432 HydrophobicContact CE2-CD1 4.15Å; M397-L432 HydrophobicContact CE-CD1 3.83Å; K421-L432 HydrophobicContact CB-CD1 4.27Å; Q424-L432 HydrophobicContact CB-CD2 4.1Å; Q424-L432 HydrophobicContact CG-CD2 3.76Å; F425-L432 HydrophobicContact CB-CD1 4.02Å; F425-L432 HydrophobicContact CB-CD2 4.2Å; F425-L432 HydrophobicContact CB-CG 3.76Å; F425-L432 HydrophobicContact CD2-CD1 4.48Å; F425-L432 HydrophobicContact CD2-CG 4.01Å; F425-L432 HydrophobicContact CG-CG 4.38Å; L432-P435 HydrophobicContact CB-CB 4.14Å; L432-P435 HydrophobicContact CB-CG 4.12Å; L432-P435 HydrophobicContact CD1-CB 4.11Å
433	F	94.9	Very high	95	Very high	9 Å²	9	32.4 Å²	32.4	4%	0.039	18%	0.177	C	C	.	.	S	Bend	trans	-85.5	117.4	175.2	179.7	-122.3	0	0	0	110.4	Q466 Y467 R470 M478 D482 L485	F433-Q466 HydrophobicContact CE2-CB 4.33Å; F433-Y467 HydrophobicContact CE1-CD2 4.38Å; F433-Y467 AromaticContact CZ-CD2 3.85Å; F433-Y467 HydrophobicContact CZ-CD2 3.85Å; F433-Y467 HydrophobicContact CZ-CG 4.4Å; F433-R470 HydrophobicContact CD2-CB 4.01Å; F433-R470 HydrophobicContact CD2-CG 3.92Å; F433-R470 HydrophobicContact CE2-CB 4.1Å; F433-R470 HydrophobicContact CE2-CG 4.41Å; F433-R470 HydrophobicContact CG-CG 4.5Å; F433-M478 HydrophobicContact CD1-CE 4.01Å; F433-M478 HydrophobicContact CD2-CE 4.21Å; F433-M478 HydrophobicContact CE1-CE 3.93Å; F433-M478 HydrophobicContact CE2-CE 4.13Å; F433-M478 HydrophobicContact CG-CE 4.17Å; F433-M478 HydrophobicContact CZ-CE 4Å; F433-D482 HydrophobicContact CB-CB 4.1Å; F433-D482 HydrophobicContact CD1-CB 3.68Å; F433-D482 WeakPolarHBondContact CD1-O 3.3Å; F433-D482 HydrophobicContact CE1-CB 4.43Å; F433-D482 VanDerWaalsContact CE1-O 3.25Å; F433-D482 WeakPolarHBondContact CE1-O 3.23Å; F433-D482 HydrophobicContact CG-CB 4.04Å; F433-L485 HydrophobicContact CD1-CD2 4.17Å
434	I	96.4	Very high	94.7	Very high	16 Å²	16	29.2 Å²	29.2	8%	0.082	16%	0.16	C	C	.	.	S	Bend	trans	41.9	50.9	174.5	57.9	177.7	0	0	0	116	L436 Y437 E438 I463 Q466 L485 L489	I434-L436 VanDerWaalsContact C-N 3.31Å; I434-L436 PolarHBondContact O-N 3.04Å; I434-Y437 HydrophobicContact CB-CD2 4.09Å; I434-Y437 HydrophobicContact CG2-CD2 4.26Å; I434-Y437 PolarHBondContact O-N 3.02Å; I434-E438 PolarHBondContact O-N 2.96Å; I434-I463 HydrophobicContact CD1-CG1 4.5Å; I434-I463 HydrophobicContact CD1-CG2 4.17Å; I434-Q466 HydrophobicContact CG2-CB 3.65Å; I434-Q466 HydrophobicContact CG2-CG 3.98Å; I434-L485 HydrophobicContact CG1-CD2 4.26Å; I434-L489 HydrophobicContact CD1-CD1 3.53Å; I434-L489 HydrophobicContact CG1-CD1 4.15Å
435	P	97.6	Very high	94.7	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.006	16%	0.16	C	C	.	.	H	α-helix	trans	-65.3	-29.9	-169.7	29.2	-37.4	0	0	0	113.8	C368 I371 L432 E438 L439	C368-P435 HydrophobicContact CB-CG 4.4Å; I371-P435 HydrophobicContact CD1-CG 4.05Å; I371-P435 HydrophobicContact CG2-CG 4.18Å; L432-P435 HydrophobicContact CB-CB 4.14Å; L432-P435 HydrophobicContact CB-CG 4.12Å; L432-P435 HydrophobicContact CD1-CB 4.11Å; P435-E438 WeakPolarHBondContact O-CB 3.44Å; P435-E438 PolarHBondContact O-N 3.47Å; P435-L439 WeakPolarHBondContact O-CG 3.16Å; P435-L439 PolarHBondContact O-N 2.88Å
436	L	98	Very high	94.6	Very high	1 Å²	1	29 Å²	29	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-67.3	-46.2	177.7	-175.5	54.5	0	0	0	111.8	W341 L365 C368 I434 E438 L439 L440	W341-L436 HydrophobicContact CE3-CD2 3.63Å; W341-L436 HydrophobicContact CH2-CD2 4.41Å; W341-L436 HydrophobicContact CZ3-CD2 3.4Å; W341-L436 VanDerWaalsContact CZ3-CD2 3.4Å; W341-L436 HydrophobicContact CZ3-CG 4.47Å; L365-L436 HydrophobicContact CD1-CD1 3.98Å; C368-L436 HydrophobicContact CB-CB 4.05Å; C368-L436 HydrophobicContact CB-CD1 4.29Å; I434-L436 VanDerWaalsContact C-N 3.31Å; I434-L436 PolarHBondContact O-N 3.04Å; L436-E438 VanDerWaalsContact C-N 3.28Å; L436-E438 PolarHBondContact O-N 3.03Å; L436-L439 WeakPolarHBondContact O-CA 3.36Å; L436-L439 WeakPolarHBondContact O-CB 3.44Å; L436-L439 PolarHBondContact O-N 3.01Å; L436-L440 WeakPolarHBondContact O-CG 3.4Å; L436-L440 PolarHBondContact O-N 3.17Å
437	Y	98.3	Very high	94.4	Very high	4 Å²	4	27.8 Å²	27.8	2%	0.016	16%	0.158	C	C	.	.	H	α-helix	trans	-64.5	-33.8	176.4	-65.4	-50.3	0	0	0	112.6	R339 W341 I434 L439 L440 Y441 I459 D462 I463	R339-Y437 WeakPolarHBondContact CD-OH 3.43Å; W341-Y437 AromaticContact CH2-CE1 3.92Å; W341-Y437 HydrophobicContact CH2-CE1 3.92Å; W341-Y437 AromaticContact CH2-CZ 3.71Å; W341-Y437 VanDerWaalsContact CH2-OH 3.3Å; W341-Y437 WeakPolarHBondContact CH2-OH 3.3Å; W341-Y437 WeakPolarHBondContact CZ2-OH 3.33Å; I434-Y437 HydrophobicContact CB-CD2 4.09Å; I434-Y437 HydrophobicContact CG2-CD2 4.26Å; I434-Y437 PolarHBondContact O-N 3.02Å; Y437-L439 VanDerWaalsContact C-N 3.33Å; Y437-L440 HydrophobicContact CD1-CD1 4.01Å; Y437-L440 PolarHBondContact O-N 3.01Å; Y437-Y441 PolarHBondContact O-N 2.99Å; Y437-Y441 VanDerWaalsContact O-N 3.1Å; Y437-I459 HydrophobicContact CD1-CG2 3.92Å; Y437-I459 HydrophobicContact CE1-CB 4.22Å; Y437-I459 HydrophobicContact CE1-CD1 4.24Å; Y437-I459 HydrophobicContact CE1-CG1 3.86Å; Y437-I459 HydrophobicContact CE1-CG2 3.55Å; Y437-D462 HydrophobicContact CE2-CB 4.3Å; Y437-D462 VanDerWaalsContact CE2-OD2 3.22Å; Y437-D462 WeakPolarHBondContact CE2-OD2 3.4Å; Y437-D462 WeakPolarHBondContact OH-CB 3.44Å; Y437-D462 PolarHBondContact OH-OD2 3.38Å; Y437-I463 HydrophobicContact CD2-CD1 4.14Å; Y437-I463 HydrophobicContact CD2-CG1 3.54Å; Y437-I463 HydrophobicContact CE2-CG1 3.76Å; Y437-I463 HydrophobicContact CG-CD1 4.21Å; Y437-I463 HydrophobicContact CG-CG1 4.12Å
438	E	97.7	Very high	94.4	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-59.5	-43.3	170.3	-177.3	-175.8	178.7	0	0	111.3	F417 K421 I434 P435 L436 Y441 F442 L485 Y540	F417-E438 HydrophobicContact CZ-CG 4.22Å; F417-E438 WeakPolarHBondContact CZ-OE1 3.26Å; K421-E438 WeakPolarHBondContact CE-OE1 3.42Å; K421-E438 VanDerWaalsContact CE-OE2 3.25Å; K421-E438 WeakPolarHBondContact CE-OE2 3.44Å; K421-E438 IonicContact NZ-OE1 3.06Å; K421-E438 PolarHBondContact NZ-OE1 2.7Å; K421-E438 IonicContact NZ-OE2 2.99Å; K421-E438 PolarHBondContact NZ-OE2 3.2Å; I434-E438 PolarHBondContact O-N 2.96Å; P435-E438 WeakPolarHBondContact O-CB 3.44Å; P435-E438 PolarHBondContact O-N 3.47Å; L436-E438 VanDerWaalsContact C-N 3.28Å; L436-E438 PolarHBondContact O-N 3.03Å; E438-Y441 WeakPolarHBondContact O-CB 3.41Å; E438-Y441 PolarHBondContact O-N 2.81Å; E438-F442 HydrophobicContact CG-CD2 4.26Å; E438-F442 HydrophobicContact CG-CE2 3.85Å; E438-F442 WeakPolarHBondContact O-CD2 3.43Å; E438-F442 PolarHBondContact O-N 3.49Å; E438-L485 HydrophobicContact CB-CD1 4.16Å; E438-L485 HydrophobicContact CB-CD2 4.27Å; E438-L485 HydrophobicContact CG-CD1 3.97Å; E438-L485 HydrophobicContact CG-CD2 4.32Å; E438-Y540 VanDerWaalsContact OE1-CZ 3.25Å; E438-Y540 PolarHBondContact OE1-OH 3.08Å
439	L	95.9	Very high	94.7	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-63.5	-46.6	173.8	-70.4	-171.7	0	0	0	112.3	Y364 L365 C368 F417 P435 L436 Y437 Y441 F442 W443	Y364-L439 HydrophobicContact CD1-CD1 3.88Å; Y364-L439 HydrophobicContact CD1-CD2 4.39Å; Y364-L439 HydrophobicContact CE1-CD1 3.73Å; Y364-L439 HydrophobicContact CE1-CD2 3.78Å; Y364-L439 HydrophobicContact CE1-CG 3.98Å; L365-L439 HydrophobicContact CD1-CD1 3.96Å; C368-L439 HydrophobicContact CB-CD1 4.49Å; F417-L439 HydrophobicContact CD1-CD2 4.04Å; F417-L439 HydrophobicContact CE1-CD2 3.35Å; F417-L439 HydrophobicContact CZ-CD2 4.15Å; P435-L439 WeakPolarHBondContact O-CG 3.16Å; P435-L439 PolarHBondContact O-N 2.88Å; L436-L439 WeakPolarHBondContact O-CA 3.36Å; L436-L439 WeakPolarHBondContact O-CB 3.44Å; L436-L439 PolarHBondContact O-N 3.01Å; Y437-L439 VanDerWaalsContact C-N 3.33Å; L439-Y441 PolarHBondContact O-N 2.9Å; L439-Y441 VanDerWaalsContact O-N 3.12Å; L439-F442 PolarHBondContact O-N 3.23Å; L439-W443 HydrophobicContact CB-CE3 3.9Å; L439-W443 HydrophobicContact CB-CZ3 3.75Å; L439-W443 HydrophobicContact CD1-CZ3 4Å; L439-W443 HydrophobicContact CD2-CE3 4.33Å; L439-W443 HydrophobicContact CD2-CH2 4.36Å; L439-W443 HydrophobicContact CD2-CZ3 3.51Å; L439-W443 HydrophobicContact CG-CZ3 3.91Å; L439-W443 VanDerWaalsContact O-CE3 3.27Å; L439-W443 PolarHBondContact O-N 3.38Å
440	L	96.2	Very high	94.8	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-55.4	-33.5	178.2	-62.1	-169.9	0	0	0	112.1	F333 F337 L436 Y437 N444 C445 Y446 I449	F333-L440 HydrophobicContact CD1-CD2 3.54Å; F333-L440 HydrophobicContact CE1-CD2 3.92Å; F337-L440 HydrophobicContact CD1-CD1 4.1Å; F337-L440 HydrophobicContact CE1-CD1 4.1Å; F337-L440 HydrophobicContact CE1-CD2 4.07Å; L436-L440 WeakPolarHBondContact O-CG 3.4Å; L436-L440 PolarHBondContact O-N 3.17Å; Y437-L440 HydrophobicContact CD1-CD1 4.01Å; Y437-L440 PolarHBondContact O-N 3.01Å; L440-N444 PolarHBondContact O-N 2.93Å; L440-C445 HydrophobicContact CB-CB 4.03Å; L440-C445 HydrophobicContact CD2-CB 4.39Å; L440-C445 VanDerWaalsContact O-CB 3.26Å; L440-C445 WeakPolarHBondContact O-CB 3.49Å; L440-C445 PolarHBondContact O-N 3.35Å; L440-Y446 HydrophobicContact CB-CE2 4.24Å; L440-I449 HydrophobicContact CD1-CD1 4.08Å
441	Y	95.4	Very high	94.9	Very high	9 Å²	9	19.4 Å²	19.4	4%	0.035	9%	0.094	C	C	.	.	H	α-helix	trans	-63.5	-49.5	172.1	176	-101.4	0	0	0	112.7	Y437 E438 L439 W443 N444 Y446 L488 L489 M492 N544 E548 R584	Y437-Y441 PolarHBondContact O-N 2.99Å; Y437-Y441 VanDerWaalsContact O-N 3.1Å; E438-Y441 WeakPolarHBondContact O-CB 3.41Å; E438-Y441 PolarHBondContact O-N 2.81Å; L439-Y441 PolarHBondContact O-N 2.9Å; L439-Y441 VanDerWaalsContact O-N 3.12Å; Y441-W443 VanDerWaalsContact C-N 3.28Å; Y441-W443 PolarHBondContact O-N 2.94Å; Y441-N444 PolarHBondContact O-N 3.23Å; Y441-Y446 HydrophobicContact CD2-CD2 4.46Å; Y441-L488 HydrophobicContact CD1-CD2 4.29Å; Y441-L488 HydrophobicContact CE1-CD2 4.01Å; Y441-L488 HydrophobicContact CE2-CD1 4.37Å; Y441-L489 HydrophobicContact CG-CD2 4.23Å; Y441-M492 HydrophobicContact CD2-CG 3.88Å; Y441-M492 HydrophobicContact CD2-SD 4.41Å; Y441-M492 HydrophobicContact CE2-CE 4.25Å; Y441-M492 HydrophobicContact CE2-CG 3.97Å; Y441-M492 HydrophobicContact CE2-SD 3.93Å; Y441-N544 HydrophobicContact CE1-CB 4.02Å; Y441-N544 WeakPolarHBondContact CE1-OD1 3.39Å; Y441-N544 WeakPolarHBondContact OH-CB 3.17Å; Y441-N544 PolarHBondContact OH-OD1 3.3Å; Y441-N544 VanDerWaalsContact OH-OD1 3.12Å; Y441-E548 HydrophobicContact CE2-CG 4.25Å; Y441-E548 WeakPolarHBondContact CE2-OE1 3.49Å; Y441-E548 PolarHBondContact OH-OE1 3.3Å; Y441-R584 PolarHBondContact OH-NH1 2.89Å
442	F	91.8	Very high	95.1	Very high	16 Å²	16	19.3 Å²	19.3	7%	0.07	9%	0.091	C	C	.	.	H	α-helix	trans	-68.5	-24.8	-178.2	-73.6	-62	0	0	0	114.6	F417 E438 L439 N444 Y540 L577	F417-F442 HydrophobicContact CD2-CE2 4.22Å; F417-F442 AromaticContact CE2-CD2 4Å; F417-F442 HydrophobicContact CE2-CD2 4Å; F417-F442 AromaticContact CE2-CE2 3.34Å; F417-F442 HydrophobicContact CE2-CE2 3.34Å; F417-F442 AromaticContact CE2-CZ 3.91Å; F417-F442 HydrophobicContact CE2-CZ 3.91Å; F417-F442 AromaticContact CZ-CD2 3.93Å; F417-F442 HydrophobicContact CZ-CD2 3.93Å; F417-F442 AromaticContact CZ-CE2 3.59Å; F417-F442 HydrophobicContact CZ-CE2 3.59Å; E438-F442 HydrophobicContact CG-CD2 4.26Å; E438-F442 HydrophobicContact CG-CE2 3.85Å; E438-F442 WeakPolarHBondContact O-CD2 3.43Å; E438-F442 PolarHBondContact O-N 3.49Å; L439-F442 PolarHBondContact O-N 3.23Å; F442-N444 VanDerWaalsContact C-N 3.26Å; F442-Y540 HydrophobicContact CE1-CD2 4.11Å; F442-Y540 HydrophobicContact CE1-CG 4.47Å; F442-Y540 HydrophobicContact CE2-CD2 4.37Å; F442-Y540 HydrophobicContact CE2-CE2 4.03Å; F442-Y540 HydrophobicContact CZ-CD1 4.26Å; F442-Y540 AromaticContact CZ-CD2 3.4Å; F442-Y540 HydrophobicContact CZ-CD2 3.4Å; F442-Y540 VanDerWaalsContact CZ-CD2 3.4Å; F442-Y540 HydrophobicContact CZ-CE1 4.33Å; F442-Y540 AromaticContact CZ-CE2 3.49Å; F442-Y540 HydrophobicContact CZ-CE2 3.49Å; F442-Y540 VanDerWaalsContact CZ-CE2 3.49Å; F442-Y540 AromaticContact CZ-CG 3.84Å; F442-Y540 HydrophobicContact CZ-CG 3.84Å; F442-Y540 AromaticContact CZ-CZ 3.99Å; F442-L577 HydrophobicContact CB-CD1 3.95Å; F442-L577 HydrophobicContact CD1-CB 4.42Å; F442-L577 HydrophobicContact CD1-CD1 3.45Å; F442-L577 VanDerWaalsContact CD1-CD1 3.45Å; F442-L577 HydrophobicContact CD2-CD1 3.93Å; F442-L577 HydrophobicContact CE1-CB 4.36Å; F442-L577 HydrophobicContact CE1-CD1 3.78Å; F442-L577 HydrophobicContact CE2-CD1 4.23Å; F442-L577 HydrophobicContact CG-CD1 3.51Å; F442-L577 HydrophobicContact CZ-CD1 4.12Å
443	W	90	Very high	95.2	Very high	45 Å²	45	26.1 Å²	26.1	17%	0.17	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	9.8	170	-86	-83.1	0	0	0	113.9	W329 F333 T361 V414 L439 Y441 C445	W329-W443 AromaticContact CH2-CE2 3.78Å; W329-W443 HydrophobicContact CH2-CH2 4.23Å; W329-W443 AromaticContact CH2-CZ2 3.6Å; W329-W443 HydrophobicContact CH2-CZ2 3.6Å; W329-W443 AromaticContact CH2-NE1 3.92Å; W329-W443 AromaticContact CZ2-CD1 3.87Å; W329-W443 HydrophobicContact CZ2-CD2 4.31Å; W329-W443 AromaticContact CZ2-CE2 3.64Å; W329-W443 HydrophobicContact CZ2-CG 4.46Å; W329-W443 AromaticContact CZ2-CZ2 3.97Å; W329-W443 HydrophobicContact CZ2-CZ2 3.97Å; W329-W443 AromaticContact CZ2-NE1 3.34Å; W329-W443 VanDerWaalsContact CZ2-NE1 3.34Å; F333-W443 HydrophobicContact CZ-CB 4.17Å; F333-W443 HydrophobicContact CZ-CD2 4.15Å; F333-W443 AromaticContact CZ-CG 3.92Å; F333-W443 HydrophobicContact CZ-CG 3.92Å; T361-W443 HydrophobicContact CG2-CH2 4.08Å; T361-W443 HydrophobicContact CG2-CZ2 4.36Å; V414-W443 HydrophobicContact CG1-CH2 3.47Å; V414-W443 VanDerWaalsContact CG1-CH2 3.47Å; V414-W443 HydrophobicContact CG1-CZ2 3.58Å; V414-W443 HydrophobicContact CG2-CZ2 4.17Å; L439-W443 HydrophobicContact CB-CE3 3.9Å; L439-W443 HydrophobicContact CB-CZ3 3.75Å; L439-W443 HydrophobicContact CD1-CZ3 4Å; L439-W443 HydrophobicContact CD2-CE3 4.33Å; L439-W443 HydrophobicContact CD2-CH2 4.36Å; L439-W443 HydrophobicContact CD2-CZ3 3.51Å; L439-W443 HydrophobicContact CG-CZ3 3.91Å; L439-W443 VanDerWaalsContact O-CE3 3.27Å; L439-W443 PolarHBondContact O-N 3.38Å; Y441-W443 VanDerWaalsContact C-N 3.28Å; Y441-W443 PolarHBondContact O-N 2.94Å; W443-C445 PolarHBondContact O-N 2.9Å; W443-C445 VanDerWaalsContact O-N 3.14Å
444	N	90.6	Very high	95.4	Very high	23 Å²	23	29.6 Å²	29.6	12%	0.123	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	22.3	176.8	-167.2	38.8	0	0	0	113.4	Y260 L440 Y441 F442 Y446 T447	Y260-N444 PolarHBondContact O-ND2 2.96Å; L440-N444 PolarHBondContact O-N 2.93Å; Y441-N444 PolarHBondContact O-N 3.23Å; F442-N444 VanDerWaalsContact C-N 3.26Å; N444-Y446 PolarHBondContact O-N 3.48Å; N444-T447 PolarHBondContact O-N 3.12Å; N444-T447 PolarHBondContact O-OG1 3.46Å; N444-T447 WeakPolarHBondContact OD1-CG2 3.49Å
445	C	94.5	Very high	95.5	Very high	6 Å²	6	29.1 Å²	29.1	4%	0.041	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-21.5	-175.1	-60.4	0	0	0	0	113.2	F337 L440 W443 T447 C448 I449	F337-C445 HydrophobicContact CE1-CB 3.56Å; F337-C445 HydrophobicContact CZ-CB 3.65Å; L440-C445 HydrophobicContact CB-CB 4.03Å; L440-C445 HydrophobicContact CD2-CB 4.39Å; L440-C445 VanDerWaalsContact O-CB 3.26Å; L440-C445 WeakPolarHBondContact O-CB 3.49Å; L440-C445 PolarHBondContact O-N 3.35Å; W443-C445 PolarHBondContact O-N 2.9Å; W443-C445 VanDerWaalsContact O-N 3.14Å; C445-T447 PolarHBondContact O-N 3.02Å; C445-T447 VanDerWaalsContact O-N 3.14Å; C445-C448 WeakPolarHBondContact O-CB 3.42Å; C445-C448 PolarHBondContact O-N 3.14Å; C445-I449 HydrophobicContact CB-CD1 4.32Å; C445-I449 WeakPolarHBondContact O-CG1 3.34Å; C445-I449 PolarHBondContact O-N 3.45Å
446	Y	94.5	Very high	95.5	Very high	3 Å²	3	29.2 Å²	29.2	1%	0.012	14%	0.144	C	C	.	.	H	α-helix	trans	-59.7	-25.2	176.7	-80.4	-93.2	0	0	0	112.9	L440 Y441 N444 C448 I449 G450 L489 M492 H496	L440-Y446 HydrophobicContact CB-CE2 4.24Å; Y441-Y446 HydrophobicContact CD2-CD2 4.46Å; N444-Y446 PolarHBondContact O-N 3.48Å; Y446-C448 VanDerWaalsContact C-N 3.33Å; Y446-C448 PolarHBondContact O-N 3.5Å; Y446-I449 HydrophobicContact CD1-CD1 4.46Å; Y446-I449 HydrophobicContact CG-CD1 4.43Å; Y446-G450 PolarHBondContact O-N 2.98Å; Y446-L489 HydrophobicContact CE2-CD2 4.01Å; Y446-M492 HydrophobicContact CD1-CB 3.48Å; Y446-M492 VanDerWaalsContact CD1-CB 3.48Å; Y446-M492 HydrophobicContact CD2-CB 4.45Å; Y446-M492 HydrophobicContact CE1-CB 3.8Å; Y446-M492 HydrophobicContact CG-CB 3.84Å; Y446-M492 HydrophobicContact CG-CG 4.46Å; Y446-H496 PolarHBondContact O-CD2 3.38Å; Y446-H496 PolarHBondContact O-NE2 3.17Å; Y446-H496 VanDerWaalsContact O-NE2 3.14Å
447	T	91.9	Very high	95.5	Very high	41 Å²	41	33.1 Å²	33.1	25%	0.252	17%	0.165	S	C	.	.	H	α-helix	trans	-66.4	-32.7	172.8	60.8	0	0	0	0	113.2	N444 C445	N444-T447 PolarHBondContact O-N 3.12Å; N444-T447 PolarHBondContact O-OG1 3.46Å; N444-T447 WeakPolarHBondContact OD1-CG2 3.49Å; C445-T447 PolarHBondContact O-N 3.02Å; C445-T447 VanDerWaalsContact O-N 3.14Å
448	C	94.1	Very high	95.5	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.014	17%	0.174	C	C	.	.	H	α-helix	trans	-80.8	-49.9	173.2	-53.4	0	0	0	0	110.7	F303 F337 C445 Y446 G450 R451	F303-C448 HydrophobicContact CE1-CB 4.46Å; F337-C448 HydrophobicContact CE2-CB 4.35Å; C445-C448 WeakPolarHBondContact O-CB 3.42Å; C445-C448 PolarHBondContact O-N 3.14Å; Y446-C448 VanDerWaalsContact C-N 3.33Å; Y446-C448 PolarHBondContact O-N 3.5Å; C448-G450 PolarHBondContact O-N 3.39Å; C448-G450 VanDerWaalsContact O-N 3.16Å; C448-R451 WeakPolarHBondContact O-CB 3.22Å; C448-R451 PolarHBondContact O-N 3.21Å
449	I	96.3	Very high	95.5	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-51.3	-44	177.2	-62.4	166	0	0	0	110	F337 L440 C445 Y446 R451 N452 V456 I459	F337-I449 HydrophobicContact CB-CG1 4.42Å; F337-I449 HydrophobicContact CD1-CD1 3.65Å; F337-I449 HydrophobicContact CD1-CG1 3.42Å; F337-I449 VanDerWaalsContact CD1-CG1 3.42Å; F337-I449 HydrophobicContact CD2-CG1 4.47Å; F337-I449 HydrophobicContact CE1-CD1 3.81Å; F337-I449 HydrophobicContact CE1-CG1 3.72Å; F337-I449 HydrophobicContact CG-CG1 3.85Å; F337-I449 HydrophobicContact CZ-CG1 4.33Å; L440-I449 HydrophobicContact CD1-CD1 4.08Å; C445-I449 HydrophobicContact CB-CD1 4.32Å; C445-I449 WeakPolarHBondContact O-CG1 3.34Å; C445-I449 PolarHBondContact O-N 3.45Å; Y446-I449 HydrophobicContact CD1-CD1 4.46Å; Y446-I449 HydrophobicContact CG-CD1 4.43Å; I449-R451 PolarHBondContact O-N 3.41Å; I449-N452 PolarHBondContact O-N 3.32Å; I449-V456 HydrophobicContact CG2-CG2 3.83Å; I449-V456 WeakPolarHBondContact O-CG2 3.38Å; I449-I459 HydrophobicContact CD1-CD1 3.98Å; I449-I459 HydrophobicContact CG1-CD1 4.35Å; I449-I459 HydrophobicContact CG2-CD1 3.78Å
450	G	95.1	Very high	95.6	Very high	16 Å²	16	35.1 Å²	35.1	17%	0.165	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-12.7	-179.9	0	0	0	0	0	116.4	Y446 C448 H496	Y446-G450 PolarHBondContact O-N 2.98Å; C448-G450 PolarHBondContact O-N 3.39Å; C448-G450 VanDerWaalsContact O-N 3.16Å; G450-H496 VanDerWaalsContact CA-CG 3.48Å
451	R	95.6	Very high	95.7	Very high	165 Å²	165	41 Å²	41	62%	0.623	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-13	172.9	-57.3	-53.1	-176.2	168	0.8	113.2	I299 T300 C448 I449	I299-R451 VanDerWaalsContact O-CG 3.29Å; I299-R451 WeakPolarHBondContact O-CG 2.99Å; T300-R451 WeakPolarHBondContact O-CB 3.4Å; C448-R451 WeakPolarHBondContact O-CB 3.22Å; C448-R451 PolarHBondContact O-N 3.21Å; I449-R451 PolarHBondContact O-N 3.41Å
452	N	97.6	Very high	95.8	Very high	35 Å²	35	41.2 Å²	41.2	19%	0.187	21%	0.207	C	C	.	.			trans	-118	101.5	177.7	-172.1	-47.5	0	0	0	110.8	G301 F303 I449 S454 S455 V456	G301-N452 WeakPolarHBondContact O-CB 3.34Å; G301-N452 PolarHBondContact O-ND2 3.45Å; F303-N452 HydrophobicContact CD2-CB 4.27Å; F303-N452 HydrophobicContact CE2-CB 3.46Å; F303-N452 VanDerWaalsContact CE2-CB 3.46Å; F303-N452 HydrophobicContact CZ-CB 3.86Å; I449-N452 PolarHBondContact O-N 3.32Å; N452-S454 VanDerWaalsContact C-N 3.32Å; N452-S454 PolarHBondContact O-N 2.7Å; N452-S454 PolarHBondContact OD1-N 3.4Å; N452-S454 PolarHBondContact OD1-OG 3.11Å; N452-S455 PolarHBondContact O-N 2.67Å; N452-S455 PolarHBondContact OD1-N 2.84Å; N452-V456 WeakPolarHBondContact O-CG2 3.22Å; N452-V456 PolarHBondContact O-N 3.14Å
453	K	97.6	Very high	96.1	Very high	153 Å²	153	40.5 Å²	40.5	67%	0.665	20%	0.204	S	C	*	.	H	α-helix	trans	-59.9	-38.1	-175.5	-174.5	176.4	178.3	179.9	0	113.2	V456 L457 L497	K453-V456 PolarHBondContact O-N 2.99Å; K453-L457 HydrophobicContact CG-CD1 4.11Å; K453-L457 VanDerWaalsContact O-CG 3.32Å; K453-L457 WeakPolarHBondContact O-CG 3.42Å; K453-L457 PolarHBondContact O-N 3.06Å; K453-L457 VanDerWaalsContact O-N 3.07Å; K453-L497 HydrophobicContact CG-CD2 4.13Å
454	S	98	Very high	96.5	Very high	83 Å²	83	41.4 Å²	41.4	58%	0.58	21%	0.21	S	C	*	.	H	α-helix	trans	-68.8	-40.2	-179.4	56.3	0	0	0	0	111.3	N452 L457 S458	N452-S454 VanDerWaalsContact C-N 3.32Å; N452-S454 PolarHBondContact O-N 2.7Å; N452-S454 PolarHBondContact OD1-N 3.4Å; N452-S454 PolarHBondContact OD1-OG 3.11Å; S454-L457 PolarHBondContact O-N 2.86Å; S454-S458 WeakPolarHBondContact O-CB 3.42Å; S454-S458 PolarHBondContact O-N 2.95Å
455	S	98	Very high	96.7	Very high	5 Å²	5	44.1 Å²	44.1	4%	0.035	22%	0.222	C	C	.	.	H	α-helix	trans	-61.9	-44.4	172.2	-74.4	0	0	0	0	112.7	F303 F337 N452 L457 S458 I459	F303-S455 WeakPolarHBondContact CE2-OG 3.24Å; F337-S455 WeakPolarHBondContact O-CB 3.33Å; F337-S455 PolarHBondContact O-OG 3.49Å; F337-S455 VanDerWaalsContact O-OG 3.07Å; N452-S455 PolarHBondContact O-N 2.67Å; N452-S455 PolarHBondContact OD1-N 2.84Å; S455-L457 VanDerWaalsContact C-N 3.35Å; S455-L457 PolarHBondContact O-N 2.88Å; S455-S458 PolarHBondContact O-N 3.43Å; S455-I459 WeakPolarHBondContact O-CB 3.39Å; S455-I459 WeakPolarHBondContact O-CG1 3.49Å; S455-I459 PolarHBondContact O-N 3.23Å
456	V	98.1	Very high	96.7	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.018	23%	0.227	C	C	.	.	H	α-helix	trans	-60	-45.6	177.7	-176.4	0	0	0	0	111.3	I449 N452 K453 I459 L460 C493 H496 L497	I449-V456 HydrophobicContact CG2-CG2 3.83Å; I449-V456 WeakPolarHBondContact O-CG2 3.38Å; N452-V456 WeakPolarHBondContact O-CG2 3.22Å; N452-V456 PolarHBondContact O-N 3.14Å; K453-V456 PolarHBondContact O-N 2.99Å; V456-I459 PolarHBondContact O-N 2.75Å; V456-L460 VanDerWaalsContact O-CB 3.3Å; V456-L460 WeakPolarHBondContact O-CB 3.45Å; V456-L460 PolarHBondContact O-N 3.49Å; V456-C493 HydrophobicContact CG1-CB 3.88Å; V456-H496 HydrophobicContact CG2-CB 4.39Å; V456-L497 HydrophobicContact CB-CD2 4.06Å; V456-L497 HydrophobicContact CB-CG 4.36Å; V456-L497 HydrophobicContact CG1-CD1 3.96Å; V456-L497 HydrophobicContact CG1-CD2 3.84Å; V456-L497 HydrophobicContact CG1-CG 3.59Å
457	L	98.4	Very high	96.8	Very high	83 Å²	83	45.5 Å²	45.5	44%	0.435	23%	0.228	S	C	.	.	H	α-helix	trans	-62.7	-46.9	178.9	-71.8	169.7	0	0	0	111.4	K453 S454 S455 I459 L460 E461 L497	K453-L457 HydrophobicContact CG-CD1 4.11Å; K453-L457 VanDerWaalsContact O-CG 3.32Å; K453-L457 WeakPolarHBondContact O-CG 3.42Å; K453-L457 PolarHBondContact O-N 3.06Å; K453-L457 VanDerWaalsContact O-N 3.07Å; S454-L457 PolarHBondContact O-N 2.86Å; S455-L457 VanDerWaalsContact C-N 3.35Å; S455-L457 PolarHBondContact O-N 2.88Å; L457-I459 VanDerWaalsContact C-N 3.34Å; L457-I459 PolarHBondContact O-N 3.21Å; L457-L460 PolarHBondContact O-N 3.49Å; L457-E461 WeakPolarHBondContact O-CB 3.35Å; L457-E461 PolarHBondContact O-N 3.31Å; L457-L497 HydrophobicContact CD2-CD1 3.9Å; L457-L497 HydrophobicContact CD2-CD2 3.87Å; L457-L497 HydrophobicContact CG-CD2 3.98Å
458	S	97.9	Very high	96.9	Very high	31 Å²	31	48.8 Å²	48.8	22%	0.217	24%	0.24	C	C	.	.	H	α-helix	trans	-59.3	-41.6	178.4	-175	0	0	0	0	112.3	R339 S454 S455 D462	R339-S458 PolarHBondContact NE-OG 3.09Å; R339-S458 PolarHBondContact NH1-O 2.68Å; R339-S458 PolarHBondContact NH2-OG 2.87Å; S454-S458 WeakPolarHBondContact O-CB 3.42Å; S454-S458 PolarHBondContact O-N 2.95Å; S455-S458 PolarHBondContact O-N 3.43Å; S458-D462 PolarHBondContact O-N 2.97Å
459	I	98.2	Very high	96.8	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-71.9	-42	176.5	-72.2	172.5	0	0	0	111.7	R339 Y437 I449 S455 V456 L457 E461 D462 I463	R339-I459 HydrophobicContact CG-CG1 4.45Å; Y437-I459 HydrophobicContact CD1-CG2 3.92Å; Y437-I459 HydrophobicContact CE1-CB 4.22Å; Y437-I459 HydrophobicContact CE1-CD1 4.24Å; Y437-I459 HydrophobicContact CE1-CG1 3.86Å; Y437-I459 HydrophobicContact CE1-CG2 3.55Å; I449-I459 HydrophobicContact CD1-CD1 3.98Å; I449-I459 HydrophobicContact CG1-CD1 4.35Å; I449-I459 HydrophobicContact CG2-CD1 3.78Å; S455-I459 WeakPolarHBondContact O-CB 3.39Å; S455-I459 WeakPolarHBondContact O-CG1 3.49Å; S455-I459 PolarHBondContact O-N 3.23Å; V456-I459 PolarHBondContact O-N 2.75Å; L457-I459 VanDerWaalsContact C-N 3.34Å; L457-I459 PolarHBondContact O-N 3.21Å; I459-E461 VanDerWaalsContact C-N 3.35Å; I459-E461 PolarHBondContact O-N 3.24Å; I459-D462 PolarHBondContact O-N 3.21Å; I459-I463 HydrophobicContact CG2-CD1 3.66Å; I459-I463 HydrophobicContact CG2-CG1 4.32Å; I459-I463 VanDerWaalsContact O-CG1 3.31Å; I459-I463 WeakPolarHBondContact O-CG1 3.31Å; I459-I463 PolarHBondContact O-N 2.81Å
460	L	98.4	Very high	96.5	Very high	17 Å²	17	53.8 Å²	53.8	9%	0.089	26%	0.259	C	S	.	.	H	α-helix	trans	-60.7	-46	177.9	175.4	57.6	0	0	0	111.2	V456 L457 D462 I463 E464 K490 C493 L494 L497	V456-L460 VanDerWaalsContact O-CB 3.3Å; V456-L460 WeakPolarHBondContact O-CB 3.45Å; V456-L460 PolarHBondContact O-N 3.49Å; L457-L460 PolarHBondContact O-N 3.49Å; L460-D462 VanDerWaalsContact C-N 3.31Å; L460-D462 PolarHBondContact O-N 3.23Å; L460-I463 PolarHBondContact O-N 3.08Å; L460-E464 HydrophobicContact CD1-CG 4.15Å; L460-E464 WeakPolarHBondContact O-CG 3.49Å; L460-E464 PolarHBondContact O-N 3.28Å; L460-K490 HydrophobicContact CD1-CB 4.34Å; L460-K490 HydrophobicContact CD1-CD 4.29Å; L460-K490 HydrophobicContact CD1-CG 3.78Å; L460-C493 HydrophobicContact CB-CB 3.95Å; L460-C493 HydrophobicContact CD1-CB 4.01Å; L460-C493 HydrophobicContact CD2-CB 4.28Å; L460-C493 HydrophobicContact CG-CB 4.3Å; L460-L494 HydrophobicContact CD2-CD2 4.22Å; L460-L497 HydrophobicContact CD2-CD1 3.72Å
461	E	98	Very high	96.3	Very high	125 Å²	125	57.1 Å²	57.1	58%	0.584	27%	0.269	S	S	*	.	H	α-helix	trans	-57	-45.5	176.1	-176.8	-178.5	-170.7	0	0	111.4	L457 I459 E464 Q465	L457-E461 WeakPolarHBondContact O-CB 3.35Å; L457-E461 PolarHBondContact O-N 3.31Å; I459-E461 VanDerWaalsContact C-N 3.35Å; I459-E461 PolarHBondContact O-N 3.24Å; E461-E464 PolarHBondContact O-N 3.17Å; E461-Q465 WeakPolarHBondContact O-CB 3.22Å; E461-Q465 PolarHBondContact O-N 3.35Å
462	D	97.3	Very high	96	Very high	13 Å²	13	58.2 Å²	58.2	7%	0.07	28%	0.278	C	S	.	.	H	α-helix	trans	-63.2	-47.4	177.8	-164.2	41.2	0	0	0	112.2	R339 Y437 S458 I459 L460 E464 Q465 Q466	R339-D462 IonicContact NH1-OD1 2.56Å; Y437-D462 HydrophobicContact CE2-CB 4.3Å; Y437-D462 VanDerWaalsContact CE2-OD2 3.22Å; Y437-D462 WeakPolarHBondContact CE2-OD2 3.4Å; Y437-D462 WeakPolarHBondContact OH-CB 3.44Å; Y437-D462 PolarHBondContact OH-OD2 3.38Å; S458-D462 PolarHBondContact O-N 2.97Å; I459-D462 PolarHBondContact O-N 3.21Å; L460-D462 VanDerWaalsContact C-N 3.31Å; L460-D462 PolarHBondContact O-N 3.23Å; D462-E464 VanDerWaalsContact C-N 3.27Å; D462-E464 PolarHBondContact O-N 2.94Å; D462-Q465 PolarHBondContact O-N 3.42Å; D462-Q466 WeakPolarHBondContact O-CB 3.35Å; D462-Q466 WeakPolarHBondContact O-CG 3.42Å; D462-Q466 PolarHBondContact O-N 2.79Å
463	I	97.9	Very high	95.4	Very high	0 Å²	0	62 Å²	62	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-57.2	-43.2	177.3	-71.9	167.6	0	0	0	110.7	I434 Y437 I459 L460 Y467 Y486 L489	I434-I463 HydrophobicContact CD1-CG1 4.5Å; I434-I463 HydrophobicContact CD1-CG2 4.17Å; Y437-I463 HydrophobicContact CD2-CD1 4.14Å; Y437-I463 HydrophobicContact CD2-CG1 3.54Å; Y437-I463 HydrophobicContact CE2-CG1 3.76Å; Y437-I463 HydrophobicContact CG-CD1 4.21Å; Y437-I463 HydrophobicContact CG-CG1 4.12Å; I459-I463 HydrophobicContact CG2-CD1 3.66Å; I459-I463 HydrophobicContact CG2-CG1 4.32Å; I459-I463 VanDerWaalsContact O-CG1 3.31Å; I459-I463 WeakPolarHBondContact O-CG1 3.31Å; I459-I463 PolarHBondContact O-N 2.81Å; L460-I463 PolarHBondContact O-N 3.08Å; I463-Y467 VanDerWaalsContact O-CB 3.3Å; I463-Y467 WeakPolarHBondContact O-CB 3.44Å; I463-Y467 PolarHBondContact O-N 3.1Å; I463-Y486 HydrophobicContact CG2-CD2 3.76Å; I463-Y486 HydrophobicContact CG2-CE2 4.06Å; I463-L489 HydrophobicContact CD1-CB 4.05Å
464	E	97.8	Very high	94.6	Very high	64 Å²	64	56.4 Å²	56.4	30%	0.299	28%	0.282	S	S	.	.	H	α-helix	trans	-66.6	-44	178.1	-72	-176.5	151.6	0	0	112	L460 E461 D462 Y467 Q468 Y486 K490	L460-E464 HydrophobicContact CD1-CG 4.15Å; L460-E464 WeakPolarHBondContact O-CG 3.49Å; L460-E464 PolarHBondContact O-N 3.28Å; E461-E464 PolarHBondContact O-N 3.17Å; D462-E464 VanDerWaalsContact C-N 3.27Å; D462-E464 PolarHBondContact O-N 2.94Å; E464-Y467 PolarHBondContact O-N 3.41Å; E464-Q468 WeakPolarHBondContact O-CG 3.26Å; E464-Q468 PolarHBondContact O-N 2.94Å; E464-Y486 HydrophobicContact CG-CE2 4.09Å; E464-K490 VanDerWaalsContact OE1-CE 3.23Å; E464-K490 WeakPolarHBondContact OE1-CE 3.44Å; E464-K490 IonicContact OE1-NZ 2.73Å; E464-K490 PolarHBondContact OE1-NZ 3.47Å
465	Q	95.9	Very high	93.2	Very high	80 Å²	80	57.6 Å²	57.6	37%	0.374	30%	0.297	S	S	.	.	H	α-helix	trans	-61.1	-47.1	176.8	-168.3	-178.2	29.4	0	0	111.4	E461 D462 Y467 Q468 R469	E461-Q465 WeakPolarHBondContact O-CB 3.22Å; E461-Q465 PolarHBondContact O-N 3.35Å; D462-Q465 PolarHBondContact O-N 3.42Å; Q465-Y467 VanDerWaalsContact C-N 3.3Å; Q465-Y467 PolarHBondContact O-N 3.16Å; Q465-Q468 PolarHBondContact O-N 3.28Å; Q465-R469 VanDerWaalsContact CD-NH2 3.29Å; Q465-R469 WeakPolarHBondContact O-CG 3.42Å; Q465-R469 PolarHBondContact O-N 3.26Å
466	Q	94.7	Very high	91.9	Very high	29 Å²	29	67.6 Å²	67.6	14%	0.136	34%	0.34	C	S	.	.	H	α-helix	trans	-62	-38.8	177.7	-67.6	-63.6	-15.1	0	0	111.8	F433 I434 D462 R469 R470	F433-Q466 HydrophobicContact CE2-CB 4.33Å; I434-Q466 HydrophobicContact CG2-CB 3.65Å; I434-Q466 HydrophobicContact CG2-CG 3.98Å; D462-Q466 WeakPolarHBondContact O-CB 3.35Å; D462-Q466 WeakPolarHBondContact O-CG 3.42Å; D462-Q466 PolarHBondContact O-N 2.79Å; Q466-R469 PolarHBondContact O-N 3.38Å; Q466-R470 WeakPolarHBondContact O-CB 3.5Å; Q466-R470 PolarHBondContact O-N 3Å
467	Y	95.6	Very high	90.6	Very high	9 Å²	9	69.5 Å²	69.5	4%	0.035	36%	0.36	C	S	.	.	H	α-helix	trans	-63.7	-43.3	176	-179.7	-111.5	0	0	0	112.5	F433 I463 E464 Q465 R470 K471 M478 H483 Y486	F433-Y467 HydrophobicContact CE1-CD2 4.38Å; F433-Y467 AromaticContact CZ-CD2 3.85Å; F433-Y467 HydrophobicContact CZ-CD2 3.85Å; F433-Y467 HydrophobicContact CZ-CG 4.4Å; I463-Y467 VanDerWaalsContact O-CB 3.3Å; I463-Y467 WeakPolarHBondContact O-CB 3.44Å; I463-Y467 PolarHBondContact O-N 3.1Å; E464-Y467 PolarHBondContact O-N 3.41Å; Q465-Y467 VanDerWaalsContact C-N 3.3Å; Q465-Y467 PolarHBondContact O-N 3.16Å; Y467-R470 PolarHBondContact O-N 2.66Å; Y467-K471 HydrophobicContact CD1-CD 4.32Å; Y467-K471 HydrophobicContact CE1-CD 3.82Å; Y467-K471 PolarHBondContact O-N 3.41Å; Y467-K471 WeakPolarHBondContact OH-CE 3.26Å; Y467-K471 PolarHBondContact OH-NZ 3.07Å; Y467-M478 HydrophobicContact CD2-CE 3.52Å; Y467-M478 HydrophobicContact CE2-CE 3.61Å; Y467-M478 HydrophobicContact CE2-CG 4.01Å; Y467-H483 AromaticContact CE2-ND1 3.92Å; Y467-H483 AromaticContact CZ-ND1 3.64Å; Y467-H483 PolarHBondContact OH-CE1 2.9Å; Y467-H483 PolarHBondContact OH-ND1 3.24Å; Y467-Y486 AromaticContact CD1-CD1 3.96Å; Y467-Y486 HydrophobicContact CD1-CD1 3.96Å; Y467-Y486 AromaticContact CD1-CD2 3.98Å; Y467-Y486 HydrophobicContact CD1-CD2 3.98Å; Y467-Y486 AromaticContact CD1-CE1 3.79Å; Y467-Y486 HydrophobicContact CD1-CE1 3.79Å; Y467-Y486 AromaticContact CD1-CE2 3.82Å; Y467-Y486 HydrophobicContact CD1-CE2 3.82Å; Y467-Y486 HydrophobicContact CD1-CG 4.04Å; Y467-Y486 AromaticContact CD1-CZ 3.71Å; Y467-Y486 AromaticContact CD2-CD1 3.87Å; Y467-Y486 HydrophobicContact CD2-CD1 3.87Å; Y467-Y486 AromaticContact CD2-CD2 3.76Å; Y467-Y486 HydrophobicContact CD2-CD2 3.76Å; Y467-Y486 HydrophobicContact CD2-CE2 4.44Å; Y467-Y486 AromaticContact CD2-CG 3.42Å; Y467-Y486 HydrophobicContact CD2-CG 3.42Å; Y467-Y486 VanDerWaalsContact CD2-CG 3.42Å; Y467-Y486 AromaticContact CE1-CD1 3.78Å; Y467-Y486 HydrophobicContact CE1-CD1 3.78Å; Y467-Y486 AromaticContact CE1-CE1 3.65Å; Y467-Y486 HydrophobicContact CE1-CE1 3.65Å; Y467-Y486 HydrophobicContact CE1-CG 4.26Å; Y467-Y486 AromaticContact CE2-CD1 3.72Å; Y467-Y486 HydrophobicContact CE2-CD1 3.72Å; Y467-Y486 HydrophobicContact CE2-CD2 4.46Å; Y467-Y486 HydrophobicContact CE2-CE1 4.44Å; Y467-Y486 AromaticContact CE2-CG 3.72Å; Y467-Y486 HydrophobicContact CE2-CG 3.72Å; Y467-Y486 AromaticContact CG-CD1 3.99Å; Y467-Y486 HydrophobicContact CG-CD1 3.99Å; Y467-Y486 AromaticContact CG-CD2 3.49Å; Y467-Y486 HydrophobicContact CG-CD2 3.49Å; Y467-Y486 VanDerWaalsContact CG-CD2 3.49Å; Y467-Y486 HydrophobicContact CG-CE1 4.23Å; Y467-Y486 AromaticContact CG-CE2 3.76Å; Y467-Y486 HydrophobicContact CG-CE2 3.76Å; Y467-Y486 AromaticContact CG-CG 3.6Å; Y467-Y486 HydrophobicContact CG-CG 3.6Å; Y467-Y486 AromaticContact CZ-CD1 3.67Å
468	Q	94.2	Very high	89.8	Confident	110 Å²	110	67.2 Å²	67.2	51%	0.514	35%	0.348	S	S	.	.	H	α-helix	trans	-65.1	-42.5	176.4	-62.7	-54.9	-22.5	0	0	111.9	E464 Q465 R470 K471 F472	E464-Q468 WeakPolarHBondContact O-CG 3.26Å; E464-Q468 PolarHBondContact O-N 2.94Å; Q465-Q468 PolarHBondContact O-N 3.28Å; Q468-R470 PolarHBondContact O-N 3.04Å; Q468-K471 WeakPolarHBondContact O-CB 3.43Å; Q468-K471 PolarHBondContact O-N 3.38Å; Q468-F472 PolarHBondContact O-N 3.45Å
469	R	91.4	Very high	89.4	Confident	68 Å²	68	67.7 Å²	67.7	26%	0.257	35%	0.351	S	S	.	.	H	α-helix	trans	-59.2	-47.7	174.7	-70.6	177.2	-173.2	-175.9	4.7	111.7	E375 Q465 Q466 K471 F472 V473	E375-R469 IonicContact OE2-NH1 2.67Å; E375-R469 PolarHBondContact OE2-NH1 2.95Å; Q465-R469 VanDerWaalsContact CD-NH2 3.29Å; Q465-R469 WeakPolarHBondContact O-CG 3.42Å; Q465-R469 PolarHBondContact O-N 3.26Å; Q466-R469 PolarHBondContact O-N 3.38Å; R469-K471 VanDerWaalsContact C-N 3.32Å; R469-K471 PolarHBondContact O-N 3.13Å; R469-F472 WeakPolarHBondContact O-CB 3.43Å; R469-F472 PolarHBondContact O-N 3.16Å; R469-F472 VanDerWaalsContact O-N 3.13Å; R469-V473 WeakPolarHBondContact O-CG2 3.41Å; R469-V473 PolarHBondContact O-N 3.04Å
470	R	91.4	Very high	89	Confident	40 Å²	40	69.2 Å²	69.2	15%	0.151	36%	0.361	C	S	.	.	H	α-helix	trans	-60	-42.5	178.7	-174.3	64.5	164.4	-165.6	-5.6	111.7	S431 F433 Q466 Y467 Q468 F472 V473 C474 M478 D482	S431-R470 PolarHBondContact OG-NH1 2.94Å; F433-R470 HydrophobicContact CD2-CB 4.01Å; F433-R470 HydrophobicContact CD2-CG 3.92Å; F433-R470 HydrophobicContact CE2-CB 4.1Å; F433-R470 HydrophobicContact CE2-CG 4.41Å; F433-R470 HydrophobicContact CG-CG 4.5Å; Q466-R470 WeakPolarHBondContact O-CB 3.5Å; Q466-R470 PolarHBondContact O-N 3Å; Y467-R470 PolarHBondContact O-N 2.66Å; Q468-R470 PolarHBondContact O-N 3.04Å; R470-F472 VanDerWaalsContact C-N 3.34Å; R470-F472 PolarHBondContact O-N 3.27Å; R470-V473 PolarHBondContact O-N 2.99Å; R470-C474 WeakPolarHBondContact O-CB 3.36Å; R470-C474 PolarHBondContact O-N 2.85Å; R470-C474 PolarHBondContact O-SG 2.88Å; R470-C474 VanDerWaalsContact O-SG 3.35Å; R470-M478 HydrophobicContact CB-CE 4.06Å; R470-M478 HydrophobicContact CB-SD 4.35Å; R470-M478 HydrophobicContact CG-CE 3.53Å; R470-M478 HydrophobicContact CG-SD 3.51Å; R470-M478 VanDerWaalsContact CG-SD 3.51Å; R470-D482 IonicContact CZ-OD2 2.75Å; R470-D482 IonicContact NE-OD2 3.62Å; R470-D482 PolarHBondContact NE-OD2 2.77Å; R470-D482 IonicContact NH2-OD2 3.84Å; R470-D482 PolarHBondContact NH2-OD2 2.83Å; R470-D482 VanDerWaalsContact NH2-OD2 3.09Å
471	K	90.8	Very high	88.6	Confident	87 Å²	87	68.8 Å²	68.8	38%	0.378	36%	0.358	S	S	.	.	H	α-helix	trans	-58.8	-43.3	173.3	-86.7	-178.1	163	171.7	0	113	Y467 Q468 R469 M478	Y467-K471 HydrophobicContact CD1-CD 4.32Å; Y467-K471 HydrophobicContact CE1-CD 3.82Å; Y467-K471 PolarHBondContact O-N 3.41Å; Y467-K471 WeakPolarHBondContact OH-CE 3.26Å; Y467-K471 PolarHBondContact OH-NZ 3.07Å; Q468-K471 WeakPolarHBondContact O-CB 3.43Å; Q468-K471 PolarHBondContact O-N 3.38Å; R469-K471 VanDerWaalsContact C-N 3.32Å; R469-K471 PolarHBondContact O-N 3.13Å; K471-M478 HydrophobicContact CG-CB 4.19Å
472	F	88.4	Confident	88.4	Confident	187 Å²	187	63 Å²	63	82%	0.82	33%	0.332	S	S	*	.	H	α-helix	trans	-66.1	-42.1	-179.2	-177.8	-97.4	0	0	0	112.3	Q468 R469 R470	Q468-F472 PolarHBondContact O-N 3.45Å; R469-F472 WeakPolarHBondContact O-CB 3.43Å; R469-F472 PolarHBondContact O-N 3.16Å; R469-F472 VanDerWaalsContact O-N 3.13Å; R470-F472 VanDerWaalsContact C-N 3.34Å; R470-F472 PolarHBondContact O-N 3.27Å
473	V	85.8	Confident	88.2	Confident	114 Å²	114	63.7 Å²	63.7	69%	0.691	33%	0.334	S	S	*	.	H	α-helix	trans	-73.1	-33.7	-179.8	176.6	0	0	0	0	112.1	R469 R470 A475	R469-V473 WeakPolarHBondContact O-CG2 3.41Å; R469-V473 PolarHBondContact O-N 3.04Å; R470-V473 PolarHBondContact O-N 2.99Å; V473-A475 PolarHBondContact O-N 2.99Å; V473-A475 VanDerWaalsContact O-N 3.11Å
474	C	80.6	Confident	88.1	Confident	37 Å²	37	63.7 Å²	63.7	25%	0.25	33%	0.334	C	S	.	.			trans	-81.3	89.4	-179.7	-68.9	0	0	0	0	112.2	R470 K476 G477	R470-C474 WeakPolarHBondContact O-CB 3.36Å; R470-C474 PolarHBondContact O-N 2.85Å; R470-C474 PolarHBondContact O-SG 2.88Å; R470-C474 VanDerWaalsContact O-SG 3.35Å; C474-K476 PolarHBondContact O-N 3.33Å; C474-K476 VanDerWaalsContact O-N 3.08Å; C474-G477 WeakPolarHBondContact O-CA 3.37Å; C474-G477 PolarHBondContact O-N 3.33Å
475	A	68.1	Low	88	Confident	107 Å²	107	60.8 Å²	60.8	88%	0.884	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-29.2	179.2	0	0	0	0	0	115.1	V473 G477	V473-A475 PolarHBondContact O-N 2.99Å; V473-A475 VanDerWaalsContact O-N 3.11Å; A475-G477 PolarHBondContact O-N 3.03Å
476	K	70.4	Confident	88.1	Confident	216 Å²	216	57.8 Å²	57.8	94%	0.939	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	7.7	177.2	-66.9	-176.4	179.4	177.7	0	113.7	C474	C474-K476 PolarHBondContact O-N 3.33Å; C474-K476 VanDerWaalsContact O-N 3.08Å
477	G	71.5	Confident	88.3	Confident	43 Å²	43	56.6 Å²	56.6	44%	0.443	30%	0.301	S	S	.	.			trans	81.9	169.9	-170	0	0	0	0	0	112.9	C474 A475	C474-G477 WeakPolarHBondContact O-CA 3.37Å; C474-G477 PolarHBondContact O-N 3.33Å; A475-G477 PolarHBondContact O-N 3.03Å
478	M	82.2	Confident	88.4	Confident	34 Å²	34	56.2 Å²	56.2	17%	0.167	30%	0.299	C	S	.	.			trans	-71.2	136.8	-178.5	-171.5	58.5	149.4	0	0	111.3	F433 Y467 R470 K471 D482 H483	F433-M478 HydrophobicContact CD1-CE 4.01Å; F433-M478 HydrophobicContact CD2-CE 4.21Å; F433-M478 HydrophobicContact CE1-CE 3.93Å; F433-M478 HydrophobicContact CE2-CE 4.13Å; F433-M478 HydrophobicContact CG-CE 4.17Å; F433-M478 HydrophobicContact CZ-CE 4Å; Y467-M478 HydrophobicContact CD2-CE 3.52Å; Y467-M478 HydrophobicContact CE2-CE 3.61Å; Y467-M478 HydrophobicContact CE2-CG 4.01Å; R470-M478 HydrophobicContact CB-CE 4.06Å; R470-M478 HydrophobicContact CB-SD 4.35Å; R470-M478 HydrophobicContact CG-CE 3.53Å; R470-M478 HydrophobicContact CG-SD 3.51Å; R470-M478 VanDerWaalsContact CG-SD 3.51Å; K471-M478 HydrophobicContact CG-CB 4.19Å; M478-D482 HydrophobicContact CE-CB 3.23Å; M478-D482 HydrophobicContact CG-CB 4.26Å; M478-D482 HydrophobicContact SD-CB 3.6Å; M478-H483 HydrophobicContact CG-CB 3.95Å
479	S	88.1	Confident	88.6	Confident	41 Å²	41	51 Å²	51	29%	0.287	28%	0.275	S	S	.	.			trans	-62.9	150	174.3	76.4	0	0	0	0	110.9	D481 D482 H483	S479-D481 VanDerWaalsContact C-N 3.28Å; S479-D481 PolarHBondContact O-N 2.93Å; S479-D482 PolarHBondContact O-N 3.46Å; S479-D482 VanDerWaalsContact OG-CB 3.29Å; S479-D482 WeakPolarHBondContact OG-CB 3.2Å; S479-D482 PolarHBondContact OG-N 3.06Å; S479-D482 VanDerWaalsContact OG-N 3.07Å; S479-D482 PolarHBondContact OG-OD1 2.84Å; S479-D482 PolarHBondContact OG-OD2 2.67Å; S479-H483 WeakPolarHBondContact O-CB 3.18Å; S479-H483 PolarHBondContact O-N 3.42Å
480	T	89.7	Confident	89	Confident	33 Å²	33	49.6 Å²	49.6	20%	0.202	27%	0.27	C	S	.	.	H	α-helix	trans	-59.9	-41.9	176.8	-60.5	0	0	0	0	111.1	H483 C484 K513 D534 L535	T480-H483 PolarHBondContact O-N 2.94Å; T480-C484 WeakPolarHBondContact O-CB 3.48Å; T480-C484 PolarHBondContact O-N 2.9Å; T480-C484 PolarHBondContact O-SG 2.65Å; T480-K513 HydrophobicContact CG2-CD 4.31Å; T480-D534 HydrophobicContact CG2-CB 3.93Å; T480-L535 HydrophobicContact CG2-CD2 4.31Å
481	D	91.1	Very high	89.3	Confident	7 Å²	7	47.8 Å²	47.8	4%	0.037	26%	0.264	C	S	.	.	H	α-helix	trans	-58.2	-52.2	176.9	-62.2	-117.3	0	0	0	112.2	S479 H483 C484 L485 L535 K536 V537 N538 L541	S479-D481 VanDerWaalsContact C-N 3.28Å; S479-D481 PolarHBondContact O-N 2.93Å; D481-H483 VanDerWaalsContact C-N 3.34Å; D481-H483 PolarHBondContact O-N 3.36Å; D481-C484 PolarHBondContact O-N 2.7Å; D481-L485 WeakPolarHBondContact O-CB 2.97Å; D481-L485 PolarHBondContact O-N 3.02Å; D481-L535 HydrophobicContact CB-CD2 4.19Å; D481-K536 PolarHBondContact OD1-N 3.33Å; D481-K536 PolarHBondContact OD2-N 2.95Å; D481-V537 PolarHBondContact OD1-N 2.88Å; D481-N538 HydrophobicContact CB-CB 4.27Å; D481-N538 WeakPolarHBondContact OD1-CB 3.38Å; D481-N538 PolarHBondContact OD1-N 3.28Å; D481-L541 WeakPolarHBondContact O-CD1 3.32Å
482	D	93.3	Very high	89.6	Confident	5 Å²	5	44 Å²	44	3%	0.027	25%	0.247	C	C	.	.	H	α-helix	trans	-67.2	-37.1	-178.1	-64.5	-6.8	0	0	0	111.2	F433 R470 M478 S479 L485 Y486	F433-D482 HydrophobicContact CB-CB 4.1Å; F433-D482 HydrophobicContact CD1-CB 3.68Å; F433-D482 WeakPolarHBondContact CD1-O 3.3Å; F433-D482 HydrophobicContact CE1-CB 4.43Å; F433-D482 VanDerWaalsContact CE1-O 3.25Å; F433-D482 WeakPolarHBondContact CE1-O 3.23Å; F433-D482 HydrophobicContact CG-CB 4.04Å; R470-D482 IonicContact CZ-OD2 2.75Å; R470-D482 IonicContact NE-OD2 3.62Å; R470-D482 PolarHBondContact NE-OD2 2.77Å; R470-D482 IonicContact NH2-OD2 3.84Å; R470-D482 PolarHBondContact NH2-OD2 2.83Å; R470-D482 VanDerWaalsContact NH2-OD2 3.09Å; M478-D482 HydrophobicContact CE-CB 3.23Å; M478-D482 HydrophobicContact CG-CB 4.26Å; M478-D482 HydrophobicContact SD-CB 3.6Å; S479-D482 PolarHBondContact O-N 3.46Å; S479-D482 VanDerWaalsContact OG-CB 3.29Å; S479-D482 WeakPolarHBondContact OG-CB 3.2Å; S479-D482 PolarHBondContact OG-N 3.06Å; S479-D482 VanDerWaalsContact OG-N 3.07Å; S479-D482 PolarHBondContact OG-OD1 2.84Å; S479-D482 PolarHBondContact OG-OD2 2.67Å; D482-L485 PolarHBondContact O-N 2.72Å; D482-Y486 PolarHBondContact O-N 2.72Å
483	H	93.9	Very high	90.1	Very high	26 Å²	26	35 Å²	35	12%	0.12	21%	0.208	C	C	.	.	H	α-helix	trans	-66.1	-43	176	178	42.5	0	0	0	112.6	Y467 M478 S479 T480 D481 L485 Y486 L487 E509	Y467-H483 AromaticContact CE2-ND1 3.92Å; Y467-H483 AromaticContact CZ-ND1 3.64Å; Y467-H483 PolarHBondContact OH-CE1 2.9Å; Y467-H483 PolarHBondContact OH-ND1 3.24Å; M478-H483 HydrophobicContact CG-CB 3.95Å; S479-H483 WeakPolarHBondContact O-CB 3.18Å; S479-H483 PolarHBondContact O-N 3.42Å; T480-H483 PolarHBondContact O-N 2.94Å; D481-H483 VanDerWaalsContact C-N 3.34Å; D481-H483 PolarHBondContact O-N 3.36Å; H483-L485 VanDerWaalsContact C-N 3.32Å; H483-L485 PolarHBondContact O-N 3.46Å; H483-Y486 WeakPolarHBondContact O-CB 3.35Å; H483-Y486 PolarHBondContact O-N 3.2Å; H483-L487 WeakPolarHBondContact O-CG 3.18Å; H483-L487 PolarHBondContact O-N 2.92Å; H483-E509 IonicContact CE1-OE1 2.76Å; H483-E509 IonicContact NE2-OE1 3.85Å; H483-E509 PolarHBondContact NE2-OE1 2.69Å
484	C	95.1	Very high	90.7	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.3	-36	176.5	-67	0	0	0	0	111.4	T480 D481 L487 L488 I510 L535 L541	T480-C484 WeakPolarHBondContact O-CB 3.48Å; T480-C484 PolarHBondContact O-N 2.9Å; T480-C484 PolarHBondContact O-SG 2.65Å; D481-C484 PolarHBondContact O-N 2.7Å; C484-L487 PolarHBondContact O-N 3.34Å; C484-L488 WeakPolarHBondContact O-CB 3.45Å; C484-L488 PolarHBondContact O-N 2.95Å; C484-I510 HydrophobicContact CB-CG1 4.36Å; C484-I510 HydrophobicContact CB-CG2 4.21Å; C484-I510 WeakPolarHBondContact O-CD1 3.24Å; C484-L535 HydrophobicContact CB-CD2 4.34Å; C484-L541 HydrophobicContact CB-CD1 3.84Å
485	L	96.5	Very high	91.4	Very high	3 Å²	3	30.3 Å²	30.3	2%	0.016	18%	0.175	C	C	.	.	H	α-helix	trans	-62.4	-45.1	172.7	179.8	60.6	0	0	0	111.6	F433 I434 E438 D481 D482 H483 L487 L488 L489 L541	F433-L485 HydrophobicContact CD1-CD2 4.17Å; I434-L485 HydrophobicContact CG1-CD2 4.26Å; E438-L485 HydrophobicContact CB-CD1 4.16Å; E438-L485 HydrophobicContact CB-CD2 4.27Å; E438-L485 HydrophobicContact CG-CD1 3.97Å; E438-L485 HydrophobicContact CG-CD2 4.32Å; D481-L485 WeakPolarHBondContact O-CB 2.97Å; D481-L485 PolarHBondContact O-N 3.02Å; D482-L485 PolarHBondContact O-N 2.72Å; H483-L485 VanDerWaalsContact C-N 3.32Å; H483-L485 PolarHBondContact O-N 3.46Å; L485-L487 PolarHBondContact O-N 3.09Å; L485-L488 PolarHBondContact O-N 2.96Å; L485-L489 HydrophobicContact CD1-CD1 3.8Å; L485-L489 HydrophobicContact CD1-CD2 4.49Å; L485-L489 HydrophobicContact CD1-CG 3.98Å; L485-L489 HydrophobicContact CG-CD1 4.02Å; L485-L489 WeakPolarHBondContact O-CG 3.42Å; L485-L489 PolarHBondContact O-N 2.84Å; L485-L541 HydrophobicContact CB-CD1 4.42Å; L485-L541 HydrophobicContact CB-CD2 4.17Å; L485-L541 HydrophobicContact CD1-CD2 4.08Å
486	Y	97.8	Very high	92.7	Very high	18 Å²	18	27.3 Å²	27.3	7%	0.071	14%	0.142	C	C	.	.	H	α-helix	trans	-55.7	-50.3	173.4	163.8	-104.9	0	0	0	112	I463 E464 Y467 D482 H483 L488 L489 K490	I463-Y486 HydrophobicContact CG2-CD2 3.76Å; I463-Y486 HydrophobicContact CG2-CE2 4.06Å; E464-Y486 HydrophobicContact CG-CE2 4.09Å; Y467-Y486 AromaticContact CD1-CD1 3.96Å; Y467-Y486 HydrophobicContact CD1-CD1 3.96Å; Y467-Y486 AromaticContact CD1-CD2 3.98Å; Y467-Y486 HydrophobicContact CD1-CD2 3.98Å; Y467-Y486 AromaticContact CD1-CE1 3.79Å; Y467-Y486 HydrophobicContact CD1-CE1 3.79Å; Y467-Y486 AromaticContact CD1-CE2 3.82Å; Y467-Y486 HydrophobicContact CD1-CE2 3.82Å; Y467-Y486 HydrophobicContact CD1-CG 4.04Å; Y467-Y486 AromaticContact CD1-CZ 3.71Å; Y467-Y486 AromaticContact CD2-CD1 3.87Å; Y467-Y486 HydrophobicContact CD2-CD1 3.87Å; Y467-Y486 AromaticContact CD2-CD2 3.76Å; Y467-Y486 HydrophobicContact CD2-CD2 3.76Å; Y467-Y486 HydrophobicContact CD2-CE2 4.44Å; Y467-Y486 AromaticContact CD2-CG 3.42Å; Y467-Y486 HydrophobicContact CD2-CG 3.42Å; Y467-Y486 VanDerWaalsContact CD2-CG 3.42Å; Y467-Y486 AromaticContact CE1-CD1 3.78Å; Y467-Y486 HydrophobicContact CE1-CD1 3.78Å; Y467-Y486 AromaticContact CE1-CE1 3.65Å; Y467-Y486 HydrophobicContact CE1-CE1 3.65Å; Y467-Y486 HydrophobicContact CE1-CG 4.26Å; Y467-Y486 AromaticContact CE2-CD1 3.72Å; Y467-Y486 HydrophobicContact CE2-CD1 3.72Å; Y467-Y486 HydrophobicContact CE2-CD2 4.46Å; Y467-Y486 HydrophobicContact CE2-CE1 4.44Å; Y467-Y486 AromaticContact CE2-CG 3.72Å; Y467-Y486 HydrophobicContact CE2-CG 3.72Å; Y467-Y486 AromaticContact CG-CD1 3.99Å; Y467-Y486 HydrophobicContact CG-CD1 3.99Å; Y467-Y486 AromaticContact CG-CD2 3.49Å; Y467-Y486 HydrophobicContact CG-CD2 3.49Å; Y467-Y486 VanDerWaalsContact CG-CD2 3.49Å; Y467-Y486 HydrophobicContact CG-CE1 4.23Å; Y467-Y486 AromaticContact CG-CE2 3.76Å; Y467-Y486 HydrophobicContact CG-CE2 3.76Å; Y467-Y486 AromaticContact CG-CG 3.6Å; Y467-Y486 HydrophobicContact CG-CG 3.6Å; Y467-Y486 AromaticContact CZ-CD1 3.67Å; D482-Y486 PolarHBondContact O-N 2.72Å; H483-Y486 WeakPolarHBondContact O-CB 3.35Å; H483-Y486 PolarHBondContact O-N 3.2Å; Y486-L488 VanDerWaalsContact C-N 3.33Å; Y486-L488 PolarHBondContact O-N 2.87Å; Y486-L489 PolarHBondContact O-N 3.38Å; Y486-K490 HydrophobicContact CE1-CD 4.2Å; Y486-K490 HydrophobicContact CE2-CB 4.44Å; Y486-K490 HydrophobicContact CE2-CD 4.06Å; Y486-K490 VanDerWaalsContact O-CB 3.23Å; Y486-K490 WeakPolarHBondContact O-CB 3.43Å; Y486-K490 PolarHBondContact O-N 3.28Å; Y486-K490 VanDerWaalsContact OH-CD 3.23Å; Y486-K490 WeakPolarHBondContact OH-CD 3.39Å; Y486-K490 PolarHBondContact OH-NZ 2.85Å; Y486-K490 VanDerWaalsContact OH-NZ 3.14Å
487	L	98.2	Very high	93.9	Very high	4 Å²	4	18.8 Å²	18.8	2%	0.021	11%	0.107	C	C	.	.	H	α-helix	trans	-60.2	-43.1	-179.7	-69	176.1	0	0	0	111.5	H483 C484 L485 A491 L506 E509 I510	H483-L487 WeakPolarHBondContact O-CG 3.18Å; H483-L487 PolarHBondContact O-N 2.92Å; C484-L487 PolarHBondContact O-N 3.34Å; L485-L487 PolarHBondContact O-N 3.09Å; L487-A491 VanDerWaalsContact O-CB 3.26Å; L487-A491 WeakPolarHBondContact O-CB 3.41Å; L487-A491 PolarHBondContact O-N 3.43Å; L487-L506 HydrophobicContact CB-CB 4.48Å; L487-L506 HydrophobicContact CD2-CB 4.32Å; L487-L506 HydrophobicContact CD2-CD2 3.68Å; L487-L506 HydrophobicContact CD2-CG 4.47Å; L487-E509 HydrophobicContact CD1-CB 4.23Å; L487-E509 HydrophobicContact CD1-CG 3.95Å; L487-I510 HydrophobicContact CB-CD1 3.77Å; L487-I510 HydrophobicContact CB-CG1 3.75Å; L487-I510 HydrophobicContact CD1-CG1 3.85Å; L487-I510 HydrophobicContact CG-CG1 4.48Å
488	L	98.3	Very high	95	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-61	-54.3	178.6	177.5	63.5	0	0	0	111	Y441 C484 L485 Y486 K490 A491 M492 L507 I510 L541 N544 E548	Y441-L488 HydrophobicContact CD1-CD2 4.29Å; Y441-L488 HydrophobicContact CE1-CD2 4.01Å; Y441-L488 HydrophobicContact CE2-CD1 4.37Å; C484-L488 WeakPolarHBondContact O-CB 3.45Å; C484-L488 PolarHBondContact O-N 2.95Å; L485-L488 PolarHBondContact O-N 2.96Å; Y486-L488 VanDerWaalsContact C-N 3.33Å; Y486-L488 PolarHBondContact O-N 2.87Å; L488-K490 PolarHBondContact O-N 2.9Å; L488-A491 WeakPolarHBondContact O-CB 3.36Å; L488-A491 PolarHBondContact O-N 3.41Å; L488-M492 WeakPolarHBondContact O-CG 3.31Å; L488-M492 PolarHBondContact O-N 3.49Å; L488-L507 HydrophobicContact CD1-CD2 3.75Å; L488-I510 HydrophobicContact CB-CD1 3.99Å; L488-L541 HydrophobicContact CD2-CD2 3.75Å; L488-N544 HydrophobicContact CD2-CB 4.45Å; L488-E548 HydrophobicContact CD1-CG 4.27Å
489	L	98.5	Very high	95.6	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-67.5	-37.2	-176	-61.5	176.9	0	0	0	112	I434 Y441 Y446 I463 L485 Y486 M492 C493	I434-L489 HydrophobicContact CD1-CD1 3.53Å; I434-L489 HydrophobicContact CG1-CD1 4.15Å; Y441-L489 HydrophobicContact CG-CD2 4.23Å; Y446-L489 HydrophobicContact CE2-CD2 4.01Å; I463-L489 HydrophobicContact CD1-CB 4.05Å; L485-L489 HydrophobicContact CD1-CD1 3.8Å; L485-L489 HydrophobicContact CD1-CD2 4.49Å; L485-L489 HydrophobicContact CD1-CG 3.98Å; L485-L489 HydrophobicContact CG-CD1 4.02Å; L485-L489 WeakPolarHBondContact O-CG 3.42Å; L485-L489 PolarHBondContact O-N 2.84Å; Y486-L489 PolarHBondContact O-N 3.38Å; L489-M492 WeakPolarHBondContact O-CB 3.16Å; L489-M492 PolarHBondContact O-N 3.39Å; L489-C493 PolarHBondContact O-N 3.31Å; L489-C493 VanDerWaalsContact O-N 3.11Å
490	K	98.6	Very high	95.9	Very high	39 Å²	39	25.5 Å²	25.5	17%	0.17	13%	0.131	C	C	.	.	H	α-helix	trans	-63.1	-41.9	171.9	178	165.8	172.7	165.8	0	111.8	L460 E464 Y486 L488 M492 C493 L494 L506	L460-K490 HydrophobicContact CD1-CB 4.34Å; L460-K490 HydrophobicContact CD1-CD 4.29Å; L460-K490 HydrophobicContact CD1-CG 3.78Å; E464-K490 VanDerWaalsContact OE1-CE 3.23Å; E464-K490 WeakPolarHBondContact OE1-CE 3.44Å; E464-K490 IonicContact OE1-NZ 2.73Å; E464-K490 PolarHBondContact OE1-NZ 3.47Å; Y486-K490 HydrophobicContact CE1-CD 4.2Å; Y486-K490 HydrophobicContact CE2-CB 4.44Å; Y486-K490 HydrophobicContact CE2-CD 4.06Å; Y486-K490 VanDerWaalsContact O-CB 3.23Å; Y486-K490 WeakPolarHBondContact O-CB 3.43Å; Y486-K490 PolarHBondContact O-N 3.28Å; Y486-K490 VanDerWaalsContact OH-CD 3.23Å; Y486-K490 WeakPolarHBondContact OH-CD 3.39Å; Y486-K490 PolarHBondContact OH-NZ 2.85Å; Y486-K490 VanDerWaalsContact OH-NZ 3.14Å; L488-K490 PolarHBondContact O-N 2.9Å; K490-M492 VanDerWaalsContact C-N 3.27Å; K490-M492 PolarHBondContact O-N 3.48Å; K490-C493 PolarHBondContact O-N 3.43Å; K490-L494 HydrophobicContact CG-CD1 4.02Å; K490-L494 HydrophobicContact CG-CG 4.33Å; K490-L494 WeakPolarHBondContact O-CG 3.47Å; K490-L494 PolarHBondContact O-N 2.67Å; K490-L506 HydrophobicContact CB-CD1 4.11Å; K490-L506 HydrophobicContact CD-CD1 3.98Å; K490-L506 HydrophobicContact CG-CD1 3.62Å
491	A	98.5	Very high	96.2	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.008	15%	0.149	C	C	.	.	H	α-helix	trans	-60.2	-38.8	174.9	0	0	0	0	0	111.7	L487 L488 L494 K495 A503 L506 L507	L487-A491 VanDerWaalsContact O-CB 3.26Å; L487-A491 WeakPolarHBondContact O-CB 3.41Å; L487-A491 PolarHBondContact O-N 3.43Å; L488-A491 WeakPolarHBondContact O-CB 3.36Å; L488-A491 PolarHBondContact O-N 3.41Å; A491-L494 PolarHBondContact O-N 3.26Å; A491-K495 VanDerWaalsContact O-CB 3.3Å; A491-K495 WeakPolarHBondContact O-CB 3.46Å; A491-K495 PolarHBondContact O-N 3.04Å; A491-A503 HydrophobicContact CB-CB 4.15Å; A491-A503 VanDerWaalsContact O-CB 3.27Å; A491-A503 WeakPolarHBondContact O-CB 3.3Å; A491-L506 HydrophobicContact CB-CB 4.18Å; A491-L506 HydrophobicContact CB-CD1 4.38Å; A491-L507 HydrophobicContact CB-CD1 4.28Å; A491-L507 HydrophobicContact CB-CD2 3.9Å; A491-L507 HydrophobicContact CB-CG 3.74Å
492	M	97.5	Very high	96.5	Very high	7 Å²	7	34.4 Å²	34.4	3%	0.034	17%	0.168	C	C	.	.	H	α-helix	trans	-62.2	-44.7	174.9	-61.6	-48.2	-64.9	0	0	112.2	Y441 Y446 L488 L489 K490 K495 H496 E548	Y441-M492 HydrophobicContact CD2-CG 3.88Å; Y441-M492 HydrophobicContact CD2-SD 4.41Å; Y441-M492 HydrophobicContact CE2-CE 4.25Å; Y441-M492 HydrophobicContact CE2-CG 3.97Å; Y441-M492 HydrophobicContact CE2-SD 3.93Å; Y446-M492 HydrophobicContact CD1-CB 3.48Å; Y446-M492 VanDerWaalsContact CD1-CB 3.48Å; Y446-M492 HydrophobicContact CD2-CB 4.45Å; Y446-M492 HydrophobicContact CE1-CB 3.8Å; Y446-M492 HydrophobicContact CG-CB 3.84Å; Y446-M492 HydrophobicContact CG-CG 4.46Å; L488-M492 WeakPolarHBondContact O-CG 3.31Å; L488-M492 PolarHBondContact O-N 3.49Å; L489-M492 WeakPolarHBondContact O-CB 3.16Å; L489-M492 PolarHBondContact O-N 3.39Å; K490-M492 VanDerWaalsContact C-N 3.27Å; K490-M492 PolarHBondContact O-N 3.48Å; M492-K495 HydrophobicContact CE-CD 4.41Å; M492-H496 PolarHBondContact O-CD2 2.86Å; M492-H496 PolarHBondContact O-N 3.48Å; M492-E548 HydrophobicContact SD-CB 4.43Å; M492-E548 VanDerWaalsContact SD-CD 3.59Å; M492-E548 HydrophobicContact SD-CG 3.7Å
493	C	98.4	Very high	96.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.3	-49.3	173.7	-66.5	0	0	0	0	111.7	V456 L460 L489 K490 K495 H496 L497	V456-C493 HydrophobicContact CG1-CB 3.88Å; L460-C493 HydrophobicContact CB-CB 3.95Å; L460-C493 HydrophobicContact CD1-CB 4.01Å; L460-C493 HydrophobicContact CD2-CB 4.28Å; L460-C493 HydrophobicContact CG-CB 4.3Å; L489-C493 PolarHBondContact O-N 3.31Å; L489-C493 VanDerWaalsContact O-N 3.11Å; K490-C493 PolarHBondContact O-N 3.43Å; C493-K495 VanDerWaalsContact C-N 3.34Å; C493-K495 PolarHBondContact O-N 3.02Å; C493-H496 PolarHBondContact O-N 3.04Å; C493-H496 VanDerWaalsContact O-N 3.13Å; C493-L497 WeakPolarHBondContact O-CG 3.2Å; C493-L497 PolarHBondContact O-N 3.09Å
494	L	98.1	Very high	96.9	Very high	15 Å²	15	33.6 Å²	33.6	8%	0.079	16%	0.164	C	C	.	.	H	α-helix	trans	-63.9	-37.1	-178.1	-69.9	176.3	0	0	0	112.9	L460 K490 A491 H496 L497 S499 Q502 A503 L506	L460-L494 HydrophobicContact CD2-CD2 4.22Å; K490-L494 HydrophobicContact CG-CD1 4.02Å; K490-L494 HydrophobicContact CG-CG 4.33Å; K490-L494 WeakPolarHBondContact O-CG 3.47Å; K490-L494 PolarHBondContact O-N 2.67Å; A491-L494 PolarHBondContact O-N 3.26Å; L494-H496 VanDerWaalsContact C-N 3.28Å; L494-H496 PolarHBondContact O-N 2.67Å; L494-L497 PolarHBondContact O-N 3.34Å; L494-S499 CarbonylContact O-C 3.6Å; L494-S499 WeakPolarHBondContact O-CA 3.32Å; L494-S499 WeakPolarHBondContact O-CB 3.42Å; L494-S499 PolarHBondContact O-N 3.29Å; L494-Q502 HydrophobicContact CD1-CB 3.94Å; L494-A503 HydrophobicContact CB-CB 4.09Å; L494-L506 HydrophobicContact CD1-CD1 3.64Å
495	K	95.7	Very high	97	Very high	36 Å²	36	38.4 Å²	38.4	16%	0.157	19%	0.187	C	C	.	.	H	α-helix	trans	-54.6	-46.9	172.4	173	178.9	-178.8	180	0	110.7	A491 M492 C493 Q498 A503 E548 L552	A491-K495 VanDerWaalsContact O-CB 3.3Å; A491-K495 WeakPolarHBondContact O-CB 3.46Å; A491-K495 PolarHBondContact O-N 3.04Å; M492-K495 HydrophobicContact CE-CD 4.41Å; C493-K495 VanDerWaalsContact C-N 3.34Å; C493-K495 PolarHBondContact O-N 3.02Å; K495-Q498 PolarHBondContact O-N 2.9Å; K495-A503 HydrophobicContact CB-CB 4.13Å; K495-E548 IonicContact NZ-OE2 2.96Å; K495-L552 HydrophobicContact CB-CD2 4.28Å; K495-L552 HydrophobicContact CD-CD2 3.77Å; K495-L552 HydrophobicContact CD-CG 4.47Å; K495-L552 HydrophobicContact CG-CD2 3.73Å
496	H	94.7	Very high	97.1	Very high	44 Å²	44	39.6 Å²	39.6	20%	0.204	19%	0.193	C	C	.	.	H	α-helix	trans	-78.7	-20.8	-179.1	-72.9	-67.8	0	0	0	114.1	Y446 G450 V456 M492 C493 L494 Q498	Y446-H496 PolarHBondContact O-CD2 3.38Å; Y446-H496 PolarHBondContact O-NE2 3.17Å; Y446-H496 VanDerWaalsContact O-NE2 3.14Å; G450-H496 VanDerWaalsContact CA-CG 3.48Å; V456-H496 HydrophobicContact CG2-CB 4.39Å; M492-H496 PolarHBondContact O-CD2 2.86Å; M492-H496 PolarHBondContact O-N 3.48Å; C493-H496 PolarHBondContact O-N 3.04Å; C493-H496 VanDerWaalsContact O-N 3.13Å; L494-H496 VanDerWaalsContact C-N 3.28Å; L494-H496 PolarHBondContact O-N 2.67Å; H496-Q498 PolarHBondContact O-N 3.43Å
497	L	96.6	Very high	97	Very high	37 Å²	37	38.9 Å²	38.9	19%	0.194	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	13.5	170.7	-68.3	172	0	0	0	114.1	K453 V456 L457 L460 C493 L494 S499	K453-L497 HydrophobicContact CG-CD2 4.13Å; V456-L497 HydrophobicContact CB-CD2 4.06Å; V456-L497 HydrophobicContact CB-CG 4.36Å; V456-L497 HydrophobicContact CG1-CD1 3.96Å; V456-L497 HydrophobicContact CG1-CD2 3.84Å; V456-L497 HydrophobicContact CG1-CG 3.59Å; L457-L497 HydrophobicContact CD2-CD1 3.9Å; L457-L497 HydrophobicContact CD2-CD2 3.87Å; L457-L497 HydrophobicContact CG-CD2 3.98Å; L460-L497 HydrophobicContact CD2-CD1 3.72Å; C493-L497 WeakPolarHBondContact O-CG 3.2Å; C493-L497 PolarHBondContact O-N 3.09Å; L494-L497 PolarHBondContact O-N 3.34Å; L497-S499 VanDerWaalsContact C-N 3.27Å; L497-S499 PolarHBondContact O-N 3.16Å
498	Q	93.9	Very high	96.9	Very high	164 Å²	164	41.1 Å²	41.1	77%	0.766	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.7	29.3	-177.5	-52.2	-62.3	-44.5	0	0	113.7	K495 H496 P500	K495-Q498 PolarHBondContact O-N 2.9Å; H496-Q498 PolarHBondContact O-N 3.43Å; Q498-P500 WeakPolarHBondContact O-CD 3.33Å
499	S	96	Very high	96.7	Very high	37 Å²	37	45 Å²	45	26%	0.259	22%	0.22	S	C	.	.			trans	-113	56.2	173.4	-64.2	0	0	0	0	112	L494 L497 F501 Q502 A503	L494-S499 CarbonylContact O-C 3.6Å; L494-S499 WeakPolarHBondContact O-CA 3.32Å; L494-S499 WeakPolarHBondContact O-CB 3.42Å; L494-S499 PolarHBondContact O-N 3.29Å; L497-S499 VanDerWaalsContact C-N 3.27Å; L497-S499 PolarHBondContact O-N 3.16Å; S499-F501 VanDerWaalsContact C-N 3.28Å; S499-F501 PolarHBondContact O-N 3.32Å; S499-Q502 PolarHBondContact O-N 2.92Å; S499-A503 PolarHBondContact O-N 3.44Å
500	P	94.1	Very high	96.5	Very high	58 Å²	58	45 Å²	45	38%	0.377	22%	0.22	S	C	.	.	H	α-helix	trans	-64.1	-30.6	-173.1	27.3	-35.9	0	0	0	113.2	Q498 A503 E504 L552	Q498-P500 WeakPolarHBondContact O-CD 3.33Å; P500-A503 PolarHBondContact O-N 2.88Å; P500-E504 VanDerWaalsContact O-CB 3.32Å; P500-E504 WeakPolarHBondContact O-CB 3.44Å; P500-E504 PolarHBondContact O-N 3.16Å; P500-L552 HydrophobicContact CB-CD2 4.06Å
501	F	95.7	Very high	96.2	Very high	133 Å²	133	43.3 Å²	43.3	58%	0.583	21%	0.213	S	C	*	.	H	α-helix	trans	-65.2	-44.6	176.7	179.5	-100.5	0	0	0	112	S499 E504 Q505	S499-F501 VanDerWaalsContact C-N 3.28Å; S499-F501 PolarHBondContact O-N 3.32Å; F501-E504 PolarHBondContact O-N 2.98Å; F501-Q505 HydrophobicContact CD1-CG 4.47Å; F501-Q505 HydrophobicContact CE1-CG 4.12Å; F501-Q505 VanDerWaalsContact CE1-NE2 3.29Å; F501-Q505 HydrophobicContact CZ-CG 4.25Å; F501-Q505 WeakPolarHBondContact O-CG 3.1Å; F501-Q505 PolarHBondContact O-N 2.98Å
502	Q	97.2	Very high	95.7	Very high	95 Å²	95	48 Å²	48	44%	0.444	24%	0.238	S	C	.	.	H	α-helix	trans	-66.7	-42.1	176.7	-64.8	177	-14.5	0	0	110.9	L494 S499 E504 Q505 L506	L494-Q502 HydrophobicContact CD1-CB 3.94Å; S499-Q502 PolarHBondContact O-N 2.92Å; Q502-E504 VanDerWaalsContact C-N 3.3Å; Q502-E504 PolarHBondContact O-N 2.81Å; Q502-Q505 PolarHBondContact O-N 2.78Å; Q502-L506 WeakPolarHBondContact O-CG 3.36Å; Q502-L506 PolarHBondContact O-N 3.35Å; Q502-L506 VanDerWaalsContact O-N 3.17Å
503	A	97.5	Very high	95.1	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-56.9	-45.9	173.9	0	0	0	0	0	111.4	A491 L494 K495 S499 P500 Q505 L506 L507 L552	A491-A503 HydrophobicContact CB-CB 4.15Å; A491-A503 VanDerWaalsContact O-CB 3.27Å; A491-A503 WeakPolarHBondContact O-CB 3.3Å; L494-A503 HydrophobicContact CB-CB 4.09Å; K495-A503 HydrophobicContact CB-CB 4.13Å; S499-A503 PolarHBondContact O-N 3.44Å; P500-A503 PolarHBondContact O-N 2.88Å; A503-Q505 PolarHBondContact O-N 3.31Å; A503-L506 PolarHBondContact O-N 3.2Å; A503-L507 WeakPolarHBondContact O-CG 3.41Å; A503-L507 PolarHBondContact O-N 2.77Å; A503-L507 VanDerWaalsContact O-N 3.09Å; A503-L552 HydrophobicContact CB-CD1 4.16Å
504	E	97.1	Very high	94	Very high	14 Å²	14	52 Å²	52	7%	0.065	26%	0.256	C	S	.	.	H	α-helix	trans	-59.6	-44.6	175.8	167.8	160.6	-135	0	0	112.4	P500 F501 Q502 L506 L507 L508 L549 L552 R553	P500-E504 VanDerWaalsContact O-CB 3.32Å; P500-E504 WeakPolarHBondContact O-CB 3.44Å; P500-E504 PolarHBondContact O-N 3.16Å; F501-E504 PolarHBondContact O-N 2.98Å; Q502-E504 VanDerWaalsContact C-N 3.3Å; Q502-E504 PolarHBondContact O-N 2.81Å; E504-L506 VanDerWaalsContact C-N 3.32Å; E504-L506 PolarHBondContact O-N 3.24Å; E504-L507 PolarHBondContact O-N 3.11Å; E504-L508 HydrophobicContact CG-CD1 3.74Å; E504-L508 HydrophobicContact CG-CG 4.11Å; E504-L508 WeakPolarHBondContact O-CB 3.35Å; E504-L508 WeakPolarHBondContact O-CG 3.44Å; E504-L508 PolarHBondContact O-N 3.28Å; E504-L549 HydrophobicContact CB-CD2 4.48Å; E504-L549 HydrophobicContact CG-CD2 3.96Å; E504-L552 HydrophobicContact CB-CD1 4.05Å; E504-R553 IonicContact OE1-CZ 3.32Å; E504-R553 IonicContact OE1-NE 3.01Å; E504-R553 PolarHBondContact OE1-NE 3.34Å; E504-R553 IonicContact OE1-NH1 2.76Å; E504-R553 PolarHBondContact OE1-NH1 2.82Å; E504-R553 IonicContact OE1-NH2 2.75Å; E504-R553 PolarHBondContact OE1-NH2 3.45Å; E504-R553 IonicContact OE2-CZ 3.81Å; E504-R553 IonicContact OE2-NE 3.7Å; E504-R553 IonicContact OE2-NH1 3.35Å; E504-R553 PolarHBondContact OE2-NH1 3.44Å; E504-R553 IonicContact OE2-NH2 3.63Å; E504-R553 PolarHBondContact OE2-NH2 2.86Å
505	Q	97.8	Very high	92.6	Very high	101 Å²	101	54.3 Å²	54.3	47%	0.472	27%	0.268	S	S	.	.	H	α-helix	trans	-58.4	-43.3	178.5	-73.5	179.9	-47	0	0	112.3	F501 Q502 A503 L508 E509	F501-Q505 HydrophobicContact CD1-CG 4.47Å; F501-Q505 HydrophobicContact CE1-CG 4.12Å; F501-Q505 VanDerWaalsContact CE1-NE2 3.29Å; F501-Q505 HydrophobicContact CZ-CG 4.25Å; F501-Q505 WeakPolarHBondContact O-CG 3.1Å; F501-Q505 PolarHBondContact O-N 2.98Å; Q502-Q505 PolarHBondContact O-N 2.78Å; A503-Q505 PolarHBondContact O-N 3.31Å; Q505-L508 PolarHBondContact O-N 3.16Å; Q505-E509 PolarHBondContact O-N 2.98Å
506	L	98.1	Very high	90.1	Very high	28 Å²	28	60.6 Å²	60.6	15%	0.147	29%	0.292	C	S	.	.	H	α-helix	trans	-65.8	-39.5	177.7	-60	177	0	0	0	111.9	L487 K490 A491 L494 Q502 A503 E504 E509 I510	L487-L506 HydrophobicContact CB-CB 4.48Å; L487-L506 HydrophobicContact CD2-CB 4.32Å; L487-L506 HydrophobicContact CD2-CD2 3.68Å; L487-L506 HydrophobicContact CD2-CG 4.47Å; K490-L506 HydrophobicContact CB-CD1 4.11Å; K490-L506 HydrophobicContact CD-CD1 3.98Å; K490-L506 HydrophobicContact CG-CD1 3.62Å; A491-L506 HydrophobicContact CB-CB 4.18Å; A491-L506 HydrophobicContact CB-CD1 4.38Å; L494-L506 HydrophobicContact CD1-CD1 3.64Å; Q502-L506 WeakPolarHBondContact O-CG 3.36Å; Q502-L506 PolarHBondContact O-N 3.35Å; Q502-L506 VanDerWaalsContact O-N 3.17Å; A503-L506 PolarHBondContact O-N 3.2Å; E504-L506 VanDerWaalsContact C-N 3.32Å; E504-L506 PolarHBondContact O-N 3.24Å; L506-E509 WeakPolarHBondContact O-CB 3.49Å; L506-E509 PolarHBondContact O-N 3.05Å; L506-I510 WeakPolarHBondContact O-CG1 3.38Å; L506-I510 PolarHBondContact O-N 3.49Å
507	L	97.6	Very high	87.6	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.01	31%	0.314	C	S	.	.	H	α-helix	trans	-69.5	-37.8	176.9	-64.8	167.7	0	0	0	112	L488 A491 A503 E504 E509 I510 V511 A545 E548 L549 L552	L488-L507 HydrophobicContact CD1-CD2 3.75Å; A491-L507 HydrophobicContact CB-CD1 4.28Å; A491-L507 HydrophobicContact CB-CD2 3.9Å; A491-L507 HydrophobicContact CB-CG 3.74Å; A503-L507 WeakPolarHBondContact O-CG 3.41Å; A503-L507 PolarHBondContact O-N 2.77Å; A503-L507 VanDerWaalsContact O-N 3.09Å; E504-L507 PolarHBondContact O-N 3.11Å; L507-E509 VanDerWaalsContact C-N 3.3Å; L507-I510 HydrophobicContact CD2-CD1 4.32Å; L507-I510 WeakPolarHBondContact O-CB 3.48Å; L507-I510 PolarHBondContact O-N 2.78Å; L507-V511 PolarHBondContact O-N 2.91Å; L507-V511 VanDerWaalsContact O-N 3.16Å; L507-A545 HydrophobicContact CD2-CB 4.23Å; L507-E548 HydrophobicContact CD1-CB 3.75Å; L507-E548 HydrophobicContact CD2-CB 4.17Å; L507-L549 HydrophobicContact CB-CD1 4.15Å; L507-L549 HydrophobicContact CB-CD2 3.65Å; L507-L549 HydrophobicContact CB-CG 3.66Å; L507-L549 HydrophobicContact CD1-CD2 4.18Å; L507-L549 HydrophobicContact CD1-CG 4.16Å; L507-L552 HydrophobicContact CD1-CD1 3.64Å
508	L	95.5	Very high	84.8	Confident	52 Å²	52	66.9 Å²	66.9	27%	0.272	33%	0.325	S	S	.	.	H	α-helix	trans	-62.6	-38.2	173.1	-75	174.4	0	0	0	111.5	E504 Q505 I510 V511 N512 L549 F565	E504-L508 HydrophobicContact CG-CD1 3.74Å; E504-L508 HydrophobicContact CG-CG 4.11Å; E504-L508 WeakPolarHBondContact O-CB 3.35Å; E504-L508 WeakPolarHBondContact O-CG 3.44Å; E504-L508 PolarHBondContact O-N 3.28Å; Q505-L508 PolarHBondContact O-N 3.16Å; L508-I510 VanDerWaalsContact C-N 3.35Å; L508-I510 PolarHBondContact O-N 3.29Å; L508-V511 HydrophobicContact CD2-CG2 4.28Å; L508-V511 WeakPolarHBondContact O-CG2 3.42Å; L508-V511 PolarHBondContact O-N 3.33Å; L508-N512 WeakPolarHBondContact O-CB 3.39Å; L508-N512 PolarHBondContact O-N 3.13Å; L508-N512 PolarHBondContact O-ND2 3Å; L508-N512 VanDerWaalsContact O-ND2 3.17Å; L508-L549 HydrophobicContact CD2-CD1 4.08Å; L508-L549 HydrophobicContact CD2-CD2 4.18Å; L508-L549 HydrophobicContact CG-CD2 4.05Å; L508-F565 HydrophobicContact CD2-CZ 4.26Å
509	E	94.6	Very high	81.9	Confident	82 Å²	82	66 Å²	66	38%	0.383	32%	0.324	S	S	.	.	H	α-helix	trans	-58.9	-45.2	173.9	-174.6	-179.2	161.3	0	0	111.6	H483 L487 Q505 L506 L507 N512 K513	H483-E509 IonicContact CE1-OE1 2.76Å; H483-E509 IonicContact NE2-OE1 3.85Å; H483-E509 PolarHBondContact NE2-OE1 2.69Å; L487-E509 HydrophobicContact CD1-CB 4.23Å; L487-E509 HydrophobicContact CD1-CG 3.95Å; Q505-E509 PolarHBondContact O-N 2.98Å; L506-E509 WeakPolarHBondContact O-CB 3.49Å; L506-E509 PolarHBondContact O-N 3.05Å; L507-E509 VanDerWaalsContact C-N 3.3Å; E509-N512 PolarHBondContact O-N 3.02Å; E509-K513 VanDerWaalsContact O-CB 3.25Å; E509-K513 WeakPolarHBondContact O-CB 3.41Å; E509-K513 PolarHBondContact O-N 3.21Å
510	I	93.9	Very high	79.2	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-57.2	-55.5	175.8	-60.7	168.2	0	0	0	110.1	C484 L487 L488 L506 L507 L508 N512 K513 L514 A545	C484-I510 HydrophobicContact CB-CG1 4.36Å; C484-I510 HydrophobicContact CB-CG2 4.21Å; C484-I510 WeakPolarHBondContact O-CD1 3.24Å; L487-I510 HydrophobicContact CB-CD1 3.77Å; L487-I510 HydrophobicContact CB-CG1 3.75Å; L487-I510 HydrophobicContact CD1-CG1 3.85Å; L487-I510 HydrophobicContact CG-CG1 4.48Å; L488-I510 HydrophobicContact CB-CD1 3.99Å; L506-I510 WeakPolarHBondContact O-CG1 3.38Å; L506-I510 PolarHBondContact O-N 3.49Å; L507-I510 HydrophobicContact CD2-CD1 4.32Å; L507-I510 WeakPolarHBondContact O-CB 3.48Å; L507-I510 PolarHBondContact O-N 2.78Å; L508-I510 VanDerWaalsContact C-N 3.35Å; L508-I510 PolarHBondContact O-N 3.29Å; I510-N512 VanDerWaalsContact C-N 3.35Å; I510-N512 PolarHBondContact O-N 3.46Å; I510-K513 PolarHBondContact O-N 3.35Å; I510-L514 HydrophobicContact CG2-CD1 3.82Å; I510-L514 WeakPolarHBondContact O-CG 3.43Å; I510-L514 PolarHBondContact O-N 3.49Å; I510-L514 VanDerWaalsContact O-N 3.17Å; I510-A545 HydrophobicContact CB-CB 4.15Å; I510-A545 HydrophobicContact CD1-CB 4.17Å; I510-A545 HydrophobicContact CG2-CB 3.9Å
511	V	91.3	Very high	76.6	Confident	3 Å²	3	68.7 Å²	68.7	2%	0.018	34%	0.343	C	S	.	.	H	α-helix	trans	-68.2	-33.9	-174.8	-59.2	0	0	0	0	112.5	L507 L508 L514 N515 A545 Y546 L549	L507-V511 PolarHBondContact O-N 2.91Å; L507-V511 VanDerWaalsContact O-N 3.16Å; L508-V511 HydrophobicContact CD2-CG2 4.28Å; L508-V511 WeakPolarHBondContact O-CG2 3.42Å; L508-V511 PolarHBondContact O-N 3.33Å; V511-L514 PolarHBondContact O-N 3.3Å; V511-N515 VanDerWaalsContact O-CB 3.24Å; V511-N515 WeakPolarHBondContact O-CB 3.5Å; V511-N515 VanDerWaalsContact O-CG 3.3Å; V511-N515 PolarHBondContact O-N 3.14Å; V511-N515 PolarHBondContact O-ND2 3.32Å; V511-A545 HydrophobicContact CG1-CB 3.95Å; V511-Y546 HydrophobicContact CB-CE1 4.03Å; V511-Y546 HydrophobicContact CB-CE2 4.13Å; V511-Y546 HydrophobicContact CG1-CD1 3.96Å; V511-Y546 HydrophobicContact CG1-CD2 3.9Å; V511-Y546 HydrophobicContact CG1-CE1 3.8Å; V511-Y546 HydrophobicContact CG1-CE2 3.7Å; V511-Y546 HydrophobicContact CG1-CG 4.03Å; V511-Y546 HydrophobicContact CG2-CE1 4.38Å; V511-L549 HydrophobicContact CG1-CD1 4.12Å; V511-L549 HydrophobicContact CG2-CD1 4.12Å
512	N	88.8	Confident	73.9	Confident	99 Å²	99	67.7 Å²	67.7	53%	0.529	35%	0.348	S	S	.	.	H	α-helix	trans	-67.4	-41.4	176.2	-73.6	-22.7	0	0	0	111.6	L508 E509 I510 L514 N515 Y516	L508-N512 WeakPolarHBondContact O-CB 3.39Å; L508-N512 PolarHBondContact O-N 3.13Å; L508-N512 PolarHBondContact O-ND2 3Å; L508-N512 VanDerWaalsContact O-ND2 3.17Å; E509-N512 PolarHBondContact O-N 3.02Å; I510-N512 VanDerWaalsContact C-N 3.35Å; I510-N512 PolarHBondContact O-N 3.46Å; N512-L514 PolarHBondContact O-N 3.09Å; N512-N515 PolarHBondContact O-N 3.23Å; N512-Y516 PolarHBondContact O-N 2.97Å
513	K	84.1	Confident	71.3	Confident	75 Å²	75	72.1 Å²	72.1	33%	0.326	37%	0.366	S	S	.	.	H	α-helix	trans	-62.5	-29.9	175.9	-163.9	172.8	-173.3	-173.2	0	112	T480 E509 I510	T480-K513 HydrophobicContact CG2-CD 4.31Å; E509-K513 VanDerWaalsContact O-CB 3.25Å; E509-K513 WeakPolarHBondContact O-CB 3.41Å; E509-K513 PolarHBondContact O-N 3.21Å; I510-K513 PolarHBondContact O-N 3.35Å
514	L	76.6	Confident	68.4	Low	17 Å²	17	76.1 Å²	76.1	9%	0.089	39%	0.393	C	S	.	.	H	α-helix	trans	-93.6	-20.3	-178.5	-59.1	175.4	0	0	0	114.3	I510 V511 N512 L535 A542	I510-L514 HydrophobicContact CG2-CD1 3.82Å; I510-L514 WeakPolarHBondContact O-CG 3.43Å; I510-L514 PolarHBondContact O-N 3.49Å; I510-L514 VanDerWaalsContact O-N 3.17Å; V511-L514 PolarHBondContact O-N 3.3Å; N512-L514 PolarHBondContact O-N 3.09Å; L514-L535 HydrophobicContact CD1-CD1 3.56Å; L514-L535 HydrophobicContact CD1-CG 4.2Å; L514-L535 HydrophobicContact CD2-CD1 3.88Å; L514-L535 HydrophobicContact CD2-CD2 4.41Å; L514-L535 HydrophobicContact CD2-CG 3.6Å; L514-L535 HydrophobicContact CG-CD1 4.39Å; L514-A542 HydrophobicContact CD1-CB 3.52Å
515	N	68.2	Low	65.3	Low	64 Å²	64	83.8 Å²	83.8	34%	0.342	43%	0.433	S	S	.	.	H	α-helix	trans	-87.4	-8.6	177.5	-83	-16.3	0	0	0	114	V511 N512 P517 Y546	V511-N515 VanDerWaalsContact O-CB 3.24Å; V511-N515 WeakPolarHBondContact O-CB 3.5Å; V511-N515 VanDerWaalsContact O-CG 3.3Å; V511-N515 PolarHBondContact O-N 3.14Å; V511-N515 PolarHBondContact O-ND2 3.32Å; N512-N515 PolarHBondContact O-N 3.23Å; N515-P517 WeakPolarHBondContact O-CD 3.36Å; N515-Y546 PolarHBondContact ND2-OH 2.94Å; N515-Y546 PolarHBondContact OD1-OH 3.09Å
516	Y	43.8	Very low	62.3	Low	168 Å²	168	85.6 Å²	85.6	66%	0.659	45%	0.446	S	S	*	.			trans	-58.9	110.8	-176.2	-152.4	-90	0	0	0	110	N512 R518	N512-Y516 PolarHBondContact O-N 2.97Å; Y516-R518 PolarHBondContact O-N 3.36Å; Y516-R518 VanDerWaalsContact O-N 3.16Å
517	P	41.2	Very low	59.2	Low	100 Å²	100	93.6 Å²	93.6	65%	0.649	48%	0.483	S	S	*	.			trans	-67.7	116.9	168.1	4.8	10.4	0	0	0	105.3	N515 L519	N515-P517 WeakPolarHBondContact O-CD 3.36Å; P517-L519 PolarHBondContact O-N 3.09Å; P517-L519 VanDerWaalsContact O-N 3.17Å
518	R	38.3	Very low	56.3	Low	112 Å²	112	97.7 Å²	97.7	42%	0.423	52%	0.517	S	S	.	.			trans	-59.7	128	169.9	-65.2	-177.8	-153.5	-160.3	2.9	106.3	Y516 A520 D521 K532 D534	Y516-R518 PolarHBondContact O-N 3.36Å; Y516-R518 VanDerWaalsContact O-N 3.16Å; R518-A520 PolarHBondContact O-N 3.13Å; R518-D521 PolarHBondContact O-N 3.49Å; R518-K532 PolarHBondContact NH2-O 2.7Å; R518-D534 IonicContact CZ-OD1 3.3Å; R518-D534 IonicContact NH2-OD1 3.02Å; R518-D534 PolarHBondContact NH2-OD1 3.15Å
519	L	31.9	Very low	53.4	Low	145 Å²	145	99 Å²	99	76%	0.759	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-51.3	-11.5	173.5	-94.2	144.5	0	0	0	113.8	P517	P517-L519 PolarHBondContact O-N 3.09Å; P517-L519 VanDerWaalsContact O-N 3.17Å
520	A	39.2	Very low	50.7	Low	75 Å²	75	103.7 Å²	103.7	62%	0.62	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-76.6	-18.3	173	0	0	0	0	0	114.7	R518	R518-A520 PolarHBondContact O-N 3.13Å
521	D	40	Very low	48.1	Very low	77 Å²	77	111.3 Å²	111.3	41%	0.412	58%	0.575	S	S	.	*	G	3₁₀ helix	trans	-93.9	5.7	-175.8	-67.7	-28.2	0	0	0	113.8	R518 F523	R518-D521 PolarHBondContact O-N 3.49Å; D521-F523 VanDerWaalsContact C-N 3.27Å; D521-F523 PolarHBondContact O-N 3.4Å
522	V	40.3	Very low	45.7	Very low	112 Å²	112	118.7 Å²	118.7	68%	0.679	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-78.1	-10.6	173.5	179.8	0	0	0	0	112.4
523	F	41.2	Very low	43.9	Very low	188 Å²	188	116.9 Å²	116.9	83%	0.825	60%	0.596	S	S	*	*	S	Bend	trans	-113.8	7.6	-178.8	-82.6	-76.3	0	0	0	116.4	D521	D521-F523 VanDerWaalsContact C-N 3.27Å; D521-F523 PolarHBondContact O-N 3.4Å
524	C	36.5	Very low	42.8	Very low	84 Å²	84	116.2 Å²	116.2	57%	0.568	60%	0.596	S	S	*	*			trans	-122.3	80.7	176.7	-67.6	0	0	0	0	111.2	N526	C524-N526 VanDerWaalsContact C-N 3.3Å; C524-N526 PolarHBondContact O-N 3.44Å
525	L	32	Very low	42.2	Very low	176 Å²	176	115.8 Å²	115.8	92%	0.921	59%	0.593	S	S	*	*			trans	-63.2	90.2	157.8	-81.5	149.8	0	0	0	108.5
526	N	34.6	Very low	42.3	Very low	139 Å²	139	121.8 Å²	121.8	74%	0.743	62%	0.616	S	S	*	*			trans	-148.9	134.1	154.8	-92.4	-29.7	0	0	0	108.8	C524	C524-N526 VanDerWaalsContact C-N 3.3Å; C524-N526 PolarHBondContact O-N 3.44Å
527	E	33	Very low	43.9	Very low	195 Å²	195	117.1 Å²	117.1	91%	0.911	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.6	137.2	-173.5	-65	170.2	145.1	0	0	112.4
528	A	37.4	Very low	46.2	Very low	89 Å²	89	112.4 Å²	112.4	74%	0.736	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	68.2	37.2	174	0	0	0	0	0	117.7	F530	A528-F530 PolarHBondContact O-N 3.12Å
529	V	34.8	Very low	48.6	Very low	79 Å²	79	109.1 Å²	109.1	48%	0.479	57%	0.567	S	S	.	*			trans	-65.1	90.5	157.4	-176.8	0	0	0	0	108.3	R531	V529-R531 PolarHBondContact O-N 3.37Å
530	F	36.9	Very low	51.5	Low	181 Å²	181	102.2 Å²	102.2	79%	0.794	53%	0.531	S	S	*	.			trans	-47.2	115	162.5	-92.3	-98.2	0	0	0	107.3	A528 K532	A528-F530 PolarHBondContact O-N 3.12Å; F530-K532 PolarHBondContact O-N 3.15Å
531	R	40.8	Very low	54.2	Low	160 Å²	160	98.7 Å²	98.7	60%	0.604	50%	0.501	S	S	*	.			trans	-42.6	110.7	168.1	-61.1	-179	-163.8	167.9	10.3	106.4	V529 Q533 E571	V529-R531 PolarHBondContact O-N 3.37Å; R531-Q533 PolarHBondContact O-N 3.43Å; R531-E571 IonicContact NH2-OE2 3.96Å
532	K	40.5	Very low	56.7	Low	158 Å²	158	95 Å²	95	69%	0.687	48%	0.482	S	S	*	.			trans	-65.5	82.9	175.5	-79.6	-178.8	177.9	171.7	0	107.4	R518 F530 D534	R518-K532 PolarHBondContact NH2-O 2.7Å; F530-K532 PolarHBondContact O-N 3.15Å; K532-D534 PolarHBondContact O-N 2.99Å
533	Q	50.5	Low	59.2	Low	61 Å²	61	89.7 Å²	89.7	29%	0.285	45%	0.449	S	S	.	.			trans	-51.8	131.4	171.4	-69.5	178.3	0.2	0	0	107	R531 L535 F572	R531-Q533 PolarHBondContact O-N 3.43Å; Q533-L535 PolarHBondContact O-N 2.78Å; Q533-L535 VanDerWaalsContact O-N 3.16Å; Q533-F572 VanDerWaalsContact NE2-CE1 3.3Å
534	D	62.1	Low	61.8	Low	61 Å²	61	80.9 Å²	80.9	33%	0.326	41%	0.411	S	S	.	.	S	Bend	trans	-67.1	-10.6	176.2	-77.2	-23.3	0	0	0	112.4	T480 R518 K532 K536	T480-D534 HydrophobicContact CG2-CB 3.93Å; R518-D534 IonicContact CZ-OD1 3.3Å; R518-D534 IonicContact NH2-OD1 3.02Å; R518-D534 PolarHBondContact NH2-OD1 3.15Å; K532-D534 PolarHBondContact O-N 2.99Å; D534-K536 PolarHBondContact O-N 2.69Å
535	L	63.5	Low	64.6	Low	7 Å²	7	76.9 Å²	76.9	4%	0.037	38%	0.384	C	S	.	.			trans	-72.8	118.8	167.9	-65.9	171.4	0	0	0	109.9	T480 D481 C484 L514 Q533 L541 A542	T480-L535 HydrophobicContact CG2-CD2 4.31Å; D481-L535 HydrophobicContact CB-CD2 4.19Å; C484-L535 HydrophobicContact CB-CD2 4.34Å; L514-L535 HydrophobicContact CD1-CD1 3.56Å; L514-L535 HydrophobicContact CD1-CG 4.2Å; L514-L535 HydrophobicContact CD2-CD1 3.88Å; L514-L535 HydrophobicContact CD2-CD2 4.41Å; L514-L535 HydrophobicContact CD2-CG 3.6Å; L514-L535 HydrophobicContact CG-CD1 4.39Å; Q533-L535 PolarHBondContact O-N 2.78Å; Q533-L535 VanDerWaalsContact O-N 3.16Å; L535-L541 HydrophobicContact CD1-CB 4Å; L535-L541 HydrophobicContact CD2-CD1 3.86Å; L535-A542 HydrophobicContact CD1-CB 4.49Å
536	K	68.8	Low	67.6	Low	190 Å²	190	68.9 Å²	68.9	83%	0.826	34%	0.342	S	S	*	.	S	Bend	trans	-87.4	-31.4	-179.7	-67.5	-175.1	-179.9	-179.2	0	112.6	D481 D534	D481-K536 PolarHBondContact OD1-N 3.33Å; D481-K536 PolarHBondContact OD2-N 2.95Å; D534-K536 PolarHBondContact O-N 2.69Å
537	V	78.4	Confident	70.5	Confident	70 Å²	70	62.3 Å²	62.3	42%	0.424	31%	0.306	S	S	.	.	S	Bend	trans	-130.7	-49.4	-167.2	-174.4	0	0	0	0	111.2	Q424 D481 T539	Q424-V537 HydrophobicContact CB-CG1 4.34Å; Q424-V537 HydrophobicContact CG-CG1 4.13Å; D481-V537 PolarHBondContact OD1-N 2.88Å; V537-T539 VanDerWaalsContact C-N 3.34Å; V537-T539 PolarHBondContact O-N 3.24Å; V537-T539 VanDerWaalsContact O-N 3.13Å
538	N	88.6	Confident	73.5	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.005	26%	0.263	C	S	.	.			trans	-92.8	56.3	-170.4	-68.3	-22.4	0	0	0	112	Q424 D481 Y540 L541	Q424-N538 PolarHBondContact OE1-OD1 3.46Å; D481-N538 HydrophobicContact CB-CB 4.27Å; D481-N538 WeakPolarHBondContact OD1-CB 3.38Å; D481-N538 PolarHBondContact OD1-N 3.28Å; N538-Y540 HydrophobicContact CB-CD1 4.35Å; N538-Y540 HydrophobicContact CB-CE1 3.61Å; N538-Y540 HydrophobicContact CB-CE2 4.41Å; N538-Y540 WeakPolarHBondContact CB-OH 3.47Å; N538-Y540 PolarHBondContact ND2-OH 3.16Å; N538-Y540 PolarHBondContact O-N 3.42Å; N538-Y540 PolarHBondContact OD1-OH 2.88Å; N538-L541 HydrophobicContact CB-CD1 3.65Å; N538-L541 HydrophobicContact CB-CG 4.1Å; N538-L541 WeakPolarHBondContact O-CB 3Å; N538-L541 WeakPolarHBondContact O-CG 3.33Å; N538-L541 PolarHBondContact O-N 3.28Å; N538-L541 VanDerWaalsContact O-N 3.07Å
539	T	90.1	Very high	76.3	Confident	43 Å²	43	48.9 Å²	48.9	26%	0.264	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-12.2	-176.1	56.7	0	0	0	0	114.4	V537 L541 P543 Y575	V537-T539 VanDerWaalsContact C-N 3.34Å; V537-T539 PolarHBondContact O-N 3.24Å; V537-T539 VanDerWaalsContact O-N 3.13Å; T539-L541 VanDerWaalsContact C-N 3.26Å; T539-L541 PolarHBondContact O-N 3.06Å; T539-P543 WeakPolarHBondContact O-CD 3.4Å; T539-Y575 WeakPolarHBondContact OG1-CB 3.48Å
540	Y	92.6	Very high	79.1	Confident	1 Å²	1	45.1 Å²	45.1	0%	0.004	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-17.8	173.5	62.9	-103	0	0	0	113.2	F417 E438 F442 N538 A542 P543 N544 L576	F417-Y540 HydrophobicContact CE2-CE1 4.1Å; E438-Y540 VanDerWaalsContact OE1-CZ 3.25Å; E438-Y540 PolarHBondContact OE1-OH 3.08Å; F442-Y540 HydrophobicContact CE1-CD2 4.11Å; F442-Y540 HydrophobicContact CE1-CG 4.47Å; F442-Y540 HydrophobicContact CE2-CD2 4.37Å; F442-Y540 HydrophobicContact CE2-CE2 4.03Å; F442-Y540 HydrophobicContact CZ-CD1 4.26Å; F442-Y540 AromaticContact CZ-CD2 3.4Å; F442-Y540 HydrophobicContact CZ-CD2 3.4Å; F442-Y540 VanDerWaalsContact CZ-CD2 3.4Å; F442-Y540 HydrophobicContact CZ-CE1 4.33Å; F442-Y540 AromaticContact CZ-CE2 3.49Å; F442-Y540 HydrophobicContact CZ-CE2 3.49Å; F442-Y540 VanDerWaalsContact CZ-CE2 3.49Å; F442-Y540 AromaticContact CZ-CG 3.84Å; F442-Y540 HydrophobicContact CZ-CG 3.84Å; F442-Y540 AromaticContact CZ-CZ 3.99Å; N538-Y540 HydrophobicContact CB-CD1 4.35Å; N538-Y540 HydrophobicContact CB-CE1 3.61Å; N538-Y540 HydrophobicContact CB-CE2 4.41Å; N538-Y540 WeakPolarHBondContact CB-OH 3.47Å; N538-Y540 PolarHBondContact ND2-OH 3.16Å; N538-Y540 PolarHBondContact O-N 3.42Å; N538-Y540 PolarHBondContact OD1-OH 2.88Å; Y540-A542 VanDerWaalsContact C-N 3.34Å; Y540-A542 PolarHBondContact O-N 3.45Å; Y540-P543 VanDerWaalsContact O-CD 3.28Å; Y540-P543 WeakPolarHBondContact O-CD 3.47Å; Y540-P543 WeakPolarHBondContact O-CG 3.27Å; Y540-N544 WeakPolarHBondContact O-CB 3.45Å; Y540-N544 PolarHBondContact O-N 3.38Å; Y540-N544 PolarHBondContact O-ND2 3.02Å; Y540-L576 HydrophobicContact CD1-CB 4.31Å
541	L	94.8	Very high	81.8	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.4	-39.4	-175.3	-72.7	166.8	0	0	0	112.2	D481 C484 L485 L488 L535 N538 T539 A545	D481-L541 WeakPolarHBondContact O-CD1 3.32Å; C484-L541 HydrophobicContact CB-CD1 3.84Å; L485-L541 HydrophobicContact CB-CD1 4.42Å; L485-L541 HydrophobicContact CB-CD2 4.17Å; L485-L541 HydrophobicContact CD1-CD2 4.08Å; L488-L541 HydrophobicContact CD2-CD2 3.75Å; L535-L541 HydrophobicContact CD1-CB 4Å; L535-L541 HydrophobicContact CD2-CD1 3.86Å; N538-L541 HydrophobicContact CB-CD1 3.65Å; N538-L541 HydrophobicContact CB-CG 4.1Å; N538-L541 WeakPolarHBondContact O-CB 3Å; N538-L541 WeakPolarHBondContact O-CG 3.33Å; N538-L541 PolarHBondContact O-N 3.28Å; N538-L541 VanDerWaalsContact O-N 3.07Å; T539-L541 VanDerWaalsContact C-N 3.26Å; T539-L541 PolarHBondContact O-N 3.06Å; L541-A545 WeakPolarHBondContact O-CB 3.46Å; L541-A545 PolarHBondContact O-N 2.94Å
542	A	92.5	Very high	84.3	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-64.1	-55.1	-179.7	0	0	0	0	0	113.5	L514 L535 Y540 N544 A545 Y546 F572	L514-A542 HydrophobicContact CD1-CB 3.52Å; L535-A542 HydrophobicContact CD1-CB 4.49Å; Y540-A542 VanDerWaalsContact C-N 3.34Å; Y540-A542 PolarHBondContact O-N 3.45Å; A542-N544 VanDerWaalsContact C-N 3.27Å; A542-N544 PolarHBondContact O-N 3.29Å; A542-A545 PolarHBondContact O-N 2.76Å; A542-Y546 VanDerWaalsContact O-CD2 3.26Å; A542-Y546 WeakPolarHBondContact O-CD2 3.36Å; A542-Y546 PolarHBondContact O-N 3.09Å; A542-Y546 VanDerWaalsContact O-N 3.09Å; A542-F572 HydrophobicContact CB-CD1 4.04Å; A542-F572 HydrophobicContact CB-CE1 3.4Å; A542-F572 HydrophobicContact CB-CE2 4.49Å; A542-F572 HydrophobicContact CB-CZ 3.68Å
543	P	93.6	Very high	86.8	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-64	-32.5	178.5	23.9	-33.7	0	0	0	112.6	T539 Y540 Y546 L547 F572 Y575 V581	T539-P543 WeakPolarHBondContact O-CD 3.4Å; Y540-P543 VanDerWaalsContact O-CD 3.28Å; Y540-P543 WeakPolarHBondContact O-CD 3.47Å; Y540-P543 WeakPolarHBondContact O-CG 3.27Å; P543-Y546 PolarHBondContact O-N 2.91Å; P543-L547 WeakPolarHBondContact O-CB 3.49Å; P543-L547 PolarHBondContact O-N 3Å; P543-F572 HydrophobicContact CB-CB 3.98Å; P543-F572 HydrophobicContact CB-CD2 4.16Å; P543-F572 HydrophobicContact CB-CG 4.1Å; P543-F572 HydrophobicContact CG-CB 4.07Å; P543-F572 HydrophobicContact CG-CG 4.25Å; P543-Y575 HydrophobicContact CB-CE1 4.12Å; P543-Y575 HydrophobicContact CB-CE2 4.24Å; P543-Y575 HydrophobicContact CG-CD1 3.96Å; P543-Y575 HydrophobicContact CG-CD2 3.9Å; P543-Y575 HydrophobicContact CG-CE1 3.73Å; P543-Y575 HydrophobicContact CG-CE2 3.62Å; P543-Y575 HydrophobicContact CG-CG 4.07Å; P543-V581 HydrophobicContact CB-CG1 4.43Å
544	N	95.1	Very high	88.7	Confident	4 Å²	4	22.2 Å²	22.2	2%	0.021	11%	0.109	C	C	.	.	H	α-helix	trans	-68.2	-39.8	174.1	-80.3	-76.1	0	0	0	112.1	Y441 L488 Y540 A542 Y546 L547 E548 V581	Y441-N544 HydrophobicContact CE1-CB 4.02Å; Y441-N544 WeakPolarHBondContact CE1-OD1 3.39Å; Y441-N544 WeakPolarHBondContact OH-CB 3.17Å; Y441-N544 PolarHBondContact OH-OD1 3.3Å; Y441-N544 VanDerWaalsContact OH-OD1 3.12Å; L488-N544 HydrophobicContact CD2-CB 4.45Å; Y540-N544 WeakPolarHBondContact O-CB 3.45Å; Y540-N544 PolarHBondContact O-N 3.38Å; Y540-N544 PolarHBondContact O-ND2 3.02Å; A542-N544 VanDerWaalsContact C-N 3.27Å; A542-N544 PolarHBondContact O-N 3.29Å; N544-Y546 VanDerWaalsContact C-N 3.35Å; N544-Y546 PolarHBondContact O-N 3.28Å; N544-L547 WeakPolarHBondContact O-CB 3.35Å; N544-L547 PolarHBondContact O-N 3.35Å; N544-E548 WeakPolarHBondContact O-CG 3.38Å; N544-E548 PolarHBondContact O-N 3.33Å; N544-V581 WeakPolarHBondContact OD1-CG2 3.23Å
545	A	96.2	Very high	90	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-61.5	-42.4	174.1	0	0	0	0	0	112	L507 I510 V511 L541 A542 E548 L549	L507-A545 HydrophobicContact CD2-CB 4.23Å; I510-A545 HydrophobicContact CB-CB 4.15Å; I510-A545 HydrophobicContact CD1-CB 4.17Å; I510-A545 HydrophobicContact CG2-CB 3.9Å; V511-A545 HydrophobicContact CG1-CB 3.95Å; L541-A545 WeakPolarHBondContact O-CB 3.46Å; L541-A545 PolarHBondContact O-N 2.94Å; A542-A545 PolarHBondContact O-N 2.76Å; A545-E548 PolarHBondContact O-N 3.41Å; A545-L549 WeakPolarHBondContact O-CB 3.25Å; A545-L549 VanDerWaalsContact O-CG 3.31Å; A545-L549 WeakPolarHBondContact O-CG 3.5Å; A545-L549 PolarHBondContact O-N 3.49Å
546	Y	95.9	Very high	91.2	Very high	8 Å²	8	26.2 Å²	26.2	3%	0.031	14%	0.136	C	C	.	.	H	α-helix	trans	-63.5	-41.2	173.2	-79	-65.1	0	0	0	113.1	V511 N515 A542 P543 N544 L549 A550 F565 K568 F572	V511-Y546 HydrophobicContact CB-CE1 4.03Å; V511-Y546 HydrophobicContact CB-CE2 4.13Å; V511-Y546 HydrophobicContact CG1-CD1 3.96Å; V511-Y546 HydrophobicContact CG1-CD2 3.9Å; V511-Y546 HydrophobicContact CG1-CE1 3.8Å; V511-Y546 HydrophobicContact CG1-CE2 3.7Å; V511-Y546 HydrophobicContact CG1-CG 4.03Å; V511-Y546 HydrophobicContact CG2-CE1 4.38Å; N515-Y546 PolarHBondContact ND2-OH 2.94Å; N515-Y546 PolarHBondContact OD1-OH 3.09Å; A542-Y546 VanDerWaalsContact O-CD2 3.26Å; A542-Y546 WeakPolarHBondContact O-CD2 3.36Å; A542-Y546 PolarHBondContact O-N 3.09Å; A542-Y546 VanDerWaalsContact O-N 3.09Å; P543-Y546 PolarHBondContact O-N 2.91Å; N544-Y546 VanDerWaalsContact C-N 3.35Å; N544-Y546 PolarHBondContact O-N 3.28Å; Y546-L549 PolarHBondContact O-N 3.37Å; Y546-A550 WeakPolarHBondContact O-CB 3.5Å; Y546-A550 PolarHBondContact O-N 3.46Å; Y546-F565 AromaticContact CD1-CD1 3.66Å; Y546-F565 HydrophobicContact CD1-CD1 3.66Å; Y546-F565 HydrophobicContact CD1-CE1 4.34Å; Y546-F565 HydrophobicContact CD1-CG 4.48Å; Y546-F565 HydrophobicContact CE1-CD1 4Å; Y546-F565 HydrophobicContact CE1-CE1 4.37Å; Y546-K568 HydrophobicContact CD1-CB 3.66Å; Y546-K568 HydrophobicContact CD1-CG 4.48Å; Y546-K568 HydrophobicContact CD2-CB 4.3Å; Y546-K568 HydrophobicContact CE1-CB 3.6Å; Y546-K568 HydrophobicContact CE1-CG 4.04Å; Y546-K568 HydrophobicContact CE2-CB 4.27Å; Y546-K568 HydrophobicContact CG-CB 4Å; Y546-F572 HydrophobicContact CD2-CD2 4.49Å; Y546-F572 AromaticContact CD2-CE2 3.63Å; Y546-F572 HydrophobicContact CD2-CE2 3.63Å; Y546-F572 HydrophobicContact CD2-CZ 4.18Å; Y546-F572 AromaticContact CE2-CE2 3.51Å; Y546-F572 HydrophobicContact CE2-CE2 3.51Å; Y546-F572 AromaticContact CE2-CZ 3.75Å; Y546-F572 HydrophobicContact CE2-CZ 3.75Å
547	L	94.2	Very high	92.1	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-59.2	-47.4	174.9	169.4	63.6	0	0	0	111.4	P543 N544 A550 L551 V581 R584 L585 L588	P543-L547 WeakPolarHBondContact O-CB 3.49Å; P543-L547 PolarHBondContact O-N 3Å; N544-L547 WeakPolarHBondContact O-CB 3.35Å; N544-L547 PolarHBondContact O-N 3.35Å; L547-A550 WeakPolarHBondContact O-CB 3.44Å; L547-A550 PolarHBondContact O-N 2.9Å; L547-L551 HydrophobicContact CD1-CD1 4.23Å; L547-L551 HydrophobicContact CG-CD1 4.29Å; L547-L551 WeakPolarHBondContact O-CG 3.43Å; L547-L551 PolarHBondContact O-N 3.11Å; L547-V581 HydrophobicContact CD2-CG1 4.27Å; L547-R584 HydrophobicContact CD1-CB 3.98Å; L547-R584 HydrophobicContact CD2-CB 3.77Å; L547-R584 HydrophobicContact CD2-CG 4.45Å; L547-L585 HydrophobicContact CB-CD2 4.27Å; L547-L585 HydrophobicContact CD1-CD2 3.65Å; L547-L585 HydrophobicContact CD1-CG 4.08Å; L547-L588 HydrophobicContact CD1-CD2 4.28Å
548	E	95.6	Very high	92.6	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.009	14%	0.136	C	C	.	.	H	α-helix	trans	-68.3	-35.6	179.4	-62.6	-55.1	155.5	0	0	112.5	Y441 L488 M492 K495 L507 N544 A545 L551 L552 R584	Y441-E548 HydrophobicContact CE2-CG 4.25Å; Y441-E548 WeakPolarHBondContact CE2-OE1 3.49Å; Y441-E548 PolarHBondContact OH-OE1 3.3Å; L488-E548 HydrophobicContact CD1-CG 4.27Å; M492-E548 HydrophobicContact SD-CB 4.43Å; M492-E548 VanDerWaalsContact SD-CD 3.59Å; M492-E548 HydrophobicContact SD-CG 3.7Å; K495-E548 IonicContact NZ-OE2 2.96Å; L507-E548 HydrophobicContact CD1-CB 3.75Å; L507-E548 HydrophobicContact CD2-CB 4.17Å; N544-E548 WeakPolarHBondContact O-CG 3.38Å; N544-E548 PolarHBondContact O-N 3.33Å; A545-E548 PolarHBondContact O-N 3.41Å; E548-L551 PolarHBondContact O-N 3.29Å; E548-L551 WeakPolarHBondContact OE2-CD1 3.45Å; E548-L552 WeakPolarHBondContact O-CG 3.5Å; E548-L552 PolarHBondContact O-N 2.62Å; E548-R584 IonicContact OE1-CZ 3.58Å; E548-R584 VanDerWaalsContact OE1-CZ 3.27Å; E548-R584 IonicContact OE1-NH1 3.93Å; E548-R584 PolarHBondContact OE1-NH1 3.06Å; E548-R584 IonicContact OE1-NH2 3.18Å; E548-R584 PolarHBondContact OE1-NH2 3.01Å; E548-R584 IonicContact OE2-NH2 3.09Å
549	L	96.4	Very high	92.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61	-44.1	170.9	-77.5	167.9	0	0	0	111.7	E504 L507 L508 V511 A545 Y546 L551 L552 R553 F565	E504-L549 HydrophobicContact CB-CD2 4.48Å; E504-L549 HydrophobicContact CG-CD2 3.96Å; L507-L549 HydrophobicContact CB-CD1 4.15Å; L507-L549 HydrophobicContact CB-CD2 3.65Å; L507-L549 HydrophobicContact CB-CG 3.66Å; L507-L549 HydrophobicContact CD1-CD2 4.18Å; L507-L549 HydrophobicContact CD1-CG 4.16Å; L508-L549 HydrophobicContact CD2-CD1 4.08Å; L508-L549 HydrophobicContact CD2-CD2 4.18Å; L508-L549 HydrophobicContact CG-CD2 4.05Å; V511-L549 HydrophobicContact CG1-CD1 4.12Å; V511-L549 HydrophobicContact CG2-CD1 4.12Å; A545-L549 WeakPolarHBondContact O-CB 3.25Å; A545-L549 VanDerWaalsContact O-CG 3.31Å; A545-L549 WeakPolarHBondContact O-CG 3.5Å; A545-L549 PolarHBondContact O-N 3.49Å; Y546-L549 PolarHBondContact O-N 3.37Å; L549-L551 VanDerWaalsContact C-N 3.31Å; L549-L551 PolarHBondContact O-N 3.17Å; L549-L552 PolarHBondContact O-N 3.14Å; L549-R553 WeakPolarHBondContact O-CG 3.12Å; L549-R553 PolarHBondContact O-N 3.3Å; L549-F565 HydrophobicContact CB-CD1 4.32Å; L549-F565 HydrophobicContact CB-CD2 3.74Å; L549-F565 HydrophobicContact CB-CE1 4.43Å; L549-F565 HydrophobicContact CB-CE2 3.87Å; L549-F565 HydrophobicContact CB-CG 3.96Å; L549-F565 HydrophobicContact CB-CZ 4.21Å; L549-F565 HydrophobicContact CD1-CD1 4.35Å; L549-F565 HydrophobicContact CD1-CE1 4Å; L549-F565 HydrophobicContact CD1-CZ 4.15Å
550	A	95	Very high	92.7	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-61.2	-41.9	177.4	0	0	0	0	0	111.4	Y546 L547 R553 L554 A562 F565 V566 L588	Y546-A550 WeakPolarHBondContact O-CB 3.5Å; Y546-A550 PolarHBondContact O-N 3.46Å; L547-A550 WeakPolarHBondContact O-CB 3.44Å; L547-A550 PolarHBondContact O-N 2.9Å; A550-R553 PolarHBondContact O-N 3.06Å; A550-L554 WeakPolarHBondContact O-CB 3.22Å; A550-L554 PolarHBondContact O-N 3.28Å; A550-A562 WeakPolarHBondContact O-CB 3.25Å; A550-F565 HydrophobicContact CB-CB 3.7Å; A550-V566 HydrophobicContact CB-CG2 3.95Å; A550-L588 HydrophobicContact CB-CD2 3.45Å; A550-L588 VanDerWaalsContact CB-CD2 3.45Å
551	L	92.7	Very high	92.6	Very high	19 Å²	19	35.8 Å²	35.8	10%	0.099	18%	0.181	C	C	.	.	H	α-helix	trans	-62.5	-48.4	174.7	-74.2	163.6	0	0	0	112.1	L547 E548 L549 R553 L554 D555 L588	L547-L551 HydrophobicContact CD1-CD1 4.23Å; L547-L551 HydrophobicContact CG-CD1 4.29Å; L547-L551 WeakPolarHBondContact O-CG 3.43Å; L547-L551 PolarHBondContact O-N 3.11Å; E548-L551 PolarHBondContact O-N 3.29Å; E548-L551 WeakPolarHBondContact OE2-CD1 3.45Å; L549-L551 VanDerWaalsContact C-N 3.31Å; L549-L551 PolarHBondContact O-N 3.17Å; L551-R553 VanDerWaalsContact C-N 3.28Å; L551-R553 PolarHBondContact O-N 2.83Å; L551-L554 PolarHBondContact O-N 3.03Å; L551-D555 WeakPolarHBondContact O-CB 3.47Å; L551-D555 PolarHBondContact O-N 3.31Å; L551-L588 HydrophobicContact CD2-CD1 3.84Å; L551-L588 HydrophobicContact CD2-CD2 4.34Å; L551-L588 HydrophobicContact CG-CD1 4.5Å; L551-L588 HydrophobicContact CG-CD2 4.21Å
552	L	93.5	Very high	92.5	Very high	7 Å²	7	35.8 Å²	35.8	4%	0.037	18%	0.181	C	C	.	.	H	α-helix	trans	-58.9	-39.4	177.2	-74.4	176.1	0	0	0	112.4	K495 P500 A503 E504 L507 E548 L549 S556	K495-L552 HydrophobicContact CB-CD2 4.28Å; K495-L552 HydrophobicContact CD-CD2 3.77Å; K495-L552 HydrophobicContact CD-CG 4.47Å; K495-L552 HydrophobicContact CG-CD2 3.73Å; P500-L552 HydrophobicContact CB-CD2 4.06Å; A503-L552 HydrophobicContact CB-CD1 4.16Å; E504-L552 HydrophobicContact CB-CD1 4.05Å; L507-L552 HydrophobicContact CD1-CD1 3.64Å; E548-L552 WeakPolarHBondContact O-CG 3.5Å; E548-L552 PolarHBondContact O-N 2.62Å; L549-L552 PolarHBondContact O-N 3.14Å; L552-S556 WeakPolarHBondContact O-CB 3.37Å; L552-S556 PolarHBondContact O-N 3.43Å; L552-S556 VanDerWaalsContact O-N 3.11Å; L552-S556 PolarHBondContact O-OG 3.38Å
553	R	93.1	Very high	92.6	Very high	44 Å²	44	40.8 Å²	40.8	17%	0.166	20%	0.203	C	C	.	.	H	α-helix	trans	-69.9	-39.2	176.9	-71.2	-51	-165.6	-163.3	2.8	112.5	E504 L549 A550 L551 S556 K557 K558 L561 A562 F565	E504-R553 IonicContact OE1-CZ 3.32Å; E504-R553 IonicContact OE1-NE 3.01Å; E504-R553 PolarHBondContact OE1-NE 3.34Å; E504-R553 IonicContact OE1-NH1 2.76Å; E504-R553 PolarHBondContact OE1-NH1 2.82Å; E504-R553 IonicContact OE1-NH2 2.75Å; E504-R553 PolarHBondContact OE1-NH2 3.45Å; E504-R553 IonicContact OE2-CZ 3.81Å; E504-R553 IonicContact OE2-NE 3.7Å; E504-R553 IonicContact OE2-NH1 3.35Å; E504-R553 PolarHBondContact OE2-NH1 3.44Å; E504-R553 IonicContact OE2-NH2 3.63Å; E504-R553 PolarHBondContact OE2-NH2 2.86Å; L549-R553 WeakPolarHBondContact O-CG 3.12Å; L549-R553 PolarHBondContact O-N 3.3Å; A550-R553 PolarHBondContact O-N 3.06Å; L551-R553 VanDerWaalsContact C-N 3.28Å; L551-R553 PolarHBondContact O-N 2.83Å; R553-S556 CarbonylContact O-C 3.55Å; R553-S556 PolarHBondContact O-N 2.95Å; R553-K557 PolarHBondContact O-N 3.05Å; R553-K558 HydrophobicContact CB-CB 4.44Å; R553-K558 PolarHBondContact O-N 3.04Å; R553-L561 HydrophobicContact CB-CB 4.3Å; R553-L561 HydrophobicContact CG-CB 4.05Å; R553-A562 HydrophobicContact CB-CB 4.12Å; R553-F565 HydrophobicContact CG-CD2 3.98Å; R553-F565 HydrophobicContact CG-CE2 3.74Å
554	L	90.3	Very high	92.6	Very high	9 Å²	9	45.6 Å²	45.6	5%	0.047	23%	0.228	C	C	.	.	H	α-helix	trans	-63.9	-45.2	174.2	-175.1	63.8	0	0	0	111.5	A550 L551 S556 K557 A562 L588 R591 I592 L595	A550-L554 WeakPolarHBondContact O-CB 3.22Å; A550-L554 PolarHBondContact O-N 3.28Å; L551-L554 PolarHBondContact O-N 3.03Å; L554-S556 PolarHBondContact O-N 3.12Å; L554-K557 WeakPolarHBondContact O-CA 3.44Å; L554-K557 PolarHBondContact O-N 3.48Å; L554-A562 HydrophobicContact CB-CB 4.21Å; L554-L588 HydrophobicContact CB-CD1 4.17Å; L554-L588 HydrophobicContact CD2-CD1 3.25Å; L554-L588 HydrophobicContact CG-CD1 4.3Å; L554-R591 HydrophobicContact CD2-CB 3.99Å; L554-I592 HydrophobicContact CD1-CG1 3.8Å; L554-I592 HydrophobicContact CD2-CG1 4.26Å; L554-L595 HydrophobicContact CD1-CD1 3.46Å; L554-L595 VanDerWaalsContact CD1-CD1 3.46Å
555	D	88.8	Confident	92.5	Very high	92 Å²	92	47.1 Å²	47.1	49%	0.492	24%	0.235	S	C	.	.	H	α-helix	trans	-60.8	-29.1	177.1	-65.5	-18.5	0	0	0	111.2	L551 K557 R591	L551-D555 WeakPolarHBondContact O-CB 3.47Å; L551-D555 PolarHBondContact O-N 3.31Å; D555-K557 VanDerWaalsContact C-N 3.28Å; D555-K557 PolarHBondContact O-N 3.36Å; D555-R591 IonicContact OD1-NH2 3.84Å
556	S	89.2	Confident	92.3	Very high	60 Å²	60	47.2 Å²	47.2	42%	0.42	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	10.3	172.4	-54.1	0	0	0	0	114.4	L552 R553 L554 K558	L552-S556 WeakPolarHBondContact O-CB 3.37Å; L552-S556 PolarHBondContact O-N 3.43Å; L552-S556 VanDerWaalsContact O-N 3.11Å; L552-S556 PolarHBondContact O-OG 3.38Å; R553-S556 CarbonylContact O-C 3.55Å; R553-S556 PolarHBondContact O-N 2.95Å; L554-S556 PolarHBondContact O-N 3.12Å; S556-K558 VanDerWaalsContact C-N 3.27Å; S556-K558 PolarHBondContact O-N 2.98Å
557	K	88.3	Confident	92.2	Very high	188 Å²	188	52.1 Å²	52.1	82%	0.817	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	28.9	-176.2	-55.8	-174.9	178.7	-176	0	115.1	R553 L554 D555	R553-K557 PolarHBondContact O-N 3.05Å; L554-K557 WeakPolarHBondContact O-CA 3.44Å; L554-K557 PolarHBondContact O-N 3.48Å; D555-K557 VanDerWaalsContact C-N 3.28Å; D555-K557 PolarHBondContact O-N 3.36Å
558	K	89.2	Confident	92.1	Very high	100 Å²	100	56 Å²	56	44%	0.435	28%	0.275	S	S	.	.			trans	-104.1	71.9	176.6	-61.2	-174.8	-175.3	177.9	0	110.6	R553 S556 D560 L561 A562	R553-K558 HydrophobicContact CB-CB 4.44Å; R553-K558 PolarHBondContact O-N 3.04Å; S556-K558 VanDerWaalsContact C-N 3.27Å; S556-K558 PolarHBondContact O-N 2.98Å; K558-D560 PolarHBondContact O-N 3.11Å; K558-L561 HydrophobicContact CB-CB 4.35Å; K558-L561 HydrophobicContact CB-CD1 4.26Å; K558-L561 HydrophobicContact CB-CG 4.49Å; K558-L561 HydrophobicContact CD-CD1 3.87Å; K558-L561 PolarHBondContact O-N 3.42Å; K558-A562 PolarHBondContact O-N 2.95Å; K558-A562 VanDerWaalsContact O-N 3.09Å
559	S	89.5	Confident	91.8	Very high	36 Å²	36	55.9 Å²	55.9	25%	0.252	28%	0.275	S	S	.	.	H	α-helix	trans	-58.6	-42.2	-173.9	51.8	0	0	0	0	113.5	L561 A562 K563	S559-L561 PolarHBondContact O-N 3.38Å; S559-A562 WeakPolarHBondContact O-CB 3.5Å; S559-A562 PolarHBondContact O-N 3.32Å; S559-K563 WeakPolarHBondContact O-CG 3.5Å; S559-K563 PolarHBondContact O-N 3.2Å
560	D	90.6	Very high	91.5	Very high	111 Å²	111	59.4 Å²	59.4	59%	0.594	29%	0.29	S	S	*	.	H	α-helix	trans	-63.4	-40.7	-179.8	-64.1	-35.8	0	0	0	112.9	K558 K563 N564	K558-D560 PolarHBondContact O-N 3.11Å; D560-K563 PolarHBondContact O-N 3.21Å; D560-N564 PolarHBondContact O-N 2.96Å; D560-N564 VanDerWaalsContact O-N 3.14Å; D560-N564 PolarHBondContact O-ND2 2.78Å
561	L	90.8	Very high	91.2	Very high	72 Å²	72	63.3 Å²	63.3	38%	0.377	31%	0.308	S	S	.	.	H	α-helix	trans	-69	-37.1	175.6	-64	-177.4	0	0	0	111.4	R553 K558 S559 N564 F565	R553-L561 HydrophobicContact CB-CB 4.3Å; R553-L561 HydrophobicContact CG-CB 4.05Å; K558-L561 HydrophobicContact CB-CB 4.35Å; K558-L561 HydrophobicContact CB-CD1 4.26Å; K558-L561 HydrophobicContact CB-CG 4.49Å; K558-L561 HydrophobicContact CD-CD1 3.87Å; K558-L561 PolarHBondContact O-N 3.42Å; S559-L561 PolarHBondContact O-N 3.38Å; L561-N564 PolarHBondContact O-N 2.89Å; L561-F565 WeakPolarHBondContact O-CD2 3.34Å; L561-F565 PolarHBondContact O-N 3.25Å; L561-F565 VanDerWaalsContact O-N 3.17Å
562	A	93.1	Very high	91	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61.2	-45.1	173.9	0	0	0	0	0	111.2	A550 R553 L554 K558 S559 N564 F565 V566 I592	A550-A562 WeakPolarHBondContact O-CB 3.25Å; R553-A562 HydrophobicContact CB-CB 4.12Å; L554-A562 HydrophobicContact CB-CB 4.21Å; K558-A562 PolarHBondContact O-N 2.95Å; K558-A562 VanDerWaalsContact O-N 3.09Å; S559-A562 WeakPolarHBondContact O-CB 3.5Å; S559-A562 PolarHBondContact O-N 3.32Å; A562-N564 VanDerWaalsContact C-N 3.33Å; A562-N564 PolarHBondContact O-N 3.27Å; A562-F565 PolarHBondContact O-N 3.46Å; A562-V566 WeakPolarHBondContact O-CG2 3.38Å; A562-V566 PolarHBondContact O-N 3.03Å; A562-I592 HydrophobicContact CB-CD1 3.84Å; A562-I592 HydrophobicContact CB-CG1 4.48Å
563	K	93.5	Very high	90.6	Very high	105 Å²	105	71.4 Å²	71.4	46%	0.457	34%	0.342	S	S	.	.	H	α-helix	trans	-56.3	-44.1	174.9	-72	179.2	-177.2	174.3	0	112.2	S559 D560 F565 V566 Q567 I592	S559-K563 WeakPolarHBondContact O-CG 3.5Å; S559-K563 PolarHBondContact O-N 3.2Å; D560-K563 PolarHBondContact O-N 3.21Å; K563-F565 PolarHBondContact O-N 3.45Å; K563-V566 PolarHBondContact O-N 3.35Å; K563-Q567 PolarHBondContact O-N 3.42Å; K563-I592 HydrophobicContact CD-CG2 3.97Å; K563-I592 HydrophobicContact CG-CD1 4.3Å; K563-I592 HydrophobicContact CG-CG2 3.63Å
564	N	93.2	Very high	90.2	Very high	101 Å²	101	72.6 Å²	72.6	54%	0.54	37%	0.369	S	S	.	.	H	α-helix	trans	-60.8	-44	178.3	-72.4	-24.8	0	0	0	112.1	D560 L561 A562 Q567 K568	D560-N564 PolarHBondContact O-N 2.96Å; D560-N564 VanDerWaalsContact O-N 3.14Å; D560-N564 PolarHBondContact O-ND2 2.78Å; L561-N564 PolarHBondContact O-N 2.89Å; A562-N564 VanDerWaalsContact C-N 3.33Å; A562-N564 PolarHBondContact O-N 3.27Å; N564-Q567 PolarHBondContact O-N 3.4Å; N564-K568 WeakPolarHBondContact O-CG 3.39Å; N564-K568 PolarHBondContact O-N 3.19Å
565	F	94.2	Very high	90.1	Very high	36 Å²	36	72.8 Å²	72.8	16%	0.158	37%	0.369	C	S	.	.	H	α-helix	trans	-69.6	-36	177.1	-70.4	-46.3	0	0	0	113	L508 Y546 L549 A550 R553 L561 A562 K563 Q567 K568 A569	L508-F565 HydrophobicContact CD2-CZ 4.26Å; Y546-F565 AromaticContact CD1-CD1 3.66Å; Y546-F565 HydrophobicContact CD1-CD1 3.66Å; Y546-F565 HydrophobicContact CD1-CE1 4.34Å; Y546-F565 HydrophobicContact CD1-CG 4.48Å; Y546-F565 HydrophobicContact CE1-CD1 4Å; Y546-F565 HydrophobicContact CE1-CE1 4.37Å; L549-F565 HydrophobicContact CB-CD1 4.32Å; L549-F565 HydrophobicContact CB-CD2 3.74Å; L549-F565 HydrophobicContact CB-CE1 4.43Å; L549-F565 HydrophobicContact CB-CE2 3.87Å; L549-F565 HydrophobicContact CB-CG 3.96Å; L549-F565 HydrophobicContact CB-CZ 4.21Å; L549-F565 HydrophobicContact CD1-CD1 4.35Å; L549-F565 HydrophobicContact CD1-CE1 4Å; L549-F565 HydrophobicContact CD1-CZ 4.15Å; A550-F565 HydrophobicContact CB-CB 3.7Å; R553-F565 HydrophobicContact CG-CD2 3.98Å; R553-F565 HydrophobicContact CG-CE2 3.74Å; L561-F565 WeakPolarHBondContact O-CD2 3.34Å; L561-F565 PolarHBondContact O-N 3.25Å; L561-F565 VanDerWaalsContact O-N 3.17Å; A562-F565 PolarHBondContact O-N 3.46Å; K563-F565 PolarHBondContact O-N 3.45Å; F565-Q567 VanDerWaalsContact C-N 3.35Å; F565-Q567 PolarHBondContact O-N 2.99Å; F565-K568 PolarHBondContact O-N 2.99Å; F565-A569 PolarHBondContact O-N 2.68Å
566	V	92.3	Very high	90.1	Very high	2 Å²	2	70.5 Å²	70.5	1%	0.012	36%	0.357	C	S	.	.	H	α-helix	trans	-57.8	-48.8	171.2	168.6	0	0	0	0	110.7	A550 A562 K563 K568 A569 K570 L585 L588 E589 I592	A550-V566 HydrophobicContact CB-CG2 3.95Å; A562-V566 WeakPolarHBondContact O-CG2 3.38Å; A562-V566 PolarHBondContact O-N 3.03Å; K563-V566 PolarHBondContact O-N 3.35Å; V566-K568 VanDerWaalsContact C-N 3.29Å; V566-K568 PolarHBondContact O-N 3.39Å; V566-A569 PolarHBondContact O-N 3.08Å; V566-K570 HydrophobicContact CG1-CD 4.38Å; V566-K570 WeakPolarHBondContact O-CG 3.45Å; V566-K570 PolarHBondContact O-N 2.94Å; V566-K570 VanDerWaalsContact O-N 3.13Å; V566-L585 HydrophobicContact CB-CD2 4.4Å; V566-L585 HydrophobicContact CG1-CD2 4.24Å; V566-L585 HydrophobicContact CG2-CD2 4.17Å; V566-L588 HydrophobicContact CG2-CD2 3.64Å; V566-L588 HydrophobicContact CG2-CG 4.04Å; V566-E589 HydrophobicContact CG1-CG 3.73Å; V566-E589 WeakPolarHBondContact CG1-OE1 3.49Å; V566-I592 HydrophobicContact CG2-CD1 4.3Å
567	Q	91.8	Very high	90	Very high	111 Å²	111	68.1 Å²	68.1	52%	0.519	34%	0.339	S	S	.	.	H	α-helix	trans	-61.5	-40.6	179.4	-174.2	58.4	28.5	0	0	111.3	K563 N564 F565 K570 E571	K563-Q567 PolarHBondContact O-N 3.42Å; N564-Q567 PolarHBondContact O-N 3.4Å; F565-Q567 VanDerWaalsContact C-N 3.35Å; F565-Q567 PolarHBondContact O-N 2.99Å; Q567-K570 PolarHBondContact O-N 3.41Å; Q567-E571 PolarHBondContact O-N 3.16Å
568	K	92	Very high	89.8	Confident	80 Å²	80	61.5 Å²	61.5	35%	0.348	31%	0.311	S	S	.	.	H	α-helix	trans	-63.3	-42.7	175.2	-72.6	-74.3	163.7	-148.9	0	112.7	Y546 N564 F565 V566 K570 E571 F572	Y546-K568 HydrophobicContact CD1-CB 3.66Å; Y546-K568 HydrophobicContact CD1-CG 4.48Å; Y546-K568 HydrophobicContact CD2-CB 4.3Å; Y546-K568 HydrophobicContact CE1-CB 3.6Å; Y546-K568 HydrophobicContact CE1-CG 4.04Å; Y546-K568 HydrophobicContact CE2-CB 4.27Å; Y546-K568 HydrophobicContact CG-CB 4Å; N564-K568 WeakPolarHBondContact O-CG 3.39Å; N564-K568 PolarHBondContact O-N 3.19Å; F565-K568 PolarHBondContact O-N 2.99Å; V566-K568 VanDerWaalsContact C-N 3.29Å; V566-K568 PolarHBondContact O-N 3.39Å; K568-K570 VanDerWaalsContact C-N 3.25Å; K568-K570 PolarHBondContact O-N 3.31Å; K568-E571 IonicContact NZ-OE1 2.59Å; K568-E571 PolarHBondContact NZ-OE1 3.45Å; K568-E571 IonicContact NZ-OE2 3.06Å; K568-E571 PolarHBondContact NZ-OE2 3.27Å; K568-E571 WeakPolarHBondContact O-CB 3.44Å; K568-E571 PolarHBondContact O-N 2.84Å; K568-F572 VanDerWaalsContact O-CD2 3.26Å; K568-F572 WeakPolarHBondContact O-CD2 3.42Å; K568-F572 WeakPolarHBondContact O-CE2 3.37Å
569	A	91.4	Very high	89.4	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-60.2	-36.7	176.5	0	0	0	0	0	112.1	F565 V566 E571 F572 L585	F565-A569 PolarHBondContact O-N 2.68Å; V566-A569 PolarHBondContact O-N 3.08Å; A569-E571 VanDerWaalsContact C-N 3.3Å; A569-E571 PolarHBondContact O-N 3.32Å; A569-F572 PolarHBondContact O-N 3.49Å; A569-L585 HydrophobicContact CB-CD1 3.75Å; A569-L585 HydrophobicContact CB-CD2 3.76Å; A569-L585 HydrophobicContact CB-CG 4.39Å
570	K	88.4	Confident	89.1	Confident	75 Å²	75	60.3 Å²	60.3	33%	0.326	31%	0.306	S	S	.	.	H	α-helix	trans	-72	-15.5	178.2	-70.4	-179.6	171.6	-173.2	0	114.9	V566 Q567 K568 F572 L585 E589	V566-K570 HydrophobicContact CG1-CD 4.38Å; V566-K570 WeakPolarHBondContact O-CG 3.45Å; V566-K570 PolarHBondContact O-N 2.94Å; V566-K570 VanDerWaalsContact O-N 3.13Å; Q567-K570 PolarHBondContact O-N 3.41Å; K568-K570 VanDerWaalsContact C-N 3.25Å; K568-K570 PolarHBondContact O-N 3.31Å; K570-F572 PolarHBondContact O-N 2.97Å; K570-L585 HydrophobicContact CG-CD1 4.02Å; K570-E589 WeakPolarHBondContact CE-OE1 3.44Å; K570-E589 IonicContact NZ-OE1 3.63Å; K570-E589 PolarHBondContact NZ-OE1 3.48Å; K570-E589 IonicContact NZ-OE2 3.97Å; K570-E589 PolarHBondContact NZ-OE2 3.24Å
571	E	89.1	Confident	88.8	Confident	81 Å²	81	55.1 Å²	55.1	38%	0.379	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-23.8	175.4	-68.7	175.2	-163.8	0	0	111.8	R531 Q567 K568 A569	R531-E571 IonicContact NH2-OE2 3.96Å; Q567-E571 PolarHBondContact O-N 3.16Å; K568-E571 IonicContact NZ-OE1 2.59Å; K568-E571 PolarHBondContact NZ-OE1 3.45Å; K568-E571 IonicContact NZ-OE2 3.06Å; K568-E571 PolarHBondContact NZ-OE2 3.27Å; K568-E571 WeakPolarHBondContact O-CB 3.44Å; K568-E571 PolarHBondContact O-N 2.84Å; A569-E571 VanDerWaalsContact C-N 3.3Å; A569-E571 PolarHBondContact O-N 3.32Å
572	F	87.8	Confident	88.4	Confident	22 Å²	22	55.4 Å²	55.4	10%	0.096	28%	0.277	C	S	.	.			trans	-82.2	142.2	179.8	-62.8	-98	0	0	0	111.3	Q533 A542 P543 Y546 K568 A569 K570 Y575	Q533-F572 VanDerWaalsContact NE2-CE1 3.3Å; A542-F572 HydrophobicContact CB-CD1 4.04Å; A542-F572 HydrophobicContact CB-CE1 3.4Å; A542-F572 HydrophobicContact CB-CE2 4.49Å; A542-F572 HydrophobicContact CB-CZ 3.68Å; P543-F572 HydrophobicContact CB-CB 3.98Å; P543-F572 HydrophobicContact CB-CD2 4.16Å; P543-F572 HydrophobicContact CB-CG 4.1Å; P543-F572 HydrophobicContact CG-CB 4.07Å; P543-F572 HydrophobicContact CG-CG 4.25Å; Y546-F572 HydrophobicContact CD2-CD2 4.49Å; Y546-F572 AromaticContact CD2-CE2 3.63Å; Y546-F572 HydrophobicContact CD2-CE2 3.63Å; Y546-F572 HydrophobicContact CD2-CZ 4.18Å; Y546-F572 AromaticContact CE2-CE2 3.51Å; Y546-F572 HydrophobicContact CE2-CE2 3.51Å; Y546-F572 AromaticContact CE2-CZ 3.75Å; Y546-F572 HydrophobicContact CE2-CZ 3.75Å; K568-F572 VanDerWaalsContact O-CD2 3.26Å; K568-F572 WeakPolarHBondContact O-CD2 3.42Å; K568-F572 WeakPolarHBondContact O-CE2 3.37Å; A569-F572 PolarHBondContact O-N 3.49Å; K570-F572 PolarHBondContact O-N 2.97Å; F572-Y575 HydrophobicContact CB-CD1 4.09Å; F572-Y575 HydrophobicContact CB-CE1 3.8Å
573	K	86.2	Confident	87.7	Confident	174 Å²	174	59 Å²	59	76%	0.757	29%	0.293	S	S	*	.			trans	-144.3	155.3	179.6	-62.4	-175.7	-178.7	175.9	0	111.1	Y575	K573-Y575 PolarHBondContact O-N 3.28Å
574	G	83.5	Confident	87.3	Confident	70 Å²	70	55.6 Å²	55.6	72%	0.722	28%	0.277	S	S	*	.	S	Bend	trans	76.8	18.2	170	0	0	0	0	0	114.9	E578	G574-E578 WeakPolarHBondContact CA-OE2 3.33Å; G574-E578 PolarHBondContact N-OE2 2.94Å
575	Y	88.2	Confident	87	Confident	12 Å²	12	50.8 Å²	50.8	5%	0.047	25%	0.252	C	S	.	.			trans	-94.4	160.5	177.4	57.9	-86.8	0	0	0	111.6	T539 P543 F572 K573 E578 V581	T539-Y575 WeakPolarHBondContact OG1-CB 3.48Å; P543-Y575 HydrophobicContact CB-CE1 4.12Å; P543-Y575 HydrophobicContact CB-CE2 4.24Å; P543-Y575 HydrophobicContact CG-CD1 3.96Å; P543-Y575 HydrophobicContact CG-CD2 3.9Å; P543-Y575 HydrophobicContact CG-CE1 3.73Å; P543-Y575 HydrophobicContact CG-CE2 3.62Å; P543-Y575 HydrophobicContact CG-CG 4.07Å; F572-Y575 HydrophobicContact CB-CD1 4.09Å; F572-Y575 HydrophobicContact CB-CE1 3.8Å; K573-Y575 PolarHBondContact O-N 3.28Å; Y575-E578 HydrophobicContact CD1-CB 4.41Å; Y575-E578 HydrophobicContact CD1-CG 4.45Å; Y575-E578 HydrophobicContact CD2-CB 4.05Å; Y575-E578 HydrophobicContact CE1-CB 4.13Å; Y575-E578 HydrophobicContact CE1-CG 3.84Å; Y575-E578 VanDerWaalsContact CE2-CA 3.4Å; Y575-E578 HydrophobicContact CE2-CB 3.79Å; Y575-E578 HydrophobicContact CE2-CG 4.22Å; Y575-E578 HydrophobicContact CG-CB 4.35Å; Y575-E578 WeakPolarHBondContact O-CB 3.29Å; Y575-E578 PolarHBondContact O-N 3.06Å; Y575-V581 HydrophobicContact CE2-CB 4.09Å; Y575-V581 HydrophobicContact CE2-CG2 3.82Å; Y575-V581 WeakPolarHBondContact OH-CB 3.31Å; Y575-V581 WeakPolarHBondContact OH-CG1 3.46Å
576	L	89.1	Confident	86.4	Confident	45 Å²	45	51.2 Å²	51.2	24%	0.236	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	140.8	178.4	-63.2	169.8	0	0	0	110.7	F417 A420 Y540 E578	F417-L576 HydrophobicContact CD2-CB 4.05Å; F417-L576 HydrophobicContact CD2-CD1 4.02Å; A420-L576 HydrophobicContact CB-CD1 3.56Å; A420-L576 HydrophobicContact CB-CD2 4.16Å; A420-L576 HydrophobicContact CB-CG 4.49Å; Y540-L576 HydrophobicContact CD1-CB 4.31Å; L576-E578 PolarHBondContact O-N 2.7Å
577	L	87.6	Confident	85.7	Confident	10 Å²	10	51.3 Å²	51.3	5%	0.052	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	26.2	-179.8	-55.2	175	0	0	0	114.6	P413 V414 F417 F442 S579 R580 V581	P413-L577 HydrophobicContact CB-CD2 4.05Å; P413-L577 WeakPolarHBondContact O-CD2 3.43Å; V414-L577 HydrophobicContact CG2-CD2 4.24Å; F417-L577 HydrophobicContact CB-CD1 4.12Å; F417-L577 HydrophobicContact CB-CD2 4.17Å; F417-L577 HydrophobicContact CB-CG 4.02Å; F417-L577 HydrophobicContact CD2-CD1 3.78Å; F417-L577 HydrophobicContact CD2-CG 4.17Å; F417-L577 HydrophobicContact CE2-CD1 4.38Å; F417-L577 HydrophobicContact CG-CD1 3.9Å; F417-L577 HydrophobicContact CG-CG 4.28Å; F442-L577 HydrophobicContact CB-CD1 3.95Å; F442-L577 HydrophobicContact CD1-CB 4.42Å; F442-L577 HydrophobicContact CD1-CD1 3.45Å; F442-L577 VanDerWaalsContact CD1-CD1 3.45Å; F442-L577 HydrophobicContact CD2-CD1 3.93Å; F442-L577 HydrophobicContact CE1-CB 4.36Å; F442-L577 HydrophobicContact CE1-CD1 3.78Å; F442-L577 HydrophobicContact CE2-CD1 4.23Å; F442-L577 HydrophobicContact CG-CD1 3.51Å; F442-L577 HydrophobicContact CZ-CD1 4.12Å; L577-S579 PolarHBondContact O-N 2.92Å; L577-R580 WeakPolarHBondContact O-CB 3.48Å; L577-R580 PolarHBondContact O-N 3.3Å; L577-V581 PolarHBondContact O-N 3.12Å
578	E	85	Confident	85.4	Confident	49 Å²	49	46.1 Å²	46.1	23%	0.229	23%	0.231	C	C	.	.	H	α-helix	trans	-51.1	-38.9	175.7	177	176.7	171.2	0	0	113.6	G574 Y575 L576 R580 V581 H582	G574-E578 WeakPolarHBondContact CA-OE2 3.33Å; G574-E578 PolarHBondContact N-OE2 2.94Å; Y575-E578 HydrophobicContact CD1-CB 4.41Å; Y575-E578 HydrophobicContact CD1-CG 4.45Å; Y575-E578 HydrophobicContact CD2-CB 4.05Å; Y575-E578 HydrophobicContact CE1-CB 4.13Å; Y575-E578 HydrophobicContact CE1-CG 3.84Å; Y575-E578 VanDerWaalsContact CE2-CA 3.4Å; Y575-E578 HydrophobicContact CE2-CB 3.79Å; Y575-E578 HydrophobicContact CE2-CG 4.22Å; Y575-E578 HydrophobicContact CG-CB 4.35Å; Y575-E578 WeakPolarHBondContact O-CB 3.29Å; Y575-E578 PolarHBondContact O-N 3.06Å; L576-E578 PolarHBondContact O-N 2.7Å; E578-R580 VanDerWaalsContact C-N 3.31Å; E578-R580 PolarHBondContact O-N 3.1Å; E578-V581 PolarHBondContact O-N 3.25Å; E578-H582 VanDerWaalsContact CG-CE1 3.45Å; E578-H582 WeakPolarHBondContact CG-CE1 3.5Å; E578-H582 PolarHBondContact O-N 3.2Å; E578-H582 IonicContact OE1-CE1 3.38Å; E578-H582 PolarHBondContact OE1-CE1 3.19Å; E578-H582 IonicContact OE1-NE2 2.75Å
579	S	80.9	Confident	85.1	Confident	49 Å²	49	44.6 Å²	44.6	34%	0.343	23%	0.225	S	C	.	.	H	α-helix	trans	-59.4	-39.4	177.5	54.8	0	0	0	0	112.9	L577 H582 F583	L577-S579 PolarHBondContact O-N 2.92Å; S579-H582 PolarHBondContact O-N 3.1Å; S579-F583 WeakPolarHBondContact O-CD2 3.39Å; S579-F583 PolarHBondContact O-N 2.95Å
580	R	81.5	Confident	84.5	Confident	61 Å²	61	47 Å²	47	23%	0.23	24%	0.236	C	C	.	.	H	α-helix	trans	-65.7	-43.1	178.8	-71.3	-174.6	174.4	-88	-0	111.4	L577 E578 H582 F583 R584	L577-R580 WeakPolarHBondContact O-CB 3.48Å; L577-R580 PolarHBondContact O-N 3.3Å; E578-R580 VanDerWaalsContact C-N 3.31Å; E578-R580 PolarHBondContact O-N 3.1Å; R580-H582 VanDerWaalsContact C-N 3.32Å; R580-H582 PolarHBondContact O-N 3.26Å; R580-F583 PolarHBondContact O-N 3.18Å; R580-R584 PolarHBondContact O-N 3.4Å; R580-R584 VanDerWaalsContact O-N 3.16Å
581	V	85	Confident	84.2	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.012	23%	0.232	C	C	.	.	H	α-helix	trans	-62.3	-42.6	175.6	176.9	0	0	0	0	110.2	P543 N544 L547 Y575 L577 E578 F583 R584 L585	P543-V581 HydrophobicContact CB-CG1 4.43Å; N544-V581 WeakPolarHBondContact OD1-CG2 3.23Å; L547-V581 HydrophobicContact CD2-CG1 4.27Å; Y575-V581 HydrophobicContact CE2-CB 4.09Å; Y575-V581 HydrophobicContact CE2-CG2 3.82Å; Y575-V581 WeakPolarHBondContact OH-CB 3.31Å; Y575-V581 WeakPolarHBondContact OH-CG1 3.46Å; L577-V581 PolarHBondContact O-N 3.12Å; E578-V581 PolarHBondContact O-N 3.25Å; V581-F583 PolarHBondContact O-N 2.86Å; V581-R584 PolarHBondContact O-N 3.16Å; V581-L585 HydrophobicContact CG1-CD1 3.76Å; V581-L585 HydrophobicContact CG1-CG 4.13Å; V581-L585 WeakPolarHBondContact O-CB 3.34Å; V581-L585 VanDerWaalsContact O-CG 3.27Å; V581-L585 WeakPolarHBondContact O-CG 3.25Å; V581-L585 PolarHBondContact O-N 3.38Å
582	H	83.2	Confident	84	Confident	78 Å²	78	42.8 Å²	42.8	36%	0.361	22%	0.215	S	C	.	.	H	α-helix	trans	-61.4	-41.2	176.8	-72.2	178.4	0	0	0	113.6	E578 S579 R580 L585 H586	E578-H582 VanDerWaalsContact CG-CE1 3.45Å; E578-H582 WeakPolarHBondContact CG-CE1 3.5Å; E578-H582 PolarHBondContact O-N 3.2Å; E578-H582 IonicContact OE1-CE1 3.38Å; E578-H582 PolarHBondContact OE1-CE1 3.19Å; E578-H582 IonicContact OE1-NE2 2.75Å; S579-H582 PolarHBondContact O-N 3.1Å; R580-H582 VanDerWaalsContact C-N 3.32Å; R580-H582 PolarHBondContact O-N 3.26Å; H582-L585 PolarHBondContact O-N 3.09Å; H582-H586 WeakPolarHBondContact O-CB 3.48Å; H582-H586 PolarHBondContact O-N 2.83Å
583	F	78.1	Confident	83.7	Confident	77 Å²	77	48.9 Å²	48.9	34%	0.338	24%	0.244	S	C	.	.	H	α-helix	trans	-61.5	-45.8	175.2	-79.3	-67.5	0	0	0	111.9	P209 L262 S579 R580 V581 H586 S587	P209-F583 HydrophobicContact CG-CE1 3.85Å; P209-F583 HydrophobicContact CG-CZ 4.29Å; L262-F583 HydrophobicContact CD2-CD1 4.36Å; L262-F583 HydrophobicContact CD2-CG 4.34Å; S579-F583 WeakPolarHBondContact O-CD2 3.39Å; S579-F583 PolarHBondContact O-N 2.95Å; R580-F583 PolarHBondContact O-N 3.18Å; V581-F583 PolarHBondContact O-N 2.86Å; F583-H586 PolarHBondContact O-N 2.65Å; F583-S587 PolarHBondContact O-N 3.3Å
584	R	85.1	Confident	83.3	Confident	32 Å²	32	45 Å²	45	12%	0.121	24%	0.244	C	C	.	.	H	α-helix	trans	-64.3	-42.6	177.7	-68.2	-177.9	69.4	-155.9	-1.4	112.2	L262 Y441 L547 E548 R580 V581 S587 L588	L262-R584 WeakPolarHBondContact O-CG 3.11Å; Y441-R584 PolarHBondContact OH-NH1 2.89Å; L547-R584 HydrophobicContact CD1-CB 3.98Å; L547-R584 HydrophobicContact CD2-CB 3.77Å; L547-R584 HydrophobicContact CD2-CG 4.45Å; E548-R584 IonicContact OE1-CZ 3.58Å; E548-R584 VanDerWaalsContact OE1-CZ 3.27Å; E548-R584 IonicContact OE1-NH1 3.93Å; E548-R584 PolarHBondContact OE1-NH1 3.06Å; E548-R584 IonicContact OE1-NH2 3.18Å; E548-R584 PolarHBondContact OE1-NH2 3.01Å; E548-R584 IonicContact OE2-NH2 3.09Å; R580-R584 PolarHBondContact O-N 3.4Å; R580-R584 VanDerWaalsContact O-N 3.16Å; V581-R584 PolarHBondContact O-N 3.16Å; R584-S587 PolarHBondContact O-N 2.89Å; R584-L588 VanDerWaalsContact O-CB 3.3Å; R584-L588 WeakPolarHBondContact O-CB 3.31Å; R584-L588 PolarHBondContact O-N 3.37Å
585	L	86.9	Confident	83	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-62.8	-42.8	175.4	-71.3	172.1	0	0	0	111.7	L547 V566 A569 K570 V581 H582 L588 E589	L547-L585 HydrophobicContact CB-CD2 4.27Å; L547-L585 HydrophobicContact CD1-CD2 3.65Å; L547-L585 HydrophobicContact CD1-CG 4.08Å; V566-L585 HydrophobicContact CB-CD2 4.4Å; V566-L585 HydrophobicContact CG1-CD2 4.24Å; V566-L585 HydrophobicContact CG2-CD2 4.17Å; A569-L585 HydrophobicContact CB-CD1 3.75Å; A569-L585 HydrophobicContact CB-CD2 3.76Å; A569-L585 HydrophobicContact CB-CG 4.39Å; K570-L585 HydrophobicContact CG-CD1 4.02Å; V581-L585 HydrophobicContact CG1-CD1 3.76Å; V581-L585 HydrophobicContact CG1-CG 4.13Å; V581-L585 WeakPolarHBondContact O-CB 3.34Å; V581-L585 VanDerWaalsContact O-CG 3.27Å; V581-L585 WeakPolarHBondContact O-CG 3.25Å; V581-L585 PolarHBondContact O-N 3.38Å; H582-L585 PolarHBondContact O-N 3.09Å; L585-L588 WeakPolarHBondContact O-CB 3.29Å; L585-L588 PolarHBondContact O-N 3.4Å; L585-E589 WeakPolarHBondContact O-CG 3.42Å; L585-E589 PolarHBondContact O-N 3.01Å
586	H	80.4	Confident	82.7	Confident	44 Å²	44	51.2 Å²	51.2	20%	0.204	26%	0.26	C	S	.	.	H	α-helix	trans	-63.2	-44.9	177.9	-178.6	51	0	0	0	112	H582 F583 L588 E589 Q590	H582-H586 WeakPolarHBondContact O-CB 3.48Å; H582-H586 PolarHBondContact O-N 2.83Å; F583-H586 PolarHBondContact O-N 2.65Å; H586-L588 VanDerWaalsContact C-N 3.26Å; H586-L588 PolarHBondContact O-N 3.13Å; H586-E589 PolarHBondContact O-N 2.76Å; H586-Q590 PolarHBondContact NE2-NE2 2.99Å; H586-Q590 PolarHBondContact O-N 3.16Å; H586-Q590 VanDerWaalsContact O-N 3.08Å
587	S	78.5	Confident	82.4	Confident	5 Å²	5	51.5 Å²	51.5	4%	0.035	26%	0.261	C	S	.	.	H	α-helix	trans	-62.1	-37.2	174.6	-175.3	0	0	0	0	112.1	T264 F583 R584 Q590 R591	T264-S587 VanDerWaalsContact CA-OG 3.25Å; T264-S587 WeakPolarHBondContact CA-OG 3.48Å; T264-S587 VanDerWaalsContact CB-OG 3.25Å; T264-S587 WeakPolarHBondContact CB-OG 3.34Å; T264-S587 WeakPolarHBondContact CG2-OG 3.44Å; F583-S587 PolarHBondContact O-N 3.3Å; R584-S587 PolarHBondContact O-N 2.89Å; S587-Q590 PolarHBondContact O-N 3.36Å; S587-R591 WeakPolarHBondContact O-CG 3.41Å; S587-R591 PolarHBondContact O-N 3.1Å; S587-R591 VanDerWaalsContact O-N 3.11Å
588	L	84.9	Confident	82.1	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-65.4	-39.8	177.2	-177.7	58	0	0	0	111.6	L547 A550 L551 L554 V566 R584 L585 H586 R591 I592	L547-L588 HydrophobicContact CD1-CD2 4.28Å; A550-L588 HydrophobicContact CB-CD2 3.45Å; A550-L588 VanDerWaalsContact CB-CD2 3.45Å; L551-L588 HydrophobicContact CD2-CD1 3.84Å; L551-L588 HydrophobicContact CD2-CD2 4.34Å; L551-L588 HydrophobicContact CG-CD1 4.5Å; L551-L588 HydrophobicContact CG-CD2 4.21Å; L554-L588 HydrophobicContact CB-CD1 4.17Å; L554-L588 HydrophobicContact CD2-CD1 3.25Å; L554-L588 HydrophobicContact CG-CD1 4.3Å; V566-L588 HydrophobicContact CG2-CD2 3.64Å; V566-L588 HydrophobicContact CG2-CG 4.04Å; R584-L588 VanDerWaalsContact O-CB 3.3Å; R584-L588 WeakPolarHBondContact O-CB 3.31Å; R584-L588 PolarHBondContact O-N 3.37Å; L585-L588 WeakPolarHBondContact O-CB 3.29Å; L585-L588 PolarHBondContact O-N 3.4Å; H586-L588 VanDerWaalsContact C-N 3.26Å; H586-L588 PolarHBondContact O-N 3.13Å; L588-R591 PolarHBondContact O-N 3.14Å; L588-I592 HydrophobicContact CD1-CD1 4.33Å; L588-I592 HydrophobicContact CG-CD1 4.01Å; L588-I592 WeakPolarHBondContact O-CB 3.46Å; L588-I592 VanDerWaalsContact O-CG1 3.23Å; L588-I592 WeakPolarHBondContact O-CG1 3.36Å; L588-I592 PolarHBondContact O-N 3.01Å
589	E	85.5	Confident	82	Confident	47 Å²	47	54.1 Å²	54.1	22%	0.22	28%	0.275	C	S	.	.	H	α-helix	trans	-62.2	-46.3	174	-72.7	178.9	139.8	0	0	112.3	V566 K570 L585 H586 R591 I592 E593	V566-E589 HydrophobicContact CG1-CG 3.73Å; V566-E589 WeakPolarHBondContact CG1-OE1 3.49Å; K570-E589 WeakPolarHBondContact CE-OE1 3.44Å; K570-E589 IonicContact NZ-OE1 3.63Å; K570-E589 PolarHBondContact NZ-OE1 3.48Å; K570-E589 IonicContact NZ-OE2 3.97Å; K570-E589 PolarHBondContact NZ-OE2 3.24Å; L585-E589 WeakPolarHBondContact O-CG 3.42Å; L585-E589 PolarHBondContact O-N 3.01Å; H586-E589 PolarHBondContact O-N 2.76Å; E589-R591 VanDerWaalsContact C-N 3.27Å; E589-R591 PolarHBondContact O-N 3.07Å; E589-I592 WeakPolarHBondContact O-CB 3.47Å; E589-I592 PolarHBondContact O-N 3.22Å; E589-E593 WeakPolarHBondContact O-CG 3.3Å; E589-E593 PolarHBondContact O-N 3.27Å
590	Q	79.6	Confident	82	Confident	52 Å²	52	54.4 Å²	54.4	24%	0.243	27%	0.271	C	S	.	.	H	α-helix	trans	-57.3	-42	176.1	-70.7	-178.1	-17.3	0	0	111.7	H586 S587 I592 E593 A594	H586-Q590 PolarHBondContact NE2-NE2 2.99Å; H586-Q590 PolarHBondContact O-N 3.16Å; H586-Q590 VanDerWaalsContact O-N 3.08Å; S587-Q590 PolarHBondContact O-N 3.36Å; Q590-I592 VanDerWaalsContact C-N 3.34Å; Q590-E593 PolarHBondContact O-N 3.23Å; Q590-A594 WeakPolarHBondContact O-CB 3.14Å; Q590-A594 PolarHBondContact O-N 3.17Å; Q590-A594 VanDerWaalsContact O-N 3.08Å
591	R	81.3	Confident	82.1	Confident	62 Å²	62	53.9 Å²	53.9	23%	0.234	27%	0.274	C	S	.	.	H	α-helix	trans	-65.5	-36.6	176	-74.5	173.4	58.8	-166.6	-4.4	112.7	E266 L554 D555 S587 L588 E589 L595	E266-R591 WeakPolarHBondContact OE1-CG 3.41Å; L554-R591 HydrophobicContact CD2-CB 3.99Å; D555-R591 IonicContact OD1-NH2 3.84Å; S587-R591 WeakPolarHBondContact O-CG 3.41Å; S587-R591 PolarHBondContact O-N 3.1Å; S587-R591 VanDerWaalsContact O-N 3.11Å; L588-R591 PolarHBondContact O-N 3.14Å; E589-R591 VanDerWaalsContact C-N 3.27Å; E589-R591 PolarHBondContact O-N 3.07Å; R591-L595 WeakPolarHBondContact O-CG 3.32Å
592	I	85.5	Confident	81.8	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-70.2	-37.2	176.9	-73.1	166.4	0	0	0	111.2	L554 A562 K563 V566 L588 E589 Q590 A594	L554-I592 HydrophobicContact CD1-CG1 3.8Å; L554-I592 HydrophobicContact CD2-CG1 4.26Å; A562-I592 HydrophobicContact CB-CD1 3.84Å; A562-I592 HydrophobicContact CB-CG1 4.48Å; K563-I592 HydrophobicContact CD-CG2 3.97Å; K563-I592 HydrophobicContact CG-CD1 4.3Å; K563-I592 HydrophobicContact CG-CG2 3.63Å; V566-I592 HydrophobicContact CG2-CD1 4.3Å; L588-I592 HydrophobicContact CD1-CD1 4.33Å; L588-I592 HydrophobicContact CG-CD1 4.01Å; L588-I592 WeakPolarHBondContact O-CB 3.46Å; L588-I592 VanDerWaalsContact O-CG1 3.23Å; L588-I592 WeakPolarHBondContact O-CG1 3.36Å; L588-I592 PolarHBondContact O-N 3.01Å; E589-I592 WeakPolarHBondContact O-CB 3.47Å; E589-I592 PolarHBondContact O-N 3.22Å; Q590-I592 VanDerWaalsContact C-N 3.34Å; I592-A594 VanDerWaalsContact C-N 3.32Å
593	E	82.6	Confident	81.7	Confident	151 Å²	151	56.1 Å²	56.1	71%	0.706	29%	0.287	S	S	*	.	H	α-helix	trans	-72	-26.1	178	-72.7	173.2	-179.7	0	0	112.9	E589 Q590	E589-E593 WeakPolarHBondContact O-CG 3.3Å; E589-E593 PolarHBondContact O-N 3.27Å; Q590-E593 PolarHBondContact O-N 3.23Å
594	A	76.9	Confident	82	Confident	91 Å²	91	54.3 Å²	54.3	75%	0.752	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-11.6	177.7	0	0	0	0	0	114.5	Q590 I592	Q590-A594 WeakPolarHBondContact O-CB 3.14Å; Q590-A594 PolarHBondContact O-N 3.17Å; Q590-A594 VanDerWaalsContact O-N 3.08Å; I592-A594 VanDerWaalsContact C-N 3.32Å
595	L	77.3	Confident	81.8	Confident	161 Å²	161	56.4 Å²	56.4	84%	0.843	30%	0.297	S	S	*	.			trans	-92.6	0	174.6	-69.6	174.5	0	0	0	110.9	L554 R591	L554-L595 HydrophobicContact CD1-CD1 3.46Å; L554-L595 VanDerWaalsContact CD1-CD1 3.46Å; R591-L595 WeakPolarHBondContact O-CG 3.32Å

Retrieved 595 of 595 residues in 1180.2 ms (Link to these results)

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